COC(=O)c1cccc([N+](=O)[O-])c1I ZINC000000157922 44/12/96/277441296 CMCWXWQXFLAUFM-UHFFFAOYSA-N 0 307.043 DD 1.986 0 Bother ref DDBARN COC(=O)c1cccc([N+](=O)[O-])c1I CCOC(=O)Cn1nc(Br)nc1Br ZINC000001406243 66/90/78/406669078 FUFDVZGJGRFZMP-UHFFFAOYSA-N 0 312.949 DD 1.366 0 Anodyne ref DDAARN CCOC(=O)Cn1nc(Br)nc1Br COc1cccc([C@@H]2N[C@H](C(=O)O)Cc3[nH]cnc32)c1OC ZINC000003849197 04/90/93/181049093 KNJCOIITJWUYDR-JQWIXIFHSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1cccc([C@@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c1OC COc1cccc([C@@H]2N[C@H](C(=O)O)Cc3[nH]cnc32)c1OC ZINC000003849197 04/90/91/181049091 KNJCOIITJWUYDR-JQWIXIFHSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1cccc([C@@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c1OC COc1cccc([C@H]2N[C@H](C(=O)O)Cc3[nH]cnc32)c1OC ZINC000003849201 04/89/89/181048989 KNJCOIITJWUYDR-CMPLNLGQSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1cccc([C@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c1OC COc1cccc([C@H]2N[C@H](C(=O)O)Cc3[nH]cnc32)c1OC ZINC000003849201 04/89/88/181048988 KNJCOIITJWUYDR-CMPLNLGQSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1cccc([C@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c1OC CC(C)(C)OC(=O)N(CCC(=O)O)CCN1CCOCC1 ZINC000005066712 03/61/27/333036127 OLULJKIDTAQURJ-UHFFFAOYSA-N 0 302.371 DD 1.03 2 Anodyne low DDAALN CC(C)(C)OC(=O)N(CCC(=O)[O-])CC[NH+]1CCOCC1 CC(C)(C)OC(=O)N(CCC(=O)O)CCN1CCOCC1 ZINC000005066712 03/61/24/333036124 OLULJKIDTAQURJ-UHFFFAOYSA-N -1 302.371 DD 1.03 0 Anodyne ref DDAARM CC(C)(C)OC(=O)N(CCC(=O)[O-])CCN1CCOCC1 COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066895 19/96/85/181199685 QLXYKLYIOUFPQC-DGCLKSJQSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)c(OC)c1 COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066895 19/96/82/181199682 QLXYKLYIOUFPQC-DGCLKSJQSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)c(OC)c1 COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066899 19/95/93/181199593 QLXYKLYIOUFPQC-YPMHNXCESA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)c(OC)c1 COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066899 19/95/92/181199592 QLXYKLYIOUFPQC-YPMHNXCESA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)c(OC)c1 COc1ccc([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066903 20/00/01/181200001 QLXYKLYIOUFPQC-WCQYABFASA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c(OC)c1 COc1ccc([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066903 19/99/98/181199998 QLXYKLYIOUFPQC-WCQYABFASA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c(OC)c1 COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066907 20/00/20/181200020 QLXYKLYIOUFPQC-AAEUAGOBSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c(OC)c1 COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c(OC)c1 ZINC000005066907 20/00/19/181200019 QLXYKLYIOUFPQC-AAEUAGOBSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c(OC)c1 COc1ccc(OC)c([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066936 19/99/35/181199935 KZBHVOAPLYGIMA-DGCLKSJQSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc(OC)c([C@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)c1 COc1ccc(OC)c([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066936 19/99/33/181199933 KZBHVOAPLYGIMA-DGCLKSJQSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc(OC)c([C@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)c1 COc1ccc(OC)c([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066942 19/95/44/181199544 KZBHVOAPLYGIMA-YPMHNXCESA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc(OC)c([C@@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)c1 COc1ccc(OC)c([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066942 19/95/42/181199542 KZBHVOAPLYGIMA-YPMHNXCESA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc(OC)c([C@@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)c1 COc1ccc(OC)c([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066949 19/96/66/181199666 KZBHVOAPLYGIMA-WCQYABFASA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc(OC)c([C@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c1 COc1ccc(OC)c([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066949 19/96/64/181199664 KZBHVOAPLYGIMA-WCQYABFASA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc(OC)c([C@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c1 COc1ccc(OC)c([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066955 18/16/20/295181620 KZBHVOAPLYGIMA-AAEUAGOBSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc(OC)c([C@@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)c1 COc1ccc(OC)c([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)c1 ZINC000005066955 18/16/09/295181609 KZBHVOAPLYGIMA-AAEUAGOBSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc(OC)c([C@@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)c1 COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067084 19/97/71/181199771 HYRCYYCLHCGDCJ-ZWNOBZJWSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067084 19/97/68/181199768 HYRCYYCLHCGDCJ-ZWNOBZJWSA-N 0 303.318 DD 1.115 1 Anodyne mid DDAAMN COc1ccc([C@H]2[NH2+][C@@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067084 19/97/64/181199764 HYRCYYCLHCGDCJ-ZWNOBZJWSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)cc1OC COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067092 19/94/76/181199476 HYRCYYCLHCGDCJ-MFKMUULPSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@@H]2N[C@@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067092 19/94/75/181199475 HYRCYYCLHCGDCJ-MFKMUULPSA-N 0 303.318 DD 1.115 1 Anodyne mid DDAAMN COc1ccc([C@@H]2[NH2+][C@@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067092 19/94/73/181199473 HYRCYYCLHCGDCJ-MFKMUULPSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@@H]2N[C@@H](C(=O)[O-])Cc3[nH]cnc32)cc1OC COc1ccc([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067102 20/00/90/181200090 HYRCYYCLHCGDCJ-GXFFZTMASA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067102 20/00/88/181200088 HYRCYYCLHCGDCJ-GXFFZTMASA-N 0 303.318 DD 1.115 1 Anodyne mid DDAAMN COc1ccc([C@H]2[NH2+][C@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067102 20/00/86/181200086 HYRCYYCLHCGDCJ-GXFFZTMASA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)cc1OC COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067112 36/49/53/286364953 HYRCYYCLHCGDCJ-GWCFXTLKSA-N -1 303.318 DD 1.115 1 Anodyne mid DDAAMM COc1ccc([C@@H]2N[C@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067112 36/49/52/286364952 HYRCYYCLHCGDCJ-GWCFXTLKSA-N 0 303.318 DD 1.115 1 Anodyne mid DDAAMN COc1ccc([C@@H]2[NH2+][C@H](C(=O)[O-])Cc3nc[nH]c32)cc1OC COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3nc[nH]c32)cc1OC ZINC000005067112 36/49/50/286364950 HYRCYYCLHCGDCJ-GWCFXTLKSA-N -1 303.318 DD 1.115 0 Anodyne ref DDAARM COc1ccc([C@@H]2N[C@H](C(=O)[O-])Cc3[nH]cnc32)cc1OC CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)O)cn2)CC1 ZINC000005177679 40/02/16/278400216 PWYGTZUOLAGDNK-UHFFFAOYSA-N 0 307.35 DD 1.837 2 Anodyne low DDAALN CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)[O-])c[nH+]2)CC1 CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)O)cn2)CC1 ZINC000005177679 40/02/14/278400214 PWYGTZUOLAGDNK-UHFFFAOYSA-N -1 307.35 DD 1.837 0 Anodyne ref DDAARM CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)[O-])cn2)CC1 CC(C)(C)OC(=O)N1CCN(c2ncccc2C(=O)O)CC1 ZINC000006667023 73/92/50/406739250 RQDJPSKVYOSWDB-UHFFFAOYSA-N 0 307.35 DD 1.837 2 Anodyne low DDAALN CC(C)(C)OC(=O)N1CCN(c2[nH+]cccc2C(=O)[O-])CC1 CC(C)(C)OC(=O)N1CCN(c2ncccc2C(=O)O)CC1 ZINC000006667023 73/92/44/406739244 RQDJPSKVYOSWDB-UHFFFAOYSA-N -1 307.35 DD 1.837 0 Anodyne ref DDAARM CC(C)(C)OC(=O)N1CCN(c2ncccc2C(=O)[O-])CC1 CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)C1(CCCC1)N2 ZINC000012357238 38/33/34/278383334 MGIJFCZDFQVQKM-UHFFFAOYSA-N 1 309.41 DD 1.746 2 Anodyne low DDAALO CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)C1(CCCC1)[NH2+]2 CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)C1(CCCC1)N2 ZINC000012357238 38/33/32/278383332 MGIJFCZDFQVQKM-UHFFFAOYSA-N 0 309.41 DD 1.746 0 Anodyne ref DDAARN CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)C1(CCCC1)N2 O=C(O)[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 ZINC000022107335 88/86/89/406888689 YPGQWOXJMNJVIU-WDEREUQCSA-N 0 322.162 DD 1.86 2 Anodyne low DDAALN O=C([O-])[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 ZINC000022107335 88/86/88/406888688 YPGQWOXJMNJVIU-WDEREUQCSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 ZINC000022107335 88/86/86/406888686 YPGQWOXJMNJVIU-WDEREUQCSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 ZINC000022107335 88/86/83/406888683 YPGQWOXJMNJVIU-WDEREUQCSA-N 0 322.162 DD 1.86 0 Anodyne ref DDAARN O=C([O-])[C@@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 ZINC000022107340 88/92/08/406889208 YPGQWOXJMNJVIU-GHMZBOCLSA-N 0 322.162 DD 1.86 2 Anodyne low DDAALN O=C([O-])[C@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 ZINC000022107340 88/92/05/406889205 YPGQWOXJMNJVIU-GHMZBOCLSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 O=C(O)[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 ZINC000022107340 88/92/04/406889204 YPGQWOXJMNJVIU-GHMZBOCLSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@H]1Cc2[nH]cnc2[C@@H](c2cccc(Br)c2)N1 O=C(O)[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)N1 ZINC000022107340 88/91/99/406889199 YPGQWOXJMNJVIU-GHMZBOCLSA-N 0 322.162 DD 1.86 0 Anodyne ref DDAARN O=C([O-])[C@H]1Cc2nc[nH]c2[C@@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107346 88/90/79/406889079 YPGQWOXJMNJVIU-QWRGUYRKSA-N 0 322.162 DD 1.86 2 Anodyne low DDAALN O=C([O-])[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107346 88/90/77/406889077 YPGQWOXJMNJVIU-QWRGUYRKSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@@H]1Cc2nc[nH]c2[C@H](c2cccc(Br)c2)N1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107346 88/90/75/406889075 YPGQWOXJMNJVIU-QWRGUYRKSA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 O=C(O)[C@@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107346 88/90/73/406889073 YPGQWOXJMNJVIU-QWRGUYRKSA-N 0 322.162 DD 1.86 0 Anodyne ref DDAARN O=C([O-])[C@@H]1Cc2nc[nH]c2[C@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107351 20/58/56/304205856 YPGQWOXJMNJVIU-MNOVXSKESA-N 0 322.162 DD 1.86 2 Anodyne low DDAALN O=C([O-])[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)[NH2+]1 O=C(O)[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107351 20/58/54/304205854 YPGQWOXJMNJVIU-MNOVXSKESA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@H]1Cc2nc[nH]c2[C@H](c2cccc(Br)c2)N1 O=C(O)[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107351 20/58/49/304205849 YPGQWOXJMNJVIU-MNOVXSKESA-N -1 322.162 DD 1.86 1 Anodyne mid DDAAMM O=C([O-])[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 O=C(O)[C@H]1Cc2[nH]cnc2[C@H](c2cccc(Br)c2)N1 ZINC000022107351 20/58/44/304205844 YPGQWOXJMNJVIU-MNOVXSKESA-N 0 322.162 DD 1.86 0 Anodyne ref DDAARN O=C([O-])[C@H]1Cc2nc[nH]c2[C@H](c2cccc(Br)c2)[NH2+]1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115777 30/89/70/182308970 CBBQACBMQVEKKG-ZVDSWSACSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115777 30/89/68/182308968 CBBQACBMQVEKKG-ZVDSWSACSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115777 30/89/64/182308964 CBBQACBMQVEKKG-ZVDSWSACSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115781 30/93/45/182309345 CBBQACBMQVEKKG-IBEHDNSVSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115781 30/93/44/182309344 CBBQACBMQVEKKG-IBEHDNSVSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 ZINC000022115781 30/93/41/182309341 CBBQACBMQVEKKG-IBEHDNSVSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@@H]3c3cccnc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115841 30/91/72/182309172 WHVZNXODCFBFHL-ZVDSWSACSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115841 30/91/70/182309170 WHVZNXODCFBFHL-ZVDSWSACSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115841 30/91/69/182309169 WHVZNXODCFBFHL-ZVDSWSACSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115845 88/94/84/406889484 WHVZNXODCFBFHL-IBEHDNSVSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115845 88/94/81/406889481 WHVZNXODCFBFHL-IBEHDNSVSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 ZINC000022115845 88/94/77/406889477 WHVZNXODCFBFHL-IBEHDNSVSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@@H]3c3ccncc3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115850 30/93/06/182309306 BROBLMZLNSWKNT-ZVDSWSACSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115850 30/93/05/182309305 BROBLMZLNSWKNT-ZVDSWSACSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115850 30/93/03/182309303 BROBLMZLNSWKNT-ZVDSWSACSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@H]3c3ccccn3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115854 30/92/59/182309259 BROBLMZLNSWKNT-IBEHDNSVSA-N 0 320.389 DD 1.456 1 Anodyne mid DDAAMN CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115854 30/92/58/182309258 BROBLMZLNSWKNT-IBEHDNSVSA-N 1 320.389 DD 1.456 1 Anodyne mid DDAAMO CC1(C)O[C@H]2O[C@H](C[N@H+]3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 ZINC000022115854 30/92/57/182309257 BROBLMZLNSWKNT-IBEHDNSVSA-N 1 320.389 DD 1.456 0 Anodyne ref DDAARO CC1(C)O[C@H]2O[C@H](C[N@@H+]3CCC[C@@H]3c3ccccn3)[C@H](O)[C@H]2O1 O=C(O)/C(Cl)=C(/Cl)C(=O)NC1(C(=O)O)CCCCC1 ZINC000035572186 02/30/88/304023088 QXUDWBIOORUHKZ-SREVYHEPSA-N -2 310.133 DD 1.664 0 Anodyne ref DDAARL O=C([O-])/C(Cl)=C(/Cl)C(=O)NC1(C(=O)[O-])CCCCC1 O=C1c2ccccc2C(=O)N1CCCn1cc([N+](=O)[O-])cn1 ZINC000067796670 72/24/55/190722455 RBFCJTOXMNXSFJ-UHFFFAOYSA-N 0 300.274 DD 1.478 0 Bother ref DDBARN O=C1c2ccccc2C(=O)N1CCCn1cc([N+](=O)[O-])cn1 O=C1c2ccccc2C(=O)N1CCCn1ccc([N+](=O)[O-])n1 ZINC000067796673 28/44/70/407284470 IRQDZYZZBPIGFY-UHFFFAOYSA-N 0 300.274 DD 1.478 0 Bother ref DDBARN O=C1c2ccccc2C(=O)N1CCCn1ccc([N+](=O)[O-])n1 Brc1nc(Br)n(C[C@H]2CCCO2)n1 ZINC000067800367 28/47/91/407284791 SOGSVWCIAXVUDN-RXMQYKEDSA-N 0 310.977 DD 1.982 0 Anodyne ref DDAARN Brc1nc(Br)n(C[C@H]2CCCO2)n1 Brc1nc(Br)n(C[C@@H]2CCCO2)n1 ZINC000067800369 72/23/36/190722336 SOGSVWCIAXVUDN-YFKPBYRVSA-N 0 310.977 DD 1.982 0 Anodyne ref DDAARN Brc1nc(Br)n(C[C@@H]2CCCO2)n1 COc1ccc(-c2ccc(N3CCNCC3)nn2)cc1OC ZINC000070458895 81/72/12/406817212 REEUNSFBBYHNCR-UHFFFAOYSA-N 0 300.362 DD 1.57 3 Anodyne high DDAAHN COc1ccc(-c2ccc(N3CCNCC3)nn2)cc1OC COc1ccc(-c2ccc(N3CCNCC3)nn2)cc1OC ZINC000070458895 81/72/08/406817208 REEUNSFBBYHNCR-UHFFFAOYSA-N 1 300.362 DD 1.57 0 Anodyne ref DDAARO COc1ccc(-c2ccc(N3CC[NH2+]CC3)nn2)cc1OC COc1ccc([C@@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)cc1 ZINC000071974414 87/00/91/406870091 DQYYCIRDMFBPBG-QGZVFWFLSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1ccc([C@@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)cc1 COc1ccc([C@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)cc1 ZINC000071974415 91/63/16/184916316 DQYYCIRDMFBPBG-KRWDZBQOSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1ccc([C@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)cc1 COc1ccc([C@@]2(Cc3cccs3)NC(N)=NC2=O)cc1 ZINC000071974416 91/59/24/184915924 LTVZUAUHCYZCPY-OAHLLOKOSA-N 0 301.371 DD 1.639 0 Anodyne ref DDAARN COc1ccc([C@@]2(Cc3cccs3)NC(N)=NC2=O)cc1 COc1ccc([C@]2(Cc3cccs3)NC(N)=NC2=O)cc1 ZINC000071974417 87/06/53/406870653 LTVZUAUHCYZCPY-HNNXBMFYSA-N 0 301.371 DD 1.639 0 Anodyne ref DDAARN COc1ccc([C@]2(Cc3cccs3)NC(N)=NC2=O)cc1 NC1=NC(=O)[C@](Cc2ccccc2)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000071974511 87/03/43/406870343 AZLIOACSUFEPOG-INIZCTEOSA-N 0 310.313 DD 1.477 0 Bother ref DDBARN NC1=NC(=O)[C@](Cc2ccccc2)(c2ccc([N+](=O)[O-])cc2)N1 NC1=NC(=O)[C@@](Cc2ccccc2)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000071974513 87/03/48/406870348 AZLIOACSUFEPOG-MRXNPFEDSA-N 0 310.313 DD 1.477 0 Bother ref DDBARN NC1=NC(=O)[C@@](Cc2ccccc2)(c2ccc([N+](=O)[O-])cc2)N1 NC1=NC(=O)[C@](Cc2ccccc2)(c2cccc([N+](=O)[O-])c2)N1 ZINC000071974638 86/98/09/406869809 QGEDLYFPRITRLM-INIZCTEOSA-N 0 310.313 DD 1.477 0 Bother ref DDBARN NC1=NC(=O)[C@](Cc2ccccc2)(c2cccc([N+](=O)[O-])c2)N1 NC1=NC(=O)[C@@](Cc2ccccc2)(c2cccc([N+](=O)[O-])c2)N1 ZINC000071974639 91/61/49/184916149 QGEDLYFPRITRLM-MRXNPFEDSA-N 0 310.313 DD 1.477 0 Bother ref DDBARN NC1=NC(=O)[C@@](Cc2ccccc2)(c2cccc([N+](=O)[O-])c2)N1 COc1ccc(C[C@@]2(c3ccc(F)cc3)NC(N)=NC2=O)cc1 ZINC000071974882 91/67/68/184916768 KAOHLRRBMOCLLJ-KRWDZBQOSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1ccc(C[C@@]2(c3ccc(F)cc3)NC(N)=NC2=O)cc1 COc1ccc(C[C@]2(c3ccc(F)cc3)NC(N)=NC2=O)cc1 ZINC000071974884 86/99/02/406869902 KAOHLRRBMOCLLJ-QGZVFWFLSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1ccc(C[C@]2(c3ccc(F)cc3)NC(N)=NC2=O)cc1 NC1=NC(=O)[C@](Cc2ccc(F)cc2)(c2ccc(F)cc2)N1 ZINC000071974901 91/67/47/184916747 ISTATDJUPAABHC-INIZCTEOSA-N 0 301.296 DD 1.847 0 Anodyne ref DDAARN NC1=NC(=O)[C@](Cc2ccc(F)cc2)(c2ccc(F)cc2)N1 NC1=NC(=O)[C@@](Cc2ccc(F)cc2)(c2ccc(F)cc2)N1 ZINC000071974903 86/99/37/406869937 ISTATDJUPAABHC-MRXNPFEDSA-N 0 301.296 DD 1.847 0 Anodyne ref DDAARN NC1=NC(=O)[C@@](Cc2ccc(F)cc2)(c2ccc(F)cc2)N1 COc1ccc(C[C@]2(c3ccc(C)cc3)NC(N)=NC2=O)cc1 ZINC000071975182 91/67/23/184916723 IFRNEWHTJLMTNF-GOSISDBHSA-N 0 309.369 DD 1.886 0 Anodyne ref DDAARN COc1ccc(C[C@]2(c3ccc(C)cc3)NC(N)=NC2=O)cc1 COc1ccc(C[C@@]2(c3ccc(C)cc3)NC(N)=NC2=O)cc1 ZINC000071975183 91/67/43/184916743 IFRNEWHTJLMTNF-SFHVURJKSA-N 0 309.369 DD 1.886 0 Anodyne ref DDAARN COc1ccc(C[C@@]2(c3ccc(C)cc3)NC(N)=NC2=O)cc1 COc1cccc([C@@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)c1 ZINC000071975293 91/66/89/184916689 OOGVAPGNFXVZBH-QGZVFWFLSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1cccc([C@@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)c1 COc1cccc([C@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)c1 ZINC000071975294 87/06/16/406870616 OOGVAPGNFXVZBH-KRWDZBQOSA-N 0 313.332 DD 1.717 0 Anodyne ref DDAARN COc1cccc([C@]2(Cc3ccc(F)cc3)NC(N)=NC2=O)c1 COc1cccc([C@@]2(Cc3cccs3)NC(N)=NC2=O)c1 ZINC000071975295 87/07/12/406870712 DUFPDLVZALBDDU-OAHLLOKOSA-N 0 301.371 DD 1.639 0 Anodyne ref DDAARN COc1cccc([C@@]2(Cc3cccs3)NC(N)=NC2=O)c1