COCCN1C(=O)c2ccccc2[C@H](C(=O)O)[C@H]1c1cn(C)c2ccccc12	ZINC000006721932	67/28/10/209672810	QZTVNQHUQQWMEQ-VQTJNVASSA-N	-1	378.428	GG	3.19	0	Anodyne	ref	GGABRM	COCCN1C(=O)c2ccccc2[C@H](C(=O)[O-])[C@H]1c1cn(C)c2ccccc12	 
COc1c2c(c(OC)c3occc13)O[C@@](O)(C(Cl)(Cl)Cl)CC2=O	ZINC000027551198	32/69/97/207326997	QONHLGXPMCLQRD-CYBMUJFWSA-N	-1	381.595	GG	3.474	3	Anodyne	high	GGAAHM	COc1c2c(c(OC)c3occc13)O[C@@](O)(C(Cl)(Cl)Cl)C=C2[O-]	 
COc1c2c(c(OC)c3occc13)O[C@@](O)(C(Cl)(Cl)Cl)CC2=O	ZINC000027551198	32/69/92/207326992	QONHLGXPMCLQRD-CYBMUJFWSA-N	0	381.595	GG	3.474	0	Anodyne	ref	GGAARN	COc1c2c(c(OC)c3occc13)O[C@@](O)(C(Cl)(Cl)Cl)CC2=O	 
COc1c2c(c(OC)c3occc13)O[C@](O)(C(Cl)(Cl)Cl)CC2=O	ZINC000027551202	35/45/83/564354583	QONHLGXPMCLQRD-ZDUSSCGKSA-N	-1	381.595	GG	3.474	3	Anodyne	high	GGAAHM	COc1c2c(c(OC)c3occc13)O[C@](O)(C(Cl)(Cl)Cl)C=C2[O-]	 
COc1c2c(c(OC)c3occc13)O[C@](O)(C(Cl)(Cl)Cl)CC2=O	ZINC000027551202	35/45/74/564354574	QONHLGXPMCLQRD-ZDUSSCGKSA-N	0	381.595	GG	3.474	0	Anodyne	ref	GGAARN	COc1c2c(c(OC)c3occc13)O[C@](O)(C(Cl)(Cl)Cl)CC2=O	 
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C(/O)c1ccccc1	ZINC000100404949	18/92/13/136189213	HMTPRBGXGFPTCX-BUHFOSPRSA-N	-1	387.189	GG	3.001	2	Anodyne	low	GGABLM	O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=C([O-])c1ccccc1	 
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C(/O)c1ccccc1	ZINC000100404949	18/92/12/136189212	HMTPRBGXGFPTCX-BUHFOSPRSA-N	-2	387.189	GG	3.001	0	Anodyne	ref	GGABRL	O=C1[N-]C(=O)N(c2ccc(Br)cc2)C(=O)C1=C([O-])c1ccccc1