c1ccc(Nc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1	ZINC000000269416	95/20/02/435952002	VWXIJCRXGJVNDM-UHFFFAOYSA-N	0	341.419	EC	0.861	3	Anodyne	high	ECAAHN	c1ccc(Nc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1	 
c1ccc(Nc2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1	ZINC000000269416	95/19/90/435951990	VWXIJCRXGJVNDM-UHFFFAOYSA-N	1	341.419	EC	0.861	0	Anodyne	ref	ECAARO	c1ccc(Nc2nc(N3CC[NH2+]CC3)nc(N3CCOCC3)n2)cc1	 
COc1ccc([C@@H]2C(C#N)=C(N)NC(=S)[C@H]2C(N)=O)c(OC)c1	ZINC000003771962	79/02/14/269790214	XRYZWMKNMZHNKI-VXGBXAGGSA-N	0	332.385	EC	0.513	0	Reactive	ref	ECGARN	COc1ccc([C@@H]2C(C#N)=C(N)NC(=S)[C@H]2C(N)=O)c(OC)c1	 
CC(=O)C1=C(O)C(=O)N(CCN2CCNCC2)[C@@H]1c1ccccc1	ZINC000019702492	05/54/60/212055460	HANYVJWQPZBKGC-MRXNPFEDSA-N	1	329.4	EC	0.876	0	Mild	ref	ECEARO	CC(=O)C1=C(O)C(=O)N(CCN2CC[NH2+]CC2)[C@@H]1c1ccccc1	 
CC(=O)C1=C(O)C(=O)N(CCN2CCNCC2)[C@H]1c1ccccc1	ZINC000019702494	05/52/95/212055295	HANYVJWQPZBKGC-INIZCTEOSA-N	1	329.4	EC	0.876	0	Mild	ref	ECEARO	CC(=O)C1=C(O)C(=O)N(CCN2CC[NH2+]CC2)[C@H]1c1ccccc1	 
O=C(O)c1nnsc1NC(=O)N1CCN(c2ncccn2)CC1	ZINC000022130402	27/75/34/212277534	QSUFYHXURJXPEL-UHFFFAOYSA-N	-1	335.349	EC	0.38	0	Anodyne	ref	ECAARM	O=C([O-])c1nnsc1NC(=O)N1CCN(c2ncccn2)CC1	 
O=C(O)c1nnsc1NC(=O)N1CCN(c2ccccn2)CC1	ZINC000022130405	27/75/43/212277543	IYNUFHBCBXGBHQ-UHFFFAOYSA-N	0	334.361	EC	0.985	2	Anodyne	low	ECAALN	O=C([O-])c1nnsc1NC(=O)N1CCN(c2cccc[nH+]2)CC1	 
O=C(O)c1nnsc1NC(=O)N1CCN(c2ccccn2)CC1	ZINC000022130405	27/75/39/212277539	IYNUFHBCBXGBHQ-UHFFFAOYSA-N	-1	334.361	EC	0.985	0	Anodyne	ref	ECAARM	O=C([O-])c1nnsc1NC(=O)N1CCN(c2ccccn2)CC1	 
CCOC(=O)c1nnsc1NC(=O)N1CCN(C(C)=O)CC1	ZINC000261338450	87/72/18/436877218	DTVWMFJPWDPJLS-UHFFFAOYSA-N	-1	327.366	EC	0.411	3	Anodyne	high	ECABHM	CCOC(=O)c1nnsc1[N-]C(=O)N1CCN(C(C)=O)CC1	 
CCOC(=O)c1nnsc1NC(=O)N1CCN(C(C)=O)CC1	ZINC000261338450	87/72/13/436877213	DTVWMFJPWDPJLS-UHFFFAOYSA-N	0	327.366	EC	0.411	0	Anodyne	ref	ECABRN	CCOC(=O)c1nnsc1NC(=O)N1CCN(C(C)=O)CC1