smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1NC(=S)N(c2ccccc2F)C(=O)C1=CNCCN1CC[NH2+]CC1	ZINC000019362780	207118108	/nfs/dbraw/zinc/11/81/08/207118108.db2.gz	GQYUIXPJLUYVRG-VAWYXSNFSA-N	1	1	377.445	-0.048	50	10		GBCAMO
O=C1NC(=S)N(c2ccc(F)cc2)C(=O)C1=CNCCN1CC[NH2+]CC1	ZINC000019367638	570980227	/nfs/dbraw/zinc/98/02/27/570980227.db2.gz	MKOQOKSRSKIEPW-SDNWHVSQSA-N	1	1	377.445	-0.048	50	10		GBCAMO
COc1ccccc1N1C(=O)C(=CNCCN2CC[NH2+]CC2)C(=O)NC1=S	ZINC000019370304	210247131	/nfs/dbraw/zinc/24/71/31/210247131.db2.gz	JWLZBLDSDLDTQQ-OUKQBFOZSA-N	1	1	389.481	-0.178	50	10		GBCAMO
COc1ccc(CN2C(=O)NC(=O)C(=CNCCN3CC[NH2+]CC3)C2=O)cc1	ZINC000019995157	207173257	/nfs/dbraw/zinc/17/32/57/207173257.db2.gz	MUNKDUJRPRUKKS-VBKFSLOCSA-N	1	1	387.440	-0.348	50	10		GBCAMO
COc1cccc(N2C(=O)C(=CNCCN3CC[NH2+]CC3)C(=O)NC2=S)c1	ZINC000019995888	570234271	/nfs/dbraw/zinc/23/42/71/570234271.db2.gz	FWVFUUBTYBQVSY-NTCAYCPXSA-N	1	1	389.481	-0.178	50	10		GBCAMO
O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)C1=CNCCN1CC[NH2+]CC1	ZINC000019997612	570234634	/nfs/dbraw/zinc/23/46/34/570234634.db2.gz	PRQQZYYATRBBNZ-DTQAZKPQSA-N	1	1	389.431	-0.175	50	10		GBCAMO
COc1ccc(N2C(=O)C(=CNCCN3CC[NH2+]CC3)C(=O)NC2=S)cc1	ZINC000020623295	570272883	/nfs/dbraw/zinc/27/28/83/570272883.db2.gz	TUNHDOGNWRSZRQ-NTCAYCPXSA-N	1	1	389.481	-0.178	50	10		GBCAMO
COc1ccc(CN2C(=O)NC(=O)C(=CNCCN3CC[NH2+]CC3)C2=O)cc1	ZINC000100765598	570442768	/nfs/dbraw/zinc/44/27/68/570442768.db2.gz	MUNKDUJRPRUKKS-FOWTUZBSSA-N	1	1	387.440	-0.348	50	10		GBCAMO
O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)C1=CNCCN1CC[NH2+]CC1	ZINC000100781712	570445009	/nfs/dbraw/zinc/44/50/09/570445009.db2.gz	PRQQZYYATRBBNZ-SSZFMOIBSA-N	1	1	389.431	-0.175	50	10		GBCAMO