smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1ccc(Cl)cc1NC(=O)C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000071982679	211067406	/nfs/dbraw/zinc/06/74/06/211067406.db2.gz	PJGJJSMQXZXBLE-QFIPXVFZSA-N	1	1	393.849	4.668	20	30		GJEDMO
CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N(CCC#N)C2CCCC2)n1	ZINC001165017537	721835703	/nfs/dbraw/zinc/83/57/03/721835703.db2.gz	OAQOHSXNZDCMLL-UHFFFAOYSA-N	1	1	385.581	4.813	20	30		GJEDMO
Cc1nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c(C#N)c(C)c1Cl	ZINC001164994755	722192431	/nfs/dbraw/zinc/19/24/31/722192431.db2.gz	PSPQUFOENSAVJL-QFIPXVFZSA-N	1	1	398.913	4.608	20	30		GJEDMO
Cc1nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c(C#N)c(C)c1Cl	ZINC001164994753	722192558	/nfs/dbraw/zinc/19/25/58/722192558.db2.gz	PSPQUFOENSAVJL-JOCHJYFZSA-N	1	1	398.913	4.608	20	30		GJEDMO
N#Cc1ccc(NC(=O)C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)cc1Cl	ZINC000071982735	222202421	/nfs/dbraw/zinc/20/24/21/222202421.db2.gz	REHDBGGEFMICTN-QFIPXVFZSA-N	1	1	393.849	4.668	20	30		GJEDMO
CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N(C)Cc2ccc(C#N)cc2)n1	ZINC001165017832	721837112	/nfs/dbraw/zinc/83/71/12/721837112.db2.gz	QPSUDSGBZQIMHN-UHFFFAOYSA-N	1	1	393.560	4.658	20	30		GJEDMO
N#Cc1ccc(NC(=O)C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)cc1Cl	ZINC000071982736	222202939	/nfs/dbraw/zinc/20/29/39/222202939.db2.gz	REHDBGGEFMICTN-JOCHJYFZSA-N	1	1	393.849	4.668	20	30		GJEDMO
Cc1sc2nc(C[NH+]3CCCC3)nc(N(CCC#N)C3CCCC3)c2c1C	ZINC001165016193	721835720	/nfs/dbraw/zinc/83/57/20/721835720.db2.gz	ADGNLLJBLQIJOF-UHFFFAOYSA-N	1	1	383.565	4.567	20	30		GJEDMO
Clc1ccc(C[NH+]2CCC(=NOCc3nnc(-c4ccccc4)o3)CC2)cc1	ZINC000012766144	526943922	/nfs/dbraw/zinc/94/39/22/526943922.db2.gz	FBBKHCPTIIKSGV-UHFFFAOYSA-N	1	1	396.878	4.559	20	30		GJEDMO