smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(CCO)sc[n+]1CC#Cc1ccc(C#CC[n+]2csc(CCO)c2C)cc1	ZINC000095594461	563191034	/nfs/dbraw/zinc/19/10/34/563191034.db2.gz	LVAYTSFIYOOIQX-UHFFFAOYSA-N	2	0	438.618	2.174	1	30		IEEFRP
CS(=O)(=O)ONC(=[NH2+])CCCCCCCCCCCCC(=[NH2+])NOS(C)(=O)=O	ZINC000049867661	563140403	/nfs/dbraw/zinc/14/04/03/563140403.db2.gz	YDMXVZMILUDQPW-UHFFFAOYSA-N	2	0	442.604	2.374	1	30		IEEFRP
C[N+](C)(C)CC(=O)NCc1cccc2cc3cccc(CNC(=O)C[N+](C)(C)C)c3nc21	ZINC000045284688	563128082	/nfs/dbraw/zinc/12/80/82/563128082.db2.gz	DJKRRANVYRLGRR-UHFFFAOYSA-P	2	0	437.588	2.033	1	30		IEEFRP
NC(=[NH2+])c1ccc(C=CC(=O)NCC(O)CNC(=O)C=Cc2ccc(C(N)=[NH2+])cc2)cc1	ZINC000064251845	563152481	/nfs/dbraw/zinc/15/24/81/563152481.db2.gz	JICJYMDYDRTCLP-CBIKUMSCSA-N	2	0	434.500	2.255	1	30		IEEFRP
NC(=[NH2+])c1ccc(C=CC(=O)NCC(O)CNC(=O)C=Cc2ccc(C(N)=[NH2+])cc2)cc1	ZINC000064251856	563152496	/nfs/dbraw/zinc/15/24/96/563152496.db2.gz	JICJYMDYDRTCLP-JTAXDKCCSA-N	2	0	434.500	2.255	1	30		IEEFRP