smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCSc1ccccc1C(=O)Nc1ccc(OC2CC[NH+](C)CC2)cc1	ZINC000217036782	521773060	/nfs/dbraw/zinc/77/30/60/521773060.db2.gz	PPZCFJJATUXZCO-UHFFFAOYSA-N	1	0	370.518	4.524	40	70		FJIBRO
C[NH+]1CCC(C(=O)Nc2ccccc2SCc2ccc(Cl)cc2)CC1	ZINC000216922602	523750077	/nfs/dbraw/zinc/75/00/77/523750077.db2.gz	ARUSKAKNQZAKIW-UHFFFAOYSA-N	1	0	374.937	4.913	40	70		FJIBRO
CC(C)c1ccc(CCCNC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc1	ZINC000218611950	206371825	/nfs/dbraw/zinc/37/18/25/206371825.db2.gz	AMMDNFTZUZNYTM-UHFFFAOYSA-N	1	0	364.533	4.768	40	70		FJIBRO
C[NH+]1CCC(CC(=O)Nc2ccc(CSc3ccccc3)cc2)CC1	ZINC000216893527	523754753	/nfs/dbraw/zinc/75/47/53/523754753.db2.gz	JPPSWWOPBAXPBB-UHFFFAOYSA-N	1	0	354.519	4.649	40	70		FJIBRO
C[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2SCc2ccc(Cl)cc2)C1	ZINC000216913869	523836518	/nfs/dbraw/zinc/83/65/18/523836518.db2.gz	HCDXQSSXIYNOKL-INIZCTEOSA-N	1	0	374.937	4.913	40	70		FJIBRO
C[NH+]1CCC(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)CC1	ZINC000216895589	523756421	/nfs/dbraw/zinc/75/64/21/523756421.db2.gz	YJTKPVSHFQVTDM-UHFFFAOYSA-N	1	0	358.869	4.803	40	70		FJIBRO
C[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2SCc2ccc(Cl)cc2)C1	ZINC000216913842	523812343	/nfs/dbraw/zinc/81/23/43/523812343.db2.gz	HCDXQSSXIYNOKL-MRXNPFEDSA-N	1	0	374.937	4.913	40	70		FJIBRO
Cc1cc(CSc2ccccc2)ccc1NC(=O)CC1CC[NH+](C)CC1	ZINC000216893585	524817142	/nfs/dbraw/zinc/81/71/42/524817142.db2.gz	VCEDKXBUGFSCLL-UHFFFAOYSA-N	1	0	368.546	4.958	40	70		FJIBRO
Cc1cc(CSc2ccccc2)ccc1NC(=O)C1CC[NH+](C)CC1	ZINC000216919976	568154289	/nfs/dbraw/zinc/15/42/89/568154289.db2.gz	XDTJFNLRLYVBHF-UHFFFAOYSA-N	1	0	354.519	4.568	40	70		FJIBRO
C[NH+]1CCC(CC(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)CC1	ZINC000216897927	568151839	/nfs/dbraw/zinc/15/18/39/568151839.db2.gz	HHPRFATXQIJWLO-UHFFFAOYSA-N	1	0	366.549	4.825	40	70		FJIBRO