smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)N2CC[NH+](Cc3ccc(C#N)cc3)CC2)CC1	ZINC000514295841	1059106413	/nfs/dbraw/zinc/10/64/13/1059106413.db2.gz	LFYRIDXJGSLFAC-UHFFFAOYSA-N	1	2	511.604	2.520	20	30		KFEDLO
CCCCCN(C(=O)CCC(=O)N1CC[NH+](Cc2ccc(C#N)cc2)CC1)c1c(N)n(CCCC)c(=O)[nH]c1=O	ZINC000514296347	1059128953	/nfs/dbraw/zinc/12/89/53/1059128953.db2.gz	OSMNUGXESKOXJO-UHFFFAOYSA-N	1	2	551.692	2.851	20	30		KFEDLO
C=CCn1c(S[C@@H](C)C(=O)N2CC[NH+](CC)CC2)nnc1-c1cccc(S(=O)(=O)N(CC)CC)c1	ZINC000514377152	1059247255	/nfs/dbraw/zinc/24/72/55/1059247255.db2.gz	YYFNXRTXGJDKIU-IBGZPJMESA-N	1	2	520.725	2.806	20	30		KFEDLO
C=CCn1c(S[C@H](C)C(=O)N2CC[NH+](CC)CC2)nnc1-c1cccc(S(=O)(=O)N(CC)CC)c1	ZINC000514377153	1059247183	/nfs/dbraw/zinc/24/71/83/1059247183.db2.gz	YYFNXRTXGJDKIU-LJQANCHMSA-N	1	2	520.725	2.806	20	30		KFEDLO
COc1ccc(CNC(=S)C(=C(O)C2=CCC(=NS(C)(=O)=O)C=C2)[n+]2cccc(CO)c2)cc1	ZINC000728556149	1059012959	/nfs/dbraw/zinc/01/29/59/1059012959.db2.gz	SIHMKEGJXRDPFS-UHFFFAOYSA-O	1	2	500.622	2.659	20	30		KFEDLO