smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)O[C@@H]2[C@H](O1)[C@H](COS(C)(=O)=O)O[C@H]2n1ncc(=O)[nH]c1=O	ZINC000002802438	206158100	/nfs/dbraw/zinc/15/81/00/206158100.db2.gz	WHZZSEDRSUGQAL-JZKKDOLYSA-N	0	2	363.348	-1.675	50	30		FAEALN
CC1(C)O[C@@H]2[C@H](COS(C)(=O)=O)O[C@H](n3ncc(=O)[nH]c3=O)[C@H]2O1	ZINC000009206148	482635201	/nfs/dbraw/zinc/63/52/01/482635201.db2.gz	WHZZSEDRSUGQAL-NORCUCSASA-N	0	2	363.348	-1.675	50	30		FAEALN
CC1(C)O[C@@H]2[C@H](COS(C)(=O)=O)O[C@@H](n3ncc(=O)[nH]c3=O)[C@H]2O1	ZINC000009206149	482636137	/nfs/dbraw/zinc/63/61/37/482636137.db2.gz	WHZZSEDRSUGQAL-QRYDPKPESA-N	0	2	363.348	-1.675	50	30		FAEALN
CC1(C)O[C@H]2[C@@H](O1)[C@@H](n1ncc(=O)[nH]c1=O)O[C@H]2COS(C)(=O)=O	ZINC000009206150	482635845	/nfs/dbraw/zinc/63/58/45/482635845.db2.gz	WHZZSEDRSUGQAL-ZQNVIIHSSA-N	0	2	363.348	-1.675	50	30		FAEALN
Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)[nH]c(=O)n2C	ZINC000009849203	483732052	/nfs/dbraw/zinc/73/20/52/483732052.db2.gz	USEXNQMDNAFFFT-UHFFFAOYSA-N	0	2	362.306	-2.221	50	30		FAEALN
C=CCNC(=S)N1CCN(CCNC=C2C(=O)NC(=O)NC2=O)CC1	ZINC000085434211	518949561	/nfs/dbraw/zinc/94/95/61/518949561.db2.gz	ULPOTHAJNSMTCV-UHFFFAOYSA-N	0	2	366.447	-1.496	50	30		FAEALN