smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C#CCOC[C@H](O)CN(CCc1nc(-c2ccc(C)c(Cl)c2)no1)Cc1ccco1	ZINC000036147856	518311442	/nfs/dbraw/zinc/31/14/42/518311442.db2.gz	ITYMLAQNAGKZOE-GOSISDBHSA-N	0	1	429.904	3.347	10	30		IGEEMN
CCCCCCCCCCC(=O)OC[C@@H](O)CO[P@](=O)([O-])OCC[N+](C)(C)C	ZINC000044405722	563122149	/nfs/dbraw/zinc/12/21/49/563122149.db2.gz	OZRAIUXQMKVTIQ-GOSISDBHSA-O	0	1	426.511	3.261	10	30		IGEEMN
N#Cc1c(=O)[nH]c(SCC(=O)Nc2ccccc2Br)nc1-c1ccco1	ZINC000020508066	526517341	/nfs/dbraw/zinc/51/73/41/526517341.db2.gz	JPVFMJQJHXDUNZ-UHFFFAOYSA-N	0	1	431.271	3.395	10	30		IGEEMN
CCCCCCCCCCC(=O)OC[C@H](O)CO[P@](=O)([O-])OCC[N+](C)(C)C	ZINC000102189739	717145508	/nfs/dbraw/zinc/14/55/08/717145508.db2.gz	OZRAIUXQMKVTIQ-SFHVURJKSA-O	0	1	426.511	3.261	10	30		IGEEMN
COc1cc(/C=C2\Oc3c(ccc(O)c3CN3CCCOC3)C2=O)cc(OC)c1OC	ZINC000094993449	521967675	/nfs/dbraw/zinc/96/76/75/521967675.db2.gz	KSOVMAGZZSYPNL-NVMNQCDNSA-N	0	1	427.453	3.214	10	30		IGEEMN
Cc1cc([N+](=O)[O-])nn1CC(=O)ONC(=N)c1ccc(OCc2ccccc2Cl)cc1	ZINC000020353695	525578503	/nfs/dbraw/zinc/57/85/03/525578503.db2.gz	GFYSMWCKYKSHNR-UHFFFAOYSA-N	0	1	443.847	3.196	10	30		IGEEMN
COc1cc(C=NN=c2[nH]c3ccccc3[nH]2)cc(Br)c1OCC(=O)N(C)C	ZINC000009661758	562974820	/nfs/dbraw/zinc/97/48/20/562974820.db2.gz	VBFFJWNXNVBUCF-UFFVCSGVSA-N	0	1	446.305	3.247	10	30		IGEEMN
C#CCOC[C@@H](O)CN(CCc1nc(-c2ccc(C)c(Cl)c2)no1)Cc1ccco1	ZINC000036147853	518300070	/nfs/dbraw/zinc/30/00/70/518300070.db2.gz	ITYMLAQNAGKZOE-SFHVURJKSA-N	0	1	429.904	3.347	10	30		IGEEMN