smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN(CC)CCNc1ccc(CSC)c2sc3ccccc3c(=O)c12	ZINC000003806472	204019648	/nfs/dbraw/zinc/01/96/48/204019648.db2.gz	ZUSNBRXJEIEXPH-UHFFFAOYSA-N	0	3	386.586	5.031	1	5		GKBFHN
CN(C)CCn1nc2c3c1cc1c(c3sc3ccccc23)C=CC(C)(C)O1	ZINC000026576907	207316152	/nfs/dbraw/zinc/31/61/52/207316152.db2.gz	SPLYGGOJMPUNMH-UHFFFAOYSA-N	0	3	377.513	5.150	1	5		GKBFHN
CCOc1cc2c3cc(O)ccc3c3c(c2cc1OCC)CN1CCC[C@H]1C3	ZINC000072126097	222209399	/nfs/dbraw/zinc/20/93/99/222209399.db2.gz	QGRDNLVTYFQXDR-HNNXBMFYSA-N	0	3	377.484	5.017	1	5		GKBFHN
COc1ccc2c(c1)c1cc(OC)c(OC)cc1c1c2CN2CCCCC[C@@H]2C1	ZINC000072112631	222207504	/nfs/dbraw/zinc/20/75/04/222207504.db2.gz	ZAUIBEGWABIVCD-MRXNPFEDSA-N	0	3	391.511	5.320	1	5		GKBFHN
O=c1cc(NC2CCN(Cc3ccccc3)CC2)c2ccc3ccccc3c2o1	ZINC000084602279	208093304	/nfs/dbraw/zinc/09/33/04/208093304.db2.gz	ZNGDKSVBZJGAKH-UHFFFAOYSA-N	0	3	384.479	5.023	1	5		GKBFHN
COc1ccc2ccc3c([nH]c4c3c(NCCN(C)C)nc3ccccc43)c2c1	ZINC000013440376	221268459	/nfs/dbraw/zinc/26/84/59/221268459.db2.gz	GOCZKPDHVLYWBI-UHFFFAOYSA-N	0	3	384.483	5.005	1	5		GKBFHN