smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C(=C/c1c2ccccc2[nH+]c2ccccc21)\c1c2ccccc2nc2ccccc21	ZINC000008627250	221046996	/nfs/dbraw/zinc/04/69/96/221046996.db2.gz	HPHSXUJDNGYBHI-ISLYRVAYSA-N	1	2	382.466	7.260	40	5		GKBBLO
COc1ccc2[nH+]c3cc(Cl)ccc3c(Nc3ccccc3NC(C)=O)c2n1	ZINC000001558200	570264659	/nfs/dbraw/zinc/26/46/59/570264659.db2.gz	XAYCWPMXKOKYBU-UHFFFAOYSA-N	1	2	392.846	5.147	40	5		GKBBLO
C(=C\c1c2ccccc2[nH+]c2ccccc21)\c1c2ccccc2nc2ccccc21	ZINC000004824560	570409178	/nfs/dbraw/zinc/40/91/78/570409178.db2.gz	HPHSXUJDNGYBHI-ZCXUNETKSA-N	1	2	382.466	7.260	40	5		GKBBLO
S=C(Nc1ccc2cc3ccccc3[nH+]c2c1)Nc1cccc2ccccc21	ZINC000409189119	534458511	/nfs/dbraw/zinc/45/85/11/534458511.db2.gz	IUJLLEWTAZTBAM-UHFFFAOYSA-N	1	2	379.488	6.350	40	5		GKBBLO
S=C(Nc1ccc2ccccc2c1)Nc1ccc2cc3ccccc3[nH+]c2c1	ZINC000409188167	534458995	/nfs/dbraw/zinc/45/89/95/534458995.db2.gz	BNXAPYCAXSXMJG-UHFFFAOYSA-N	1	2	379.488	6.350	40	5		GKBBLO
CCCN(Cc1ccccc1)C(=S)Nc1ccc2cc3ccccc3[nH+]c2c1	ZINC000409188198	528146371	/nfs/dbraw/zinc/14/63/71/528146371.db2.gz	BQHFGJRGUYSMMR-UHFFFAOYSA-N	1	2	385.536	5.997	40	5		GKBBLO