smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1	ZINC000103297447	209251979	/nfs/dbraw/zinc/25/19/79/209251979.db2.gz	ZFUNQHQJPVTQQO-QKYXUNIQSA-N	0	3	353.510	3.445	1	10		FGCFHN
CN(C)CCCSc1nc2c(ccc3c2C(=O)c2ccccc2C3=O)[nH]1	ZINC000103264523	209250982	/nfs/dbraw/zinc/25/09/82/209250982.db2.gz	UKEXTKOOZRMBQF-UHFFFAOYSA-N	0	3	365.458	3.382	1	10		FGCFHN
CCN(CC)CCc1c2ccccc2nc2c1C(=O)c1ncccc1C2=O	ZINC000001649604	210363563	/nfs/dbraw/zinc/36/35/63/210363563.db2.gz	OPVSYLBSDGXWKB-UHFFFAOYSA-N	0	3	359.429	3.290	1	10		FGCFHN
COc1ccc2c(c1)cc(C(=O)NCCN(C)C)c1nc3ccccc3nc21	ZINC000013586913	211040510	/nfs/dbraw/zinc/04/05/10/211040510.db2.gz	XOEHUIAXGBJGRO-UHFFFAOYSA-N	0	3	374.444	3.236	1	10		FGCFHN
O=C(N[C@@H]1CCCC[N@@H+](Cc2ccccc2[O-])C1)c1cc(F)cc(F)c1	ZINC000045301802	205120335	/nfs/dbraw/zinc/12/03/35/205120335.db2.gz	AREBTOFTCGAULE-GOSISDBHSA-N	0	3	360.404	3.455	1	10		FGCFHN
O=C(N[C@@H]1CCCC[N@H+](Cc2ccccc2[O-])C1)c1cc(F)cc(F)c1	ZINC000045301802	205120340	/nfs/dbraw/zinc/12/03/40/205120340.db2.gz	AREBTOFTCGAULE-GOSISDBHSA-N	0	3	360.404	3.455	1	10		FGCFHN
O=C(N[C@H]1CCCC[N@@H+](Cc2ccccc2[O-])C1)c1cc(F)cc(F)c1	ZINC000045301800	205120654	/nfs/dbraw/zinc/12/06/54/205120654.db2.gz	AREBTOFTCGAULE-SFHVURJKSA-N	0	3	360.404	3.455	1	10		FGCFHN
O=C(N[C@H]1CCCC[N@H+](Cc2ccccc2[O-])C1)c1cc(F)cc(F)c1	ZINC000045301800	205120657	/nfs/dbraw/zinc/12/06/57/205120657.db2.gz	AREBTOFTCGAULE-SFHVURJKSA-N	0	3	360.404	3.455	1	10		FGCFHN
Cn1cc2c3c1cccc3[C@H]1C[C@@H](CNC(=O)C3CCCC3)CN(C)[C@@H]1C2	ZINC000103297465	209251855	/nfs/dbraw/zinc/25/18/55/209251855.db2.gz	CJMOFABIRFQLED-NYSBEXSLSA-N	0	3	365.521	3.445	1	10		FGCFHN