smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C=C2SC(=O)[N-]C2=O)c(C)n1-c1ccc(-c2ccccc2)cc1	ZINC000001214420	570493657	/nfs/dbraw/zinc/49/36/57/570493657.db2.gz	FLXJSXUCSQKTMW-DEDYPNTBSA-N	-1	1	374.465	5.085	50	10		FKCAMM
O=C1c2ccccc2-c2onc3c2c1c([O-])cc3Oc1ccc(Cl)cc1	ZINC000001250317	210339922	/nfs/dbraw/zinc/33/99/22/210339922.db2.gz	VBEVSCVFAFTSRP-UHFFFAOYSA-N	-1	1	363.756	5.191	50	10		FKCAMM
O=C1[N-]C(=S)C(=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)S1	ZINC000001269266	570497003	/nfs/dbraw/zinc/49/70/03/570497003.db2.gz	UIQPUMQHPZXFLD-KPKJPENVSA-N	-1	1	355.362	5.090	50	10		FKCAMM
O=C1[N-]C(=S)C(=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)S1	ZINC000001269272	209387592	/nfs/dbraw/zinc/38/75/92/209387592.db2.gz	BNICTTPZJBHHAR-WUXMJOGZSA-N	-1	1	356.255	5.378	50	10		FKCAMM
Cc1[n-]n(-c2ccccc2)c(=O)c1C(=Nc1cccc(C)c1)c1ccccc1	ZINC000004117219	571355520	/nfs/dbraw/zinc/35/55/20/571355520.db2.gz	DYHIHBPUPTXPTJ-FCQUAONHSA-N	-1	1	367.452	5.241	50	10		FKCAMM
O=S(=O)([N-]c1ccc(/N=N/c2ccccc2)cc1)c1ccc(F)cc1	ZINC000004618165	207032838	/nfs/dbraw/zinc/03/28/38/207032838.db2.gz	UZTFAMPIPLXREW-QZQOTICOSA-N	-1	1	355.394	5.042	50	10		FKCAMM
O=C1[N-]C(=S)S/C1=C\c1ccc(Sc2cccc3ccccc32)o1	ZINC000005025800	204186152	/nfs/dbraw/zinc/18/61/52/204186152.db2.gz	XFGIVYHYWHKSLA-GDNBJRDFSA-N	-1	1	369.492	5.073	50	10		FKCAMM
O=C1[N-]C(=S)S/C1=C/c1ccc(-c2ccc(Cl)cc2Cl)s1	ZINC000005554964	570669347	/nfs/dbraw/zinc/66/93/47/570669347.db2.gz	YCEIKAJRURQIOW-WUXMJOGZSA-N	-1	1	372.323	5.211	50	10		FKCAMM
CCCCc1cc(=O)oc2c(C)c([O-])c(CNc3cc(C)ccc3C)cc12	ZINC000008741355	204342072	/nfs/dbraw/zinc/34/20/72/204342072.db2.gz	ZWXJKMAGWFGKMY-UHFFFAOYSA-N	-1	1	365.473	5.379	50	10		FKCAMM
CCCCc1cc(=O)oc2c(C)c([O-])c(CNc3cccc(C)c3C)cc12	ZINC000008744491	570687184	/nfs/dbraw/zinc/68/71/84/570687184.db2.gz	VLSYDZYLOSKLDT-UHFFFAOYSA-N	-1	1	365.473	5.379	50	10		FKCAMM
CCCCc1cc(=O)oc2c1ccc([O-])c2CNc1cc(C)ccc1C	ZINC000008914771	571071868	/nfs/dbraw/zinc/07/18/68/571071868.db2.gz	SCIVWTFINGSUDX-UHFFFAOYSA-N	-1	1	351.446	5.070	50	10		FKCAMM
O=C1[N-]C(=S)C(=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)S1	ZINC000013073859	570773331	/nfs/dbraw/zinc/77/33/31/570773331.db2.gz	BNICTTPZJBHHAR-SDQBBNPISA-N	-1	1	356.255	5.378	50	10		FKCAMM
Cc1cc(C=C2SC(=O)[N-]C2=O)c(C)n1-c1ccc(-c2ccccc2)cc1	ZINC000013635252	220080174	/nfs/dbraw/zinc/08/01/74/220080174.db2.gz	FLXJSXUCSQKTMW-MOSHPQCFSA-N	-1	1	374.465	5.085	50	10		FKCAMM
CC1=NN(c2ccc3ccccc3c2)C(=O)/C1=C\c1ccc([O-])c(Cl)c1	ZINC000015016591	570829668	/nfs/dbraw/zinc/82/96/68/570829668.db2.gz	RWBGAJDXUCSVJJ-ZDLGFXPLSA-N	-1	1	362.816	5.005	50	10		FKCAMM
O=C1[N-]C(=S)C(=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)S1	ZINC000016755258	220194014	/nfs/dbraw/zinc/19/40/14/220194014.db2.gz	UIQPUMQHPZXFLD-GHXNOFRVSA-N	-1	1	355.362	5.090	50	10		FKCAMM
Cc1ccc(S(=O)(=O)[N-]c2ccc(/N=N/c3ccccc3)cc2)cc1	ZINC000018046778	570806482	/nfs/dbraw/zinc/80/64/82/570806482.db2.gz	SVJQMMYDUVJOOR-QZQOTICOSA-N	-1	1	351.431	5.211	50	10		FKCAMM
Cc1ccc([C@@H](Nc2cccc(C)[nH+]2)c2ccc3cccnc3c2O)s1	ZINC000075280287	571159648	/nfs/dbraw/zinc/15/96/48/571159648.db2.gz	CFQOQWKLBZBYLG-FQEVSTJZSA-N	-1	1	361.470	5.215	50	10		FKCAMM
Cc1ccc([C@H](Nc2cccc(C)[nH+]2)c2ccc3cccnc3c2O)s1	ZINC000075280288	571159669	/nfs/dbraw/zinc/15/96/69/571159669.db2.gz	CFQOQWKLBZBYLG-HXUWFJFHSA-N	-1	1	361.470	5.215	50	10		FKCAMM
CC1=NN(c2ccccc2)C(=S)C1=CNc1c(Cl)cccc1Cl	ZINC000100371268	222243119	/nfs/dbraw/zinc/24/31/19/222243119.db2.gz	ZEBQBUQBNSWNBF-JLHYYAGUSA-N	-1	1	362.285	5.513	50	10		FKCAMM
O=S(=O)([N-]c1ccc(N=Nc2ccccc2)cc1)c1ccc(F)cc1	ZINC000252630442	571289530	/nfs/dbraw/zinc/28/95/30/571289530.db2.gz	UZTFAMPIPLXREW-UHFFFAOYSA-N	-1	1	355.394	5.042	50	10		FKCAMM