smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(Cc1nc(=O)c2sccc2[n-]1)c1ccc(-c2ccc(F)cc2)nn1	ZINC000160567936	495993659	/nfs/dbraw/zinc/99/36/59/495993659.db2.gz	UYQYOKKIAIFFNK-UHFFFAOYSA-N	-1	0	367.409	3.217	10	70		FGIERM
O=C(c1ccc(Cl)c(Cl)c1[O-])N1CCC(N2CCCCC2=O)CC1	ZINC000160496987	495976439	/nfs/dbraw/zinc/97/64/39/495976439.db2.gz	DKDWXRVWZJVHRG-UHFFFAOYSA-N	-1	0	371.264	3.316	10	70		FGIERM
CCCS(=O)(=O)[N-]c1ccccc1C(=O)N[C@@H](C)c1ccc(C)o1	ZINC000160167877	495899994	/nfs/dbraw/zinc/89/99/94/495899994.db2.gz	PYDAUFGKVZIDDI-ZDUSSCGKSA-N	-1	0	350.440	3.231	10	70		FGIERM
COc1ccc(NC(=O)[C@@H]2C[C@H]2C2CCCCC2)cc1NS(C)(=O)=O	ZINC000159859911	495826567	/nfs/dbraw/zinc/82/65/67/495826567.db2.gz	WAKJJRILTPNARN-LSDHHAIUSA-N	-1	0	366.483	3.222	10	70		FGIERM
Cc1ccccc1[C@H](C)NC(=O)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000161102712	496104252	/nfs/dbraw/zinc/10/42/52/496104252.db2.gz	PSIBMZZOOYJGLL-LBPRGKRZSA-N	-1	0	356.451	3.196	10	70		FGIERM
CN(Cc1nc(=O)c2sccc2[n-]1)c1nn2cc(C(C)(C)C)nc2s1	ZINC000160634431	496008194	/nfs/dbraw/zinc/00/81/94/496008194.db2.gz	SYYRDBWMTKROFN-UHFFFAOYSA-N	-1	0	374.495	3.023	10	70		FGIERM
CCC1CCC(NC(=O)CCc2c(C)nc(-c3cccnc3)[nH]c2=O)CC1	ZINC000159861571	495826628	/nfs/dbraw/zinc/82/66/28/495826628.db2.gz	XQEMDCSHROTAGX-UHFFFAOYSA-N	-1	0	368.481	3.158	10	70		FGIERM
COc1ccc(NC(=O)[C@H]2C[C@H]2C2CCCCC2)cc1NS(C)(=O)=O	ZINC000159860060	495826513	/nfs/dbraw/zinc/82/65/13/495826513.db2.gz	WAKJJRILTPNARN-GJZGRUSLSA-N	-1	0	366.483	3.222	10	70		FGIERM
CCCS(=O)(=O)[N-]c1ccccc1C(=O)N[C@H](C)c1ccc(C)o1	ZINC000160168024	495900098	/nfs/dbraw/zinc/90/00/98/495900098.db2.gz	PYDAUFGKVZIDDI-CYBMUJFWSA-N	-1	0	350.440	3.231	10	70		FGIERM