smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1c(O)c(Cl)c(Cl)cc1Cl	ZINC000002010703	229249509	/nfs/dbraw/zinc/24/95/09/229249509.db2.gz	LZHZRJKVYOHNTJ-UHFFFAOYSA-N	0	2	213.447	3.058	10	10	in-vitro	BGCELN
O=C1c2ccccc2C(O)=C2C(F)=CCC(F)=C12	ZINC000097673592	384543927	/nfs/dbraw/zinc/54/39/27/384543927.db2.gz	JUUXTXUGVMKNBZ-VXGBXAGGSA-N	0	2	246.212	3.018	10	10		BGCELN
Cc1cc(Cl)cc2sc(C=O)c(O)c21	ZINC000098179581	178064653	/nfs/dbraw/zinc/06/46/53/178064653.db2.gz	UFXWUTQIVHZRSZ-UHFFFAOYSA-N	0	2	226.684	3.381	10	10		BGCELN
O=C1c2ccccc2C(O)=C2C(F)=CCC(F)=C12	ZINC000100101976	384616811	/nfs/dbraw/zinc/61/68/11/384616811.db2.gz	JUUXTXUGVMKNBZ-RYUDHWBXSA-N	0	2	246.212	3.018	10	10		BGCELN
O=C1c2ccccc2C(O)=C2C(F)=CCC(F)=C12	ZINC000100101978	384616418	/nfs/dbraw/zinc/61/64/18/384616418.db2.gz	JUUXTXUGVMKNBZ-TXEJJXNPSA-N	0	2	246.212	3.018	10	10		BGCELN
Oc1csc2c1cccc2Br	ZINC000148082111	183305437	/nfs/dbraw/zinc/30/54/37/183305437.db2.gz	QBFZXKFRHFXMPN-UHFFFAOYSA-N	0	2	229.098	3.369	10	10		BGCELN
Oc1csc2cc(Br)ccc12	ZINC000230556416	345612650	/nfs/dbraw/zinc/61/26/50/345612650.db2.gz	ADMPRMYGWXUCPR-UHFFFAOYSA-N	0	2	229.098	3.369	10	10		BGCELN
CC[C@H](NO)c1cc(Cl)cc(Cl)c1O	ZINC000306266490	359489170	/nfs/dbraw/zinc/48/91/70/359489170.db2.gz	GEOUTFKPFOCLJA-QMMMGPOBSA-N	0	2	236.098	3.129	10	10		BGCELN
CC[C@@H](NO)c1cc(Cl)cc(Cl)c1O	ZINC000306880730	351280117	/nfs/dbraw/zinc/28/01/17/351280117.db2.gz	GEOUTFKPFOCLJA-MRVPVSSYSA-N	0	2	236.098	3.129	10	10		BGCELN