smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCC[SiH](CCCCCCCC)CCCCCCCC	ZINC000169743523	206255425	/nfs/dbraw/zinc/25/54/25/206255425.db2.gz	JBAALNCKQCMFDH-UHFFFAOYSA-N	0	0	368.766	9.295	50	70		FKIARN
CC(=O)c1ccc(C(=O)Nc2cccc(-c3nc4ccccc4s3)c2)cc1	ZINC000217461879	571347583	/nfs/dbraw/zinc/34/75/83/571347583.db2.gz	CEXGEZZILGRLKS-UHFFFAOYSA-N	0	0	372.449	5.418	50	70		FKIARN
O=C(Nc1cccs1)N1CCS[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000217633081	206364003	/nfs/dbraw/zinc/36/40/03/206364003.db2.gz	XSKNLTYIBSXTEV-CYBMUJFWSA-N	0	0	358.410	5.046	50	70		FKIARN
O=C(Nc1cccs1)N1CCS[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000217633148	571349465	/nfs/dbraw/zinc/34/94/65/571349465.db2.gz	XSKNLTYIBSXTEV-ZDUSSCGKSA-N	0	0	358.410	5.046	50	70		FKIARN
O=C(c1ccccc1F)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000217640903	571349541	/nfs/dbraw/zinc/34/95/41/571349541.db2.gz	DQJZDYVKNDJETD-MRXNPFEDSA-N	0	0	356.249	5.020	50	70		FKIARN
O=C(c1ccccc1F)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000217640956	571349532	/nfs/dbraw/zinc/34/95/32/571349532.db2.gz	DQJZDYVKNDJETD-INIZCTEOSA-N	0	0	356.249	5.020	50	70		FKIARN
Cc1cc(C(=O)N2CCS[C@@H]2c2ccc(Cl)c(Cl)c2)c(C)o1	ZINC000217641054	571349537	/nfs/dbraw/zinc/34/95/37/571349537.db2.gz	MHTWXYAFDOTODY-MRXNPFEDSA-N	0	0	356.274	5.091	50	70		FKIARN
Cc1cc(C(=O)N2CCS[C@H]2c2ccc(Cl)c(Cl)c2)c(C)o1	ZINC000217641138	206364133	/nfs/dbraw/zinc/36/41/33/206364133.db2.gz	MHTWXYAFDOTODY-INIZCTEOSA-N	0	0	356.274	5.091	50	70		FKIARN
Cc1ccccc1NC(=O)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000217642869	222673410	/nfs/dbraw/zinc/67/34/10/222673410.db2.gz	FBBDCMPJMDWFOK-MRXNPFEDSA-N	0	0	367.301	5.581	50	70		FKIARN
Cc1ccccc1NC(=O)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000217642946	571349610	/nfs/dbraw/zinc/34/96/10/571349610.db2.gz	FBBDCMPJMDWFOK-INIZCTEOSA-N	0	0	367.301	5.581	50	70		FKIARN
O=C(Nc1ccccc1F)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000217643056	206364007	/nfs/dbraw/zinc/36/40/07/206364007.db2.gz	XSPOVMWCBIZHSB-OAHLLOKOSA-N	0	0	371.264	5.412	50	70		FKIARN
O=C(Nc1ccccc1F)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000217643136	571349590	/nfs/dbraw/zinc/34/95/90/571349590.db2.gz	XSPOVMWCBIZHSB-HNNXBMFYSA-N	0	0	371.264	5.412	50	70		FKIARN
Cc1nc(-c2ccccc2NC(=O)c2ccccc2C(F)(F)F)cs1	ZINC000217650186	206364591	/nfs/dbraw/zinc/36/45/91/206364591.db2.gz	XCSPOTSWWJAAOI-UHFFFAOYSA-N	0	0	362.376	5.390	50	70		FKIARN
Cc1nc(-c2ccccc2NC(=O)c2ccccc2Br)cs1	ZINC000217650628	571349580	/nfs/dbraw/zinc/34/95/80/571349580.db2.gz	JUNGYODWWKFILK-UHFFFAOYSA-N	0	0	373.275	5.133	50	70		FKIARN
COc1ccc(-c2coc3ccc(OC/C=C/c4ccccc4)cc23)cc1	ZINC000217855253	523160345	/nfs/dbraw/zinc/16/03/45/523160345.db2.gz	ARWRQEPFYJJFRH-VMPITWQZSA-N	0	0	356.421	6.201	50	70		FKIARN
O=C(c1ccc(-c2cccc(F)c2)nc1)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000218145403	568218787	/nfs/dbraw/zinc/21/87/87/568218787.db2.gz	IPVKEMXVUWSTAB-OAQYLSRUSA-N	0	0	364.395	5.004	50	70		FKIARN
O=C(c1ccc(-c2cccc(F)c2)nc1)N1CCC[C@H]1c1ccc(F)cc1	ZINC000218145472	568218772	/nfs/dbraw/zinc/21/87/72/568218772.db2.gz	IPVKEMXVUWSTAB-NRFANRHFSA-N	0	0	364.395	5.004	50	70		FKIARN
Cc1nc(Cl)sc1C(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000218432367	571353855	/nfs/dbraw/zinc/35/38/55/571353855.db2.gz	UNPSLRVUYZBYAU-UHFFFAOYSA-N	0	0	370.905	5.057	50	70		FKIARN
Cc1nc(-c2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cs1	ZINC000218591173	571354839	/nfs/dbraw/zinc/35/48/39/571354839.db2.gz	CKYSSRUHCCWJCU-UHFFFAOYSA-N	0	0	350.487	5.668	50	70		FKIARN
CC(C)NC(=O)Nc1ccccc1-c1csc(-c2ccccc2F)n1	ZINC000218675795	571355410	/nfs/dbraw/zinc/35/54/10/571355410.db2.gz	QHPRZQLYGXKBSS-UHFFFAOYSA-N	0	0	355.438	5.146	50	70		FKIARN