smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(NCC1(c2ccsc2)CCCC1)c1ccsc1	ZINC000217479997	567170506	/nfs/dbraw/zinc/17/05/06/567170506.db2.gz	CJAXPHSASRFWRY-UHFFFAOYSA-N	0	0	291.441	4.051	50	70		CIIARN
COc1ccc(NC(=O)c2ccc(Cl)cc2C)c(C)c1	ZINC000161257238	188518451	/nfs/dbraw/zinc/51/84/51/188518451.db2.gz	VPXVUJRSCUUJEO-UHFFFAOYSA-N	0	0	289.762	4.218	50	70		CIIARN
c1ccc2c(c1)CCC[C@H]2Sc1ccc2nccnc2n1	ZINC000160444428	566942037	/nfs/dbraw/zinc/94/20/37/566942037.db2.gz	GRJGSCJZLDNGLA-OAHLLOKOSA-N	0	0	293.395	4.195	50	70		CIIARN
c1ccc(CCC[SiH2]CCCc2ccccc2)cc1	ZINC000169818244	328756407	/nfs/dbraw/zinc/75/64/07/328756407.db2.gz	PHGRKAMVHIWHJL-UHFFFAOYSA-N	0	0	268.476	4.257	50	70		CIIARN
COc1ccc(-c2coc3ccc(OCC(C)=O)cc32)cc1	ZINC000217645127	567174056	/nfs/dbraw/zinc/17/40/56/567174056.db2.gz	IHVZEQOOYNFNEQ-UHFFFAOYSA-N	0	0	296.322	4.076	50	70		CIIARN
Cc1nc(-c2ccccc2NC(=O)NC(C)(C)C)cs1	ZINC000218669422	567187046	/nfs/dbraw/zinc/18/70/46/567187046.db2.gz	LKSVFXWBUFIBIA-UHFFFAOYSA-N	0	0	289.404	4.039	50	70		CIIARN
c1ccc2c(c1)CCC[C@@H]2Sc1ccc2nccnc2n1	ZINC000160444299	566941820	/nfs/dbraw/zinc/94/18/20/566941820.db2.gz	GRJGSCJZLDNGLA-HNNXBMFYSA-N	0	0	293.395	4.195	50	70		CIIARN
O=C(NCC1(c2ccsc2)CCCC1)c1cccs1	ZINC000217479896	567170154	/nfs/dbraw/zinc/17/01/54/567170154.db2.gz	HRNFSQZPSJBJEA-UHFFFAOYSA-N	0	0	291.441	4.051	50	70		CIIARN
CN(C(=O)Nc1ccccc1C(F)(F)F)c1ccccc1	ZINC000217304209	570307527	/nfs/dbraw/zinc/30/75/27/570307527.db2.gz	VWFUEDVZIFTNQX-UHFFFAOYSA-N	0	0	294.276	4.374	50	70		CIIARN
Cc1nc(-c2ccccc2NC(=O)C2CCCC2)cs1	ZINC000218569721	567185483	/nfs/dbraw/zinc/18/54/83/567185483.db2.gz	SSCUEWJESMJMLT-UHFFFAOYSA-N	0	0	286.400	4.247	50	70		CIIARN