smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)CC(=O)NN=Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000745984674	717188849	/nfs/dbraw/zinc/18/88/49/717188849.db2.gz	WQVMDDWVNGZKSS-UHFFFAOYSA-O	1	0	380.390	3.654	20	50		GHGDRO
C[N+](C)(C)CC(=O)NN=C(CCSc1ccc(F)cc1)c1ccc(F)cc1	ZINC000794457638	717190583	/nfs/dbraw/zinc/19/05/83/717190583.db2.gz	SXWYINJREOKZCP-UHFFFAOYSA-O	1	0	392.495	3.674	20	50		GHGDRO
CC(C)(C)[Si](C)(C)OC[C@H]1CCCC[N@@H+]1Cc1ccncc1-c1nn[nH]n1	ZINC001573879908	950736358	/nfs/dbraw/zinc/73/63/58/950736358.db2.gz	OIFXMZHIQMIDSP-MRXNPFEDSA-N	1	0	388.592	3.638	20	50		GHGDRO
CC(=NNC(=O)C[N+](C)(C)C)c1ccc(Oc2ccc(F)cc2)cc1Cl	ZINC000794457618	717190356	/nfs/dbraw/zinc/19/03/56/717190356.db2.gz	SSXIRZNGYDKIBX-UHFFFAOYSA-O	1	0	378.855	3.818	20	50		GHGDRO
C[N+](C)(C)CC(=O)NN=Cc1c(Cl)cccc1OCc1ccccc1Cl	ZINC000917531245	717194081	/nfs/dbraw/zinc/19/40/81/717194081.db2.gz	DMYLMUDRZHFPBU-UHFFFAOYSA-O	1	0	395.310	3.729	20	50		GHGDRO
C[N+](C)(C)CC(=O)NN=Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1	ZINC000794456226	717189638	/nfs/dbraw/zinc/18/96/38/717189638.db2.gz	JOSFAODSFYLQIQ-UHFFFAOYSA-O	1	0	395.310	3.729	20	50		GHGDRO
Cc1cc(C=NNC(=O)C[N+](C)(C)C)c(C)n1-c1cccc(Cl)c1Cl	ZINC000916270375	717192651	/nfs/dbraw/zinc/19/26/51/717192651.db2.gz	ASWRTISIYCOTIP-UHFFFAOYSA-O	1	0	382.315	3.557	20	50		GHGDRO
CC(=NNC(=O)C[N+](C)(C)C)c1ccc(-c2ccc(Br)cc2)s1	ZINC000917565119	717194538	/nfs/dbraw/zinc/19/45/38/717194538.db2.gz	KRKKTWJMUNABII-UHFFFAOYSA-O	1	0	395.346	3.724	20	50		GHGDRO
CC(C)(C)[Si](C)(C)OC[C@@H]1CCCC[N@@H+]1Cc1ccncc1-c1nn[nH]n1	ZINC001573879907	950738025	/nfs/dbraw/zinc/73/80/25/950738025.db2.gz	OIFXMZHIQMIDSP-INIZCTEOSA-N	1	0	388.592	3.638	20	50		GHGDRO
Cc1cc(C=NNC(=O)C[N+](C)(C)C)cc(C)c1OCc1ccccc1Cl	ZINC000794454536	717188725	/nfs/dbraw/zinc/18/87/25/717188725.db2.gz	AFOWCZSSSWDJKY-UHFFFAOYSA-O	1	0	388.919	3.692	20	50		GHGDRO