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=Cc1cc(Br)c(OCc2ccccc2)c(Br)c1	ZINC000916270830	717194514	/nfs/dbraw/zinc/19/45/14/717194514.db2.gz	PBLSMMIHDSHOLL-UHFFFAOYSA-O	1	0	484.212	3.947	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCCC[C@H]3CC[NH+]3CCCC3)c2C1	ZINC001165046538	721968009	/nfs/dbraw/zinc/96/80/09/721968009.db2.gz	GVDJCVRTBNDWKF-INIZCTEOSA-N	1	0	456.418	3.708	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)c2C1	ZINC001164619152	719069102	/nfs/dbraw/zinc/06/91/02/719069102.db2.gz	CJOHTFQWIHDENX-GHTZIAJQSA-N	1	0	490.435	3.964	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)c2C1	ZINC001164619185	719069387	/nfs/dbraw/zinc/06/93/87/719069387.db2.gz	CJOHTFQWIHDENX-RXVVDRJESA-N	1	0	490.435	3.964	20	50		JHGDRO
Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1C=NNC(=O)C[N+](C)(C)C	ZINC000916270828	717194021	/nfs/dbraw/zinc/19/40/21/717194021.db2.gz	OZYIXMKUDMAJQH-UHFFFAOYSA-O	1	0	471.379	3.892	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]43)c2C1	ZINC001164619187	719068836	/nfs/dbraw/zinc/06/88/36/719068836.db2.gz	CJOHTFQWIHDENX-WIYYLYMNSA-N	1	0	490.435	3.964	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCCC[C@@H]3CC[NH+]3CCCC3)c2C1	ZINC001165046539	721968104	/nfs/dbraw/zinc/96/81/04/721968104.db2.gz	GVDJCVRTBNDWKF-MRXNPFEDSA-N	1	0	456.418	3.708	20	50		JHGDRO
O=C(OCCCl)N1CCc2nc(Cl)nc(N3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)c2C1	ZINC001164619184	719069060	/nfs/dbraw/zinc/06/90/60/719069060.db2.gz	CJOHTFQWIHDENX-NQIIRXRSSA-N	1	0	490.435	3.964	20	50		JHGDRO
C[N+](C)(C)CC(=O)NN=Cc1cc(Br)cc(Br)c1OCc1ccccc1	ZINC000916270369	717193317	/nfs/dbraw/zinc/19/33/17/717193317.db2.gz	ANKFTGLEKOXQED-UHFFFAOYSA-O	1	0	484.212	3.947	20	50		JHGDRO