smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1sccc1Br	ZINC000037771870	202364013	/nfs/dbraw/zinc/36/40/13/202364013.db2.gz	MERWBFWUSVYVPB-IUCAKERBSA-N	1	2	346.240	5.201	20	0		EKADLO
C[C@@H]([NH2+][C@@H](C)c1sccc1Br)c1c(F)cccc1F	ZINC000037771871	213165027	/nfs/dbraw/zinc/16/50/27/213165027.db2.gz	MERWBFWUSVYVPB-BDAKNGLRSA-N	1	2	346.240	5.201	20	0		EKADLO
C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1sccc1Br	ZINC000037771872	213166222	/nfs/dbraw/zinc/16/62/22/213166222.db2.gz	MERWBFWUSVYVPB-DTWKUNHWSA-N	1	2	346.240	5.201	20	0		EKADLO
C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1sccc1Br	ZINC000037771873	213165427	/nfs/dbraw/zinc/16/54/27/213165427.db2.gz	MERWBFWUSVYVPB-RKDXNWHRSA-N	1	2	346.240	5.201	20	0		EKADLO
Cc1csc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2Cl)n1	ZINC000038091058	213200313	/nfs/dbraw/zinc/20/03/13/213200313.db2.gz	SVUZQKCMPGKEEO-QMMMGPOBSA-N	1	2	335.687	5.263	20	0		EKADLO
Cc1csc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2Cl)n1	ZINC000038091059	213201363	/nfs/dbraw/zinc/20/13/63/213201363.db2.gz	SVUZQKCMPGKEEO-MRVPVSSYSA-N	1	2	335.687	5.263	20	0		EKADLO
O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1sccc1-c1ccccc1	ZINC000072058450	216000525	/nfs/dbraw/zinc/00/05/25/216000525.db2.gz	ZVQNOQKHRFTTEI-UHFFFAOYSA-N	1	2	345.427	5.058	20	0		EKADLO
O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1cccc2ccccc21	ZINC000078651699	217095923	/nfs/dbraw/zinc/09/59/23/217095923.db2.gz	MIMXLAALLUDVTO-UHFFFAOYSA-N	1	2	340.382	5.279	20	0		EKADLO
Cc1cc(C)c(NC(=O)c2ccc(-c3ccccc3Cl)o2)c(C)[nH+]1	ZINC000097040282	218926889	/nfs/dbraw/zinc/92/68/89/218926889.db2.gz	BYNZJBVPCPSURB-UHFFFAOYSA-N	1	2	340.810	5.173	20	0		EKADLO
Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccc(F)cc3F)cs2)cc1	ZINC000098069512	203982534	/nfs/dbraw/zinc/98/25/34/203982534.db2.gz	LDLPDCPTILCBCO-ZDUSSCGKSA-N	1	2	344.430	5.248	20	0		EKADLO