smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)(C)c1ccc(C[NH2+]CCCC[NH2+]CCCNC(=O)CCCCCC(=O)N[O-])cc1	ZINC000029052690	563073061	/nfs/dbraw/zinc/07/30/61/563073061.db2.gz	FSZHOSXMGMIRDI-UHFFFAOYSA-N	1	3	448.652	3.406	1	30		IGEFHO
CC(C)(C)c1ccc(C[NH2+]CCCC[NH2+]CCCNC(=O)CCCCC(=O)N[O-])cc1	ZINC000013674142	563000303	/nfs/dbraw/zinc/00/03/03/563000303.db2.gz	IEQZFKOUXPBNMO-UHFFFAOYSA-N	1	3	434.625	3.016	1	30		IGEFHO
C[NH2+]CCOc1cc(CC/C=C/C(=O)CCc2ccc(O)c(OC)c2)cc(C[NH2+]C)c1[O-]	ZINC000085597119	291356331	/nfs/dbraw/zinc/35/63/31/291356331.db2.gz	MGDJICIXSXWYBZ-FNORWQNLSA-N	1	3	442.556	3.115	1	30	biogenic,in-vitro	IGEFHO
Cn1c(COc2ccc(C=NNC(=N)N3CCCC3)cc2)c[n+]2cc(C(F)(F)F)ccc12	ZINC000026821375	563036902	/nfs/dbraw/zinc/03/69/02/563036902.db2.gz	XVENMPJJGQWYDI-KKMKTNMSSA-N	1	3	445.469	3.316	1	30		IGEFHO
C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4ccc(C#N)cc4)CC3)cc2)CC[NH2+]1	ZINC000095598489	563192193	/nfs/dbraw/zinc/19/21/93/563192193.db2.gz	DEGFRWDZKYNNIP-NRFANRHFSA-N	1	3	445.611	3.227	1	30		IGEFHO
NC(=[NH2+])NCCC[C@H](N)C(=O)N(Cc1c[nH]c2ccccc12)Cc1cccc2ccccc21	ZINC000013440120	562986222	/nfs/dbraw/zinc/98/62/22/562986222.db2.gz	BJCYJTZOIYTVTC-QHCPKHFHSA-N	1	3	442.567	3.231	1	30		IGEFHO
COc1ccc2c(c1)/C(=N\OCCC[NH+](C)C)c1c-2c(N2CCNCC2)nc2ccccc12	ZINC000029055452	563073422	/nfs/dbraw/zinc/07/34/22/563073422.db2.gz	PNUJPTIHYOIYLV-XLVZBRSZSA-N	1	3	445.567	3.354	1	30		IGEFHO