smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]Cc1ccc(CCC[NH2+]CCNS(=O)(=O)c2cc3ccccc3s2)cc1	ZINC000034804673	581096661	/nfs/dbraw/zinc/09/66/61/581096661.db2.gz	RFMZEAQBWBSUBB-UHFFFAOYSA-N	2	0	403.573	2.861	1	0		HFAFRP
NC(=[NH2+])c1cccc([C@H]2Oc3ccccc3N(CCCCC[NH+]3CCOCC3)C2=O)c1	ZINC000012355162	132358890	/nfs/dbraw/zinc/35/88/90/132358890.db2.gz	HTSLTPZBBZPAAC-JOCHJYFZSA-N	2	0	422.529	2.940	1	0		HFAFRP
Cc1cccc2cc(C[NH2+]CCCN3CCCC3=O)c(N3CC[N@@H+]4CCC[C@@H]4C3)nc12	ZINC000012130112	132354514	/nfs/dbraw/zinc/35/45/14/132354514.db2.gz	AUAMICBMCFAYQR-JOCHJYFZSA-N	2	0	421.589	2.930	1	0		HFAFRP
Cc1nc2ccc(S(=O)(=O)NCC[NH2+]CCCc3ccc(C[NH3+])cc3)cc2s1	ZINC000034804694	581093953	/nfs/dbraw/zinc/09/39/53/581093953.db2.gz	QCOWDIVJHRGAHU-UHFFFAOYSA-N	2	0	418.588	2.564	1	0		HFAFRP
C[C@@H]1CCCC[NH+]1C[C@@H](O)COc1ccc(OC[C@@H](O)C[N@H+]2CCCC[C@@H]2C)cc1	ZINC000005487001	557657049	/nfs/dbraw/zinc/65/70/49/557657049.db2.gz	SUXCVKYOWFEMAD-COPRSSIGSA-N	2	0	420.594	2.915	1	0		HFAFRP
NC(=[NH2+])c1cccc([C@@H]2Oc3ccccc3N(CCCCC[NH+]3CCOCC3)C2=O)c1	ZINC000012355160	132358911	/nfs/dbraw/zinc/35/89/11/132358911.db2.gz	HTSLTPZBBZPAAC-QFIPXVFZSA-N	2	0	422.529	2.940	1	0		HFAFRP
[NH3+]Cc1ccc(CCC[NH2+]CCNS(=O)(=O)c2ccc3sccc3c2)cc1	ZINC000034804665	581096692	/nfs/dbraw/zinc/09/66/92/581096692.db2.gz	GJNNFTSDQAHBMY-UHFFFAOYSA-N	2	0	403.573	2.861	1	0		HFAFRP
[NH3+]CCC[NH2+]CCCC[NH2+]CC1CCN(C(=O)Cc2cccc3ccccc32)CC1	ZINC000013836731	581101067	/nfs/dbraw/zinc/10/10/67/581101067.db2.gz	WRMPFWWLAHPGGR-UHFFFAOYSA-N	3	0	410.606	2.929	1	0		HFAFRP