smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1c(COc2ccc(C=NNC3=[NH+]CCCN3)cc2)c[n+]2cc(C(F)(F)F)ccc12	ZINC000026819672	563036786	/nfs/dbraw/zinc/03/67/86/563036786.db2.gz	UCUSOWRUPKNQFZ-LUOAPIJWSA-N	2	0	431.442	2.634	1	30		IFEFRP
CCOC(=O)N1C/C(=C\c2ccc(C(N)=[NH2+])cc2)C(=O)/C(=C/c2ccc(C(N)=[NH2+])cc2)C1	ZINC000013803391	563008119	/nfs/dbraw/zinc/00/81/19/563008119.db2.gz	TWZIVIWYTGUGQA-AYKLPDECSA-N	2	0	431.496	2.763	1	30		IFEFRP
CCOC(=O)N1C/C(=C/c2ccc(C(N)=[NH2+])cc2)C(=O)/C(=C\c2ccc(C(N)=[NH2+])cc2)C1	ZINC000013803401	563008128	/nfs/dbraw/zinc/00/81/28/563008128.db2.gz	TWZIVIWYTGUGQA-YZLQMOBTSA-N	2	0	431.496	2.763	1	30		IFEFRP
CCOC(=O)C1=C(c2ccccc2)c2ccc(OCCN3CC[NH+](C)CC3)cc2C1[N+](C)=O	ZINC000101141169	581098700	/nfs/dbraw/zinc/09/87/00/581098700.db2.gz	FZMNVKASGCNVIQ-AZPGRJICSA-N	2	0	449.551	2.621	1	30		IFEFRP
CN(C)c1ccc(CN(CCC[NH2+]CCCC[NH3+])C(=O)CCCCCCC(=O)NO)cc1	ZINC000029052472	563073111	/nfs/dbraw/zinc/07/31/11/563073111.db2.gz	QAUFUBUHMOIWCR-UHFFFAOYSA-N	2	0	449.640	2.646	1	30		IFEFRP
CCOC(=O)N1C/C(=C\c2ccc(C(N)=[NH2+])cc2)C(=O)/C(=C\c2ccc(C(N)=[NH2+])cc2)C1	ZINC000013803396	563008134	/nfs/dbraw/zinc/00/81/34/563008134.db2.gz	TWZIVIWYTGUGQA-UHWBUFEVSA-N	2	0	431.496	2.763	1	30		IFEFRP
C[N+]1(CC(=O)c2ccc(-c3ccc(C(=O)C[N+]4(C)CCOCC4)cc3)cc2)CCOCC1	ZINC000027646404	563045062	/nfs/dbraw/zinc/04/50/62/563045062.db2.gz	HHMTYUFUVZLXEM-UHFFFAOYSA-N	2	0	438.568	2.673	1	30		IFEFRP
COc1ccc2c(c1)/C(=N\OCC[NH+](C)C)c1c-2c(N2CC[NH2+]CC2)nc2ccccc12	ZINC000029055460	563073410	/nfs/dbraw/zinc/07/34/10/563073410.db2.gz	KBUNXEFDKFVTOH-ZZIIXHQDSA-N	2	0	431.540	2.964	1	30		IFEFRP