smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)CCn1nc2c3c1ccc(NCC[NH3+])c3C(=O)c1ccncc1-2	ZINC000001538982	204012207	/nfs/dbraw/zinc/01/22/07/204012207.db2.gz	SBRKGHGNFWALJA-UHFFFAOYSA-N	2	0	350.426	1.575	1	10		FDCFRP
C[NH+](C)CCCn1cc(CC[NH+](C)C)c2c1C(=O)c1cnccc1C2=O	ZINC000071331300	221343469	/nfs/dbraw/zinc/34/34/69/221343469.db2.gz	HREOHDIUHUSHJD-UHFFFAOYSA-N	2	0	354.454	1.714	1	10		FDCFRP
Cc1cccc2c(N)c3cccc(C(=O)NCCC[NH2+]CCN)c3[nH+]c12	ZINC000019372563	220253589	/nfs/dbraw/zinc/25/35/89/220253589.db2.gz	WFABAFAAIYXLOB-UHFFFAOYSA-N	2	0	351.454	1.947	1	10		FDCFRP
COc1cc(OC)c2c(c1)C(=O)c1cc(CNCC[NH3+])cc(OC)c1C2=O	ZINC000096932564	209162549	/nfs/dbraw/zinc/16/25/49/209162549.db2.gz	BFRGFAHFKYWVPZ-UHFFFAOYSA-N	2	0	370.405	1.536	1	10		FDCFRP
C[NH+](C)CCNc1ccc2c3c(nn2CC[NH3+])-c2cnccc2C(=O)c31	ZINC000000835581	210278398	/nfs/dbraw/zinc/27/83/98/210278398.db2.gz	KNKFPJFYDOSPTJ-UHFFFAOYSA-N	2	0	350.426	1.575	1	10		FDCFRP
C[NH2+]CCNc1ccc2c3c(nn2CC[NH3+])-c2c(O)ccc(O)c2C(=O)c31	ZINC000028759395	211498237	/nfs/dbraw/zinc/49/82/37/211498237.db2.gz	GBHLFKYNYFDFNN-UHFFFAOYSA-N	2	0	367.409	1.249	1	10		FDCFRP