smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc2c(Nc3cc(N)cc(CO)c3)c3cccc(C(=O)NCC[NH+](C)C)c3[nH+]c12	ZINC000027524465	563045387	/nfs/dbraw/zinc/04/53/87/563045387.db2.gz	HRNSJWPFXAQDHW-UHFFFAOYSA-N	2	2	459.550	3.506	1	10		JHCFLP
Cc1csc2c1c(NCC[NH+](C)C)c1c(c2NCC[NH+](C)C)C(=O)c2ccccc2C1=O	ZINC000040395756	563139412	/nfs/dbraw/zinc/13/94/12/563139412.db2.gz	FXWJBUAKZXGVFQ-UHFFFAOYSA-N	2	2	450.608	3.932	1	10		JHCFLP
C[NH+](C)CCNC(=O)c1ccc(Cl)c2c(Nc3ccc(S(N)(=O)=O)cc3)c3ccccc3[nH+]c12	ZINC000005616068	562934488	/nfs/dbraw/zinc/93/44/88/562934488.db2.gz	NBJBYEWUDQCCEY-UHFFFAOYSA-N	2	2	498.008	3.724	1	10		JHCFLP
C[NH+]1CCN(C(=O)c2ccc3c(c2)[nH+]c2ccccc2c3NCCn2nnc3ccccc32)CC1	ZINC000045245010	563181524	/nfs/dbraw/zinc/18/15/24/563181524.db2.gz	YAIBPFDYPYBECE-UHFFFAOYSA-N	2	2	465.561	3.632	1	10		JHCFLP
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[NH+]3CCCCC3)ccc(NCC[NH+]3CCCCC3)c21	ZINC000031440417	563108006	/nfs/dbraw/zinc/10/80/06/563108006.db2.gz	AYSMOTYGSAVPCU-UHFFFAOYSA-N	2	2	492.620	3.669	1	10		JHCFLP