smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(Cc1cc(C[NH+]2CCCC2)c(O)c(C[NH+]2CCCC2)c1)OCCc1cccs1	ZINC000026501780	563032792	/nfs/dbraw/zinc/03/27/92/563032792.db2.gz	VPPKCNAVOCQCAN-UHFFFAOYSA-N	2	1	428.598	3.974	1	10		IHCFMP
Cc1cccc2c(Nc3cc(N)cc(CO)c3)c3cccc(C(=O)NCC[NH+](C)C)c3[nH+]c12	ZINC000027524550	563043090	/nfs/dbraw/zinc/04/30/90/563043090.db2.gz	BXSUVYBYGMGNQF-UHFFFAOYSA-N	2	1	443.551	3.806	1	10		IHCFMP
O=C(Cc1cc(C[NH+]2CCCC2)c(O)c(C[NH+]2CCCC2)c1)OCCOc1ccccc1	ZINC000026568200	563033161	/nfs/dbraw/zinc/03/31/61/563033161.db2.gz	ADAJEBRZHXBOFS-UHFFFAOYSA-N	2	1	438.568	3.749	1	10		IHCFMP
CC[N@@H+](CCNC(=O)[C@H](C)[NH3+])Cc1cc(Nc2ccnc3cc(Cl)ccc32)ccc1O	ZINC000045286658	563128367	/nfs/dbraw/zinc/12/83/67/563128367.db2.gz	KPUHLEJPRONBGY-HNNXBMFYSA-N	2	1	441.963	3.623	1	10		IHCFMP
O=C(Cc1cc(C[NH+]2CCCC2)c(O)c(C[NH+]2CCCC2)c1)OCCc1ccsc1	ZINC000026566558	563033073	/nfs/dbraw/zinc/03/30/73/563033073.db2.gz	WLFMQOFGCCECOR-UHFFFAOYSA-N	2	1	428.598	3.974	1	10		IHCFMP