smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N=C1c2ccccc2C(=O)c2c(NCC[NH2+]CCO)ccc(O)c21	ZINC000027628817	202158613	/nfs/dbraw/zinc/15/86/13/202158613.db2.gz	PPNDCALYNGCOIX-UHFFFAOYSA-N	1	0	325.368	1.347	1	10		EDCFRO
Cn1cc2c3c1cccc3[C@@H]1C[C@@H](C(=O)OCCO)C[N@H+](C)[C@@H]1C2	ZINC000040676555	213366610	/nfs/dbraw/zinc/36/66/10/213366610.db2.gz	KZQKCTXYGGRARK-UKPHBRMFSA-N	1	0	328.412	1.674	1	10		EDCFRO
COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1OC(=O)Nc1ccc(N)cc1)[N@@H+]2C	ZINC000027769586	202160487	/nfs/dbraw/zinc/16/04/87/202160487.db2.gz	CYBZNQQOIMXQCO-CBBWQLFWSA-N	1	0	333.388	1.842	1	10		EDCFRO
CCOC(=O)N1CCN(/[N+](O)=N/Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000040860413	202464973	/nfs/dbraw/zinc/46/49/73/202464973.db2.gz	WIQDVMADBTVXSF-JXAWBTAJSA-N	1	0	339.308	1.540	1	10		EDCFRO
COc1cccc2c1C(=O)c1c(OC)cc(C[NH2+]CCO)cc1C2=O	ZINC000029335774	202185930	/nfs/dbraw/zinc/18/59/30/202185930.db2.gz	GIVQVQSGDSHCDY-UHFFFAOYSA-N	1	0	341.363	1.561	1	10		EDCFRO
O=C1c2cccc(O)c2C(=O)c2c(O)cc(C[NH2+]CCCO)cc21	ZINC000029342689	202185250	/nfs/dbraw/zinc/18/52/50/202185250.db2.gz	PMKFELFILLXAEU-UHFFFAOYSA-N	1	0	327.336	1.345	1	10		EDCFRO