smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[N-]=[N+]=N[C@@H]1CN(Cc2ccccc2)C[C@H]1N=[N+]=[N-]	ZINC000014982847	384252210	/nfs/dbraw/zinc/25/22/10/384252210.db2.gz	SJTPNWLLDKCASW-GHMZBOCLSA-N	0	1	243.274	2.860	40	10		BFCBMN
CCC[NH2+]Cc1cc(Br)ccc1[O-]	ZINC000050273156	169266024	/nfs/dbraw/zinc/26/60/24/169266024.db2.gz	BHOOUCPLMCUSLS-UHFFFAOYSA-N	0	1	244.132	2.654	40	10		BFCBMN
C[NH+](C)Cc1ccc2ccccc2c1[O-]	ZINC000001567979	397769347	/nfs/dbraw/zinc/76/93/47/397769347.db2.gz	JMXIFHGCDGVRBV-UHFFFAOYSA-N	0	1	201.269	2.607	40	10		BFCBMN
CCNc1cc(Nc2ccc(N)cc2)nc(C)n1	ZINC000217511763	170172699	/nfs/dbraw/zinc/17/26/99/170172699.db2.gz	OSUUSBQMUKBZPI-UHFFFAOYSA-N	0	1	243.314	2.543	40	10		BFCBMN
CC(C)[NH2+]Cc1cc(Br)ccc1[O-]	ZINC000011920614	167117683	/nfs/dbraw/zinc/11/76/83/167117683.db2.gz	ARMQLWCCAHFKCF-UHFFFAOYSA-N	0	1	244.132	2.653	40	10		BFCBMN
Nc1ccc(Oc2ccc3nc[nH]c3c2)cc1	ZINC000080443121	384558674	/nfs/dbraw/zinc/55/86/74/384558674.db2.gz	DNELCUCKVLCPIV-UHFFFAOYSA-N	0	1	225.251	2.937	40	10		BFCBMN
[N-]=[N+]=N[C@H]1CN(Cc2ccccc2)C[C@@H]1N=[N+]=[N-]	ZINC000014982928	188128442	/nfs/dbraw/zinc/12/84/42/188128442.db2.gz	SJTPNWLLDKCASW-QWRGUYRKSA-N	0	1	243.274	2.860	40	10		BFCBMN
[N-]=[N+]=NCC(=O)c1cc2ccccc2o1	ZINC000107339256	384485807	/nfs/dbraw/zinc/48/58/07/384485807.db2.gz	SVLNHPBCTQFFLO-UHFFFAOYSA-N	0	1	201.185	2.926	40	10		BFCBMN