smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCC[NH2+]C[C@H](N)CC[NH3+]	ZINC000043335327	175011081	/nfs/dbraw/zinc/01/10/81/175011081.db2.gz	CAJDFPMKGMISQB-MRXNPFEDSA-N	2	0	271.493	3.173	1	30		CGEFRP
CN(C)/C=[NH+]/c1cccc(-c2c[n+]3ccccc3s2)c1	ZINC000169318487	188657273	/nfs/dbraw/zinc/65/72/73/188657273.db2.gz	GGJPJXNSZCOVTE-SFQUDFHCSA-N	2	0	282.392	3.375	1	30		CGEFRP
CCCCC#CCC[n+]1cccc([C@@H]2CCC[N@@H+]2C)c1	ZINC000038695918	174153001	/nfs/dbraw/zinc/15/30/01/174153001.db2.gz	PUEDSFWLDTWPQJ-SFHVURJKSA-N	2	0	271.428	3.325	1	30		CGEFRP
CCCCCCCCCCCCCC(=O)NC(C[NH3+])C[NH3+]	ZINC000043352394	175020358	/nfs/dbraw/zinc/02/03/58/175020358.db2.gz	OJTHIEYLGBDOHW-UHFFFAOYSA-N	2	0	299.503	3.090	1	30		CGEFRP
c1cc(C[S+]2CCCC2)oc1C[S+]1CCCC1	ZINC000005855893	170147032	/nfs/dbraw/zinc/14/70/32/170147032.db2.gz	OCPCKCKUFHYUNP-UHFFFAOYSA-N	2	0	270.463	3.104	1	30		CGEFRP
CCCCCCCCCCCC[NH2+]C[C@@H](N)CC[NH3+]	ZINC000043335329	175011035	/nfs/dbraw/zinc/01/10/35/175011035.db2.gz	CAJDFPMKGMISQB-INIZCTEOSA-N	2	0	271.493	3.173	1	30		CGEFRP