smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)CCNC1=CC2=[NH+]CCc3c[nH]c(c32)C1=O	ZINC000026378715	171481010	/nfs/dbraw/zinc/48/10/10/171481010.db2.gz	HXXAGQQFMQCIBN-UHFFFAOYSA-N	2	0	258.325	0.591	1	30		CCEFRP
C[C@]12CCC(N=NC(N)=[NH2+])=CC1CC[C@@H]2CN=NC(N)=[NH2+]	ZINC000043663966	175086279	/nfs/dbraw/zinc/08/62/79/175086279.db2.gz	PKECFYWXEKWVFJ-SXYIVNANSA-N	2	0	290.375	0.012	1	30		CCEFRP
NC(=O)c1cc[n+](CCC[n+]2cccc(/C=N/O)c2)cc1	ZINC000038657568	174151185	/nfs/dbraw/zinc/15/11/85/174151185.db2.gz	UITVSQIMDSETDS-GZTJUZNOSA-P	2	0	286.335	0.259	1	30		CCEFRP
CC(=NNC(N)=[NH2+])c1cccc(C(C)=NNC(N)=[NH2+])c1	ZINC000027323638	171513236	/nfs/dbraw/zinc/51/32/36/171513236.db2.gz	OEBLRFIWEVKLAD-ZEELXFFVSA-N	2	0	274.332	0.101	1	30		CCEFRP
O/N=C/c1ccc[n+](CCC[n+]2cccc(/C=N\O)c2)c1	ZINC000045338819	175361385	/nfs/dbraw/zinc/36/13/85/175361385.db2.gz	FMBTYRXPBILFGO-VRNBXGKJSA-P	2	0	286.335	0.968	1	30		CCEFRP
OCc1cc[n+](CCC[n+]2ccc(/C=N/O)cc2)cc1	ZINC000066166283	527632527	/nfs/dbraw/zinc/63/25/27/527632527.db2.gz	YFFWMYAYWRKALW-UHFFFAOYSA-O	2	0	273.336	0.652	1	30		CCEFRP