smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc(/C=[NH+]/Cc2ccncc2)cc1	ZINC000019808693	387249804	/nfs/dbraw/zinc/24/98/04/387249804.db2.gz	HQTOVXNLEFHZOL-GZTJUZNOSA-N	2	0	239.322	2.767	50	30		BFEARP
C=CC[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1	ZINC000130743026	166396652	/nfs/dbraw/zinc/39/66/52/166396652.db2.gz	JYYRWVVLZZWJPR-UKRRQHHQSA-N	2	0	236.403	2.805	50	30		BFEARP
C=CC[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1	ZINC000130743230	166397276	/nfs/dbraw/zinc/39/72/76/166397276.db2.gz	JYYRWVVLZZWJPR-DZGCQCFKSA-N	2	0	236.403	2.805	50	30		BFEARP
C=CC[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1	ZINC000130742815	166398025	/nfs/dbraw/zinc/39/80/25/166398025.db2.gz	JYYRWVVLZZWJPR-ZFWWWQNUSA-N	2	0	236.403	2.805	50	30		BFEARP
CC[NH+](CC)CCCC#CC[NH+]1CCCCC1	ZINC000001689789	342709209	/nfs/dbraw/zinc/70/92/09/342709209.db2.gz	JSMYVEANMICDFU-UHFFFAOYSA-N	2	0	236.403	2.598	50	30		BFEARP
C=CC[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1	ZINC000130742576	166397076	/nfs/dbraw/zinc/39/70/76/166397076.db2.gz	JYYRWVVLZZWJPR-HIFRSBDPSA-N	2	0	236.403	2.805	50	30		BFEARP
C=C(Cl)C[NH+]1CCC(C[NH+](CC)CC)CC1	ZINC000047978079	411171377	/nfs/dbraw/zinc/17/13/77/411171377.db2.gz	QBZLAGMADDUXOI-UHFFFAOYSA-N	2	0	244.810	2.793	50	30		BFEARP
CCCCCCC[NH2+]CCC[NH2+]CC	ZINC000100016239	384608353	/nfs/dbraw/zinc/60/83/53/384608353.db2.gz	WANOHQFDYKUULD-UHFFFAOYSA-N	2	0	200.370	2.546	50	30		BFEARP