smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
FC(F)(F)c1cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc(C(F)(F)F)c1	ZINC000003956324	204022383	/nfs/dbraw/zinc/02/23/83/204022383.db2.gz	QSADEYQVTBQHEC-UHFFFAOYSA-N	2	0	380.376	4.690	20	0		GJADRP
Cc1ccc(C[NH+]2CCC3(CCN(c4[nH+]ccc5c4ccn5C)CC3)CC2)cc1	ZINC001164759438	721043051	/nfs/dbraw/zinc/04/30/51/721043051.db2.gz	MHJUZYPURXUTGN-UHFFFAOYSA-N	2	0	388.559	4.764	20	0		GJADRP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(C)(C)C)cn3)C[C@H]21	ZINC001165025280	721831394	/nfs/dbraw/zinc/83/13/94/721831394.db2.gz	MOGDBMWHSGETQJ-STZQEDGTSA-N	2	0	378.564	4.511	20	0		GJADRP
Cc1cc2ccccc2c(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH+]1	ZINC001165028830	721818460	/nfs/dbraw/zinc/81/84/60/721818460.db2.gz	XTTGATYZUOLMQO-ZTCOLXNVSA-N	2	0	386.543	4.675	20	0		GJADRP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(C)(C)C)cn3)C[C@@H]21	ZINC001165025277	721831387	/nfs/dbraw/zinc/83/13/87/721831387.db2.gz	MOGDBMWHSGETQJ-BVYCBKJFSA-N	2	0	378.564	4.511	20	0		GJADRP
Cc1cc2ccccc2c(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH+]1	ZINC001165028821	721818548	/nfs/dbraw/zinc/81/85/48/721818548.db2.gz	XTTGATYZUOLMQO-OYDLWJJNSA-N	2	0	386.543	4.675	20	0		GJADRP
CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@H]2CC[NH+]2CCCC2)nc1	ZINC001165047876	721978069	/nfs/dbraw/zinc/97/80/69/721978069.db2.gz	BGHZEJHCEPMJJG-GOTSBHOMSA-N	2	0	384.612	4.863	20	0		GJADRP
Cc1cc2ccccc2c(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH+]1	ZINC001165028816	721818387	/nfs/dbraw/zinc/81/83/87/721818387.db2.gz	XTTGATYZUOLMQO-NKKJXINNSA-N	2	0	386.543	4.675	20	0		GJADRP
Cc1cc2ccccc2c(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH+]1	ZINC001165028825	721818672	/nfs/dbraw/zinc/81/86/72/721818672.db2.gz	XTTGATYZUOLMQO-TUACAJSNSA-N	2	0	386.543	4.675	20	0		GJADRP
C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](C(C)(C)c1ccnc(Cl)c1)CC2	ZINC001164795584	721504769	/nfs/dbraw/zinc/50/47/69/721504769.db2.gz	LZJZACOIYDBHQP-UHFFFAOYSA-N	2	0	398.982	4.742	20	0		GJADRP
CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@@H]2CC[NH+]2CCCC2)nc1	ZINC001165047872	721978159	/nfs/dbraw/zinc/97/81/59/721978159.db2.gz	BGHZEJHCEPMJJG-DHIUTWEWSA-N	2	0	384.612	4.863	20	0		GJADRP
CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCC[C@H]2CC[NH+]2CCCC2)nc1	ZINC001165047880	721978253	/nfs/dbraw/zinc/97/82/53/721978253.db2.gz	BGHZEJHCEPMJJG-XZOQPEGZSA-N	2	0	384.612	4.863	20	0		GJADRP
Cc1nc(C[N@@H+]2CCCC23CCN(c2[nH+]c(C)cc4ccccc42)CC3)cs1	ZINC001164691556	719811485	/nfs/dbraw/zinc/81/14/85/719811485.db2.gz	HBLLILBMVKQNPR-UHFFFAOYSA-N	2	0	392.572	4.943	20	0		GJADRP
Cc1cc2ccccc2c(N2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)[nH+]1	ZINC001164795721	721497973	/nfs/dbraw/zinc/49/79/73/721497973.db2.gz	KQIWRCZGRLFENY-UHFFFAOYSA-N	2	0	386.543	4.819	20	0		GJADRP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(C)(C)C)cn3)C[C@@H]21	ZINC001165025286	721831266	/nfs/dbraw/zinc/83/12/66/721831266.db2.gz	MOGDBMWHSGETQJ-YUXAGFNASA-N	2	0	378.564	4.511	20	0		GJADRP
CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCC[C@@H]2CC[NH+]2CCCC2)nc1	ZINC001165047878	721978166	/nfs/dbraw/zinc/97/81/66/721978166.db2.gz	BGHZEJHCEPMJJG-PKTZIBPZSA-N	2	0	384.612	4.863	20	0		GJADRP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(C)(C)C)cn3)C[C@H]21	ZINC001165025283	721831463	/nfs/dbraw/zinc/83/14/63/721831463.db2.gz	MOGDBMWHSGETQJ-VLCRHTCISA-N	2	0	378.564	4.511	20	0		GJADRP
C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc(C(C)(C)C)cn1)CC2	ZINC001164794972	721503606	/nfs/dbraw/zinc/50/36/06/721503606.db2.gz	GQNQJODVVUTNLF-UHFFFAOYSA-N	2	0	378.564	4.655	20	0		GJADRP