smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Fc1ccc(N2CCC([N@@H+]3CC[C@]4(C3)CCCN(CC3CC3)C4)CC2)cc1F	ZINC000012318471	204395117	/nfs/dbraw/zinc/39/51/17/204395117.db2.gz	LEYYPJUBBQRNQU-HSZRJFAPSA-N	1	3	389.534	4.132	10	0		GIAEHO
Fc1ccc(N2CCC([N@H+]3CC[C@]4(C3)CCCN(CC3CC3)C4)CC2)cc1F	ZINC000012318471	204395120	/nfs/dbraw/zinc/39/51/20/204395120.db2.gz	LEYYPJUBBQRNQU-HSZRJFAPSA-N	1	3	389.534	4.132	10	0		GIAEHO
Fc1ccc(N2CCC(N3CC[C@]4(C3)CCC[N@H+](CC3CC3)C4)CC2)cc1F	ZINC000012318471	204395123	/nfs/dbraw/zinc/39/51/23/204395123.db2.gz	LEYYPJUBBQRNQU-HSZRJFAPSA-N	1	3	389.534	4.132	10	0		GIAEHO
Fc1ccc(N2CCC(N3CC[C@]4(C3)CCC[N@@H+](CC3CC3)C4)CC2)cc1F	ZINC000012318471	204395125	/nfs/dbraw/zinc/39/51/25/204395125.db2.gz	LEYYPJUBBQRNQU-HSZRJFAPSA-N	1	3	389.534	4.132	10	0		GIAEHO
C[N@@H+](Cc1ccc2nsnc2c1)CC1CCN(CCc2ccccc2F)CC1	ZINC000011840271	204355048	/nfs/dbraw/zinc/35/50/48/204355048.db2.gz	AKLAENUTRGWBEK-UHFFFAOYSA-N	1	3	398.551	4.217	10	0		GIAEHO
C[N@H+](Cc1ccc2nsnc2c1)CC1CCN(CCc2ccccc2F)CC1	ZINC000011840271	204355051	/nfs/dbraw/zinc/35/50/51/204355051.db2.gz	AKLAENUTRGWBEK-UHFFFAOYSA-N	1	3	398.551	4.217	10	0		GIAEHO
c1ccc(CN(CCN2CCCCC2)C[C@@H]2CCC[N@H+](C3CCCC3)C2)nc1	ZINC000020363304	207189682	/nfs/dbraw/zinc/18/96/82/207189682.db2.gz	WHJDIIPEUXUZLK-QFIPXVFZSA-N	1	3	384.612	4.024	10	0		GIAEHO
c1ccc(CN(CCN2CCCCC2)C[C@@H]2CCC[N@@H+](C3CCCC3)C2)nc1	ZINC000020363304	207189678	/nfs/dbraw/zinc/18/96/78/207189678.db2.gz	WHJDIIPEUXUZLK-QFIPXVFZSA-N	1	3	384.612	4.024	10	0		GIAEHO
CCC[NH+]1CCC([C@@H](Cc2ccccc2F)N(C)Cc2cn(C)nc2C)CC1	ZINC000020135914	207178743	/nfs/dbraw/zinc/17/87/43/207178743.db2.gz	LMYDCEVUFJXCDF-HSZRJFAPSA-N	1	3	386.559	4.033	10	0		GIAEHO
CCC[NH+]1CCC([C@H](Cc2ccccc2F)N(C)Cc2cn(C)nc2C)CC1	ZINC000020135916	207178717	/nfs/dbraw/zinc/17/87/17/207178717.db2.gz	LMYDCEVUFJXCDF-QHCPKHFHSA-N	1	3	386.559	4.033	10	0		GIAEHO
CCC[NH+]1CCC2(CCN(Cc3[nH]c4ccc(C)cc4c3C)C[C@H]2CO)CC1	ZINC000097696186	208361552	/nfs/dbraw/zinc/36/15/52/208361552.db2.gz	UCLRPMYILJCSAX-FQEVSTJZSA-N	1	3	383.580	4.091	10	0		GIAEHO
COC[C@H]1C[N@H+](Cc2ccsc2)CC12CCN(Cc1cccs1)CC2	ZINC000247820583	209026273	/nfs/dbraw/zinc/02/62/73/209026273.db2.gz	CVZUWZKLKBAFLE-GOSISDBHSA-N	1	3	376.591	4.170	10	0		GIAEHO
COC[C@H]1C[N@@H+](Cc2ccsc2)CC12CCN(Cc1cccs1)CC2	ZINC000247820583	209026277	/nfs/dbraw/zinc/02/62/77/209026277.db2.gz	CVZUWZKLKBAFLE-GOSISDBHSA-N	1	3	376.591	4.170	10	0		GIAEHO
CN(CCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000020204976	210322594	/nfs/dbraw/zinc/32/25/94/210322594.db2.gz	RNPVGUUWPDVKOD-AREMUKBSSA-N	1	3	391.603	4.290	10	0		GIAEHO
CN(CCc1ccccc1)[C@@H]1CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000020204976	210322600	/nfs/dbraw/zinc/32/26/00/210322600.db2.gz	RNPVGUUWPDVKOD-AREMUKBSSA-N	1	3	391.603	4.290	10	0		GIAEHO
CN(CCc1ccccc1)[C@H]1CCC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000020204979	210322825	/nfs/dbraw/zinc/32/28/25/210322825.db2.gz	RNPVGUUWPDVKOD-SANMLTNESA-N	1	3	391.603	4.290	10	0		GIAEHO
CN(CCc1ccccc1)[C@H]1CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000020204979	210322831	/nfs/dbraw/zinc/32/28/31/210322831.db2.gz	RNPVGUUWPDVKOD-SANMLTNESA-N	1	3	391.603	4.290	10	0		GIAEHO
Cc1cccc(CN2CCC[C@]3(CC[N@H+](Cc4ccc(-c5cc[nH]n5)o4)C3)C2)c1	ZINC000012306684	221179066	/nfs/dbraw/zinc/17/90/66/221179066.db2.gz	HAGMENRAMAZDTA-DEOSSOPVSA-N	1	3	390.531	4.466	10	0		GIAEHO
Cc1cccc(CN2CCC[C@]3(CC[N@@H+](Cc4ccc(-c5cc[nH]n5)o4)C3)C2)c1	ZINC000012306684	221179067	/nfs/dbraw/zinc/17/90/67/221179067.db2.gz	HAGMENRAMAZDTA-DEOSSOPVSA-N	1	3	390.531	4.466	10	0		GIAEHO
CCC[NH+]1CCC2(CCN(Cc3[nH]c4ccc(C)cc4c3C)C[C@@H]2CO)CC1	ZINC000097696185	570249595	/nfs/dbraw/zinc/24/95/95/570249595.db2.gz	UCLRPMYILJCSAX-HXUWFJFHSA-N	1	3	383.580	4.091	10	0		GIAEHO
c1ccc(CCCN2CCC[C@]3(CC[N@@H+](C4CSCCSC4)C3)C2)cc1	ZINC000012703402	221219961	/nfs/dbraw/zinc/21/99/61/221219961.db2.gz	NFBDNCOODGLTNI-QFIPXVFZSA-N	1	3	390.662	4.256	10	0		GIAEHO
c1ccc(CCCN2CCC[C@]3(CC[N@H+](C4CSCCSC4)C3)C2)cc1	ZINC000012703402	221219962	/nfs/dbraw/zinc/21/99/62/221219962.db2.gz	NFBDNCOODGLTNI-QFIPXVFZSA-N	1	3	390.662	4.256	10	0		GIAEHO
c1ccc(CCC[N@@H+]2CCC[C@]3(CCN(C4CSCCSC4)C3)C2)cc1	ZINC000012703402	221219964	/nfs/dbraw/zinc/21/99/64/221219964.db2.gz	NFBDNCOODGLTNI-QFIPXVFZSA-N	1	3	390.662	4.256	10	0		GIAEHO
c1ccc(CCC[N@H+]2CCC[C@]3(CCN(C4CSCCSC4)C3)C2)cc1	ZINC000012703402	221219966	/nfs/dbraw/zinc/21/99/66/221219966.db2.gz	NFBDNCOODGLTNI-QFIPXVFZSA-N	1	3	390.662	4.256	10	0		GIAEHO
CCc1nc(C)c(CN(C)CC2CC[NH+](CCc3ccc(Cl)cc3)CC2)[nH]1	ZINC000012430230	221192328	/nfs/dbraw/zinc/19/23/28/221192328.db2.gz	CERIDMFGJBZKKV-UHFFFAOYSA-N	1	3	388.987	4.320	10	0		GIAEHO