smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(NCC[NH2+]C1CCCCCC1)c1ccc(Cn2cc[nH+]c2)cc1	ZINC000159716626	206259519	/nfs/dbraw/zinc/25/95/19/206259519.db2.gz	BRCXXYWOIYCNFD-UHFFFAOYSA-N	2	2	340.471	2.974	20	70		EFIDLP
CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000159830412	206265628	/nfs/dbraw/zinc/26/56/28/206265628.db2.gz	UXVTXAGZFBPCKU-IAGOWNOFSA-N	2	2	331.504	2.670	20	70		EFIDLP
CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@@H](C)[N@H+]1CCc2ccccc2C1	ZINC000159830412	206265632	/nfs/dbraw/zinc/26/56/32/206265632.db2.gz	UXVTXAGZFBPCKU-IAGOWNOFSA-N	2	2	331.504	2.670	20	70		EFIDLP
CCC[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159591	206282107	/nfs/dbraw/zinc/28/21/07/206282107.db2.gz	PVPSSFPANPIQBU-OIISXLGYSA-N	2	2	349.544	2.874	20	70		EFIDLP
CCC[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159591	206282110	/nfs/dbraw/zinc/28/21/10/206282110.db2.gz	PVPSSFPANPIQBU-OIISXLGYSA-N	2	2	349.544	2.874	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]C[C@H](c2cccs2)[NH+]2CCCC2)CC1	ZINC000161210880	206335640	/nfs/dbraw/zinc/33/56/40/206335640.db2.gz	DHUWWAKZBFGLAK-OFLPRAFFSA-N	2	2	335.517	2.922	20	70		EFIDLP
CCc1ccc([C@H](C[NH2+]C2CCC(NC(C)=O)CC2)[NH+](C)C)cc1	ZINC000161209606	206336338	/nfs/dbraw/zinc/33/63/38/206336338.db2.gz	ZXFFESIYYKHCNL-MHJFOBGBSA-N	2	2	331.504	2.889	20	70		EFIDLP
CCc1ccc([C@@H](C[NH2+]C2CCC(NC(C)=O)CC2)[NH+](C)C)cc1	ZINC000161209469	206336624	/nfs/dbraw/zinc/33/66/24/206336624.db2.gz	ZXFFESIYYKHCNL-SOAGJPPSSA-N	2	2	331.504	2.889	20	70		EFIDLP
C[C@@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161306503	544812848	/nfs/dbraw/zinc/81/28/48/544812848.db2.gz	XGLVSAMVZXUVDU-AWEZNQCLSA-N	2	2	344.846	2.884	20	70		EFIDLP
c1cc(-c2noc(C[NH+]3CCN(c4cc[nH+]cc4)CC3)n2)cs1	ZINC000161391076	544813151	/nfs/dbraw/zinc/81/31/51/544813151.db2.gz	SLVUTKYSYOCDBO-UHFFFAOYSA-N	2	2	327.413	2.515	20	70		EFIDLP
C[C@@H](c1ccccc1Cl)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159370506	274278332	/nfs/dbraw/zinc/27/83/32/274278332.db2.gz	BYRUMAYWSZSGNE-SUMWQHHRSA-N	2	2	335.879	2.815	20	70		EFIDLP
C[C@@H](c1ccccc1Cl)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159370506	274278334	/nfs/dbraw/zinc/27/83/34/274278334.db2.gz	BYRUMAYWSZSGNE-SUMWQHHRSA-N	2	2	335.879	2.815	20	70		EFIDLP
C[C@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1	ZINC000161124839	473209176	/nfs/dbraw/zinc/20/91/76/473209176.db2.gz	IQVADGMGPYJXQV-HNJRGHQBSA-N	3	2	330.520	2.754	20	70		EFIDLP
C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1	ZINC000161124839	473209178	/nfs/dbraw/zinc/20/91/78/473209178.db2.gz	IQVADGMGPYJXQV-HNJRGHQBSA-N	3	2	330.520	2.754	20	70		EFIDLP
Cc1ccc(-n2cc[nH+]c2)c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1	ZINC000161146814	473212318	/nfs/dbraw/zinc/21/23/18/473212318.db2.gz	JKOJKQKSHCWGDP-DOTOQJQBSA-N	2	2	326.444	2.639	20	70		EFIDLP
Cc1ccc(-n2cc[nH+]c2)c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1	ZINC000161146814	473212320	/nfs/dbraw/zinc/21/23/20/473212320.db2.gz	JKOJKQKSHCWGDP-DOTOQJQBSA-N	2	2	326.444	2.639	20	70		EFIDLP
NC(=O)[C@H]1CCC[N@@H+]1C1CC[NH+](CCCc2ccc(Cl)cc2)CC1	ZINC000159411455	473025841	/nfs/dbraw/zinc/02/58/41/473025841.db2.gz	MPMAOTBLSYCQDI-GOSISDBHSA-N	2	2	349.906	2.687	20	70		EFIDLP
NC(=O)[C@H]1CCC[N@H+]1C1CC[NH+](CCCc2ccc(Cl)cc2)CC1	ZINC000159411455	473025848	/nfs/dbraw/zinc/02/58/48/473025848.db2.gz	MPMAOTBLSYCQDI-GOSISDBHSA-N	2	2	349.906	2.687	20	70		EFIDLP
C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CC[NH+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311363	473106499	/nfs/dbraw/zinc/10/64/99/473106499.db2.gz	AXQUUBLSHNYOCX-LXGFNABISA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+][C@@H]2CC[NH+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311363	473106509	/nfs/dbraw/zinc/10/65/09/473106509.db2.gz	AXQUUBLSHNYOCX-LXGFNABISA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311363	473106513	/nfs/dbraw/zinc/10/65/13/473106513.db2.gz	AXQUUBLSHNYOCX-LXGFNABISA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311363	473106519	/nfs/dbraw/zinc/10/65/19/473106519.db2.gz	AXQUUBLSHNYOCX-LXGFNABISA-N	3	2	345.531	2.868	20	70		EFIDLP
O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1[nH]cc[nH+]1	ZINC000160814406	284195038	/nfs/dbraw/zinc/19/50/38/284195038.db2.gz	KSGXSHUYDDNAKK-GOEBONIOSA-N	2	2	331.464	2.663	20	70		EFIDLP
O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1[nH]cc[nH+]1	ZINC000160814406	284195039	/nfs/dbraw/zinc/19/50/39/284195039.db2.gz	KSGXSHUYDDNAKK-GOEBONIOSA-N	2	2	331.464	2.663	20	70		EFIDLP
CC(C)c1ccccc1NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161297875	544811171	/nfs/dbraw/zinc/81/11/71/544811171.db2.gz	KZSCGEYSMXCLJT-UHFFFAOYSA-N	2	2	338.455	2.966	20	70		EFIDLP
Cc1cccc(C)c1NC(=O)[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161385358	544813008	/nfs/dbraw/zinc/81/30/08/544813008.db2.gz	HOKJBWOQQPSJJK-KRWDZBQOSA-N	2	2	338.455	2.848	20	70		EFIDLP
CCN(C(=O)[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1)C1CCCCC1	ZINC000161398803	544813209	/nfs/dbraw/zinc/81/32/09/544813209.db2.gz	VSXMLPAWTXUVPI-QGZVFWFLSA-N	2	2	344.503	2.773	20	70		EFIDLP
Fc1ccc(-c2noc(C[NH+]3CCN(c4cc[nH+]cc4)CC3)n2)cc1	ZINC000161348504	544813417	/nfs/dbraw/zinc/81/34/17/544813417.db2.gz	ZDPBBEFXTUAMOB-UHFFFAOYSA-N	2	2	339.374	2.593	20	70		EFIDLP
CCN(C(=O)[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccccc1	ZINC000161334643	544813530	/nfs/dbraw/zinc/81/35/30/544813530.db2.gz	QIBUFRZABDUFOE-KRWDZBQOSA-N	2	2	338.455	2.645	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)N(C)C(C)C	ZINC000160034792	276341912	/nfs/dbraw/zinc/34/19/12/276341912.db2.gz	DFHAAUONQAVMGJ-QGZVFWFLSA-N	2	2	346.519	2.875	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)N(C)C(C)C	ZINC000160034792	276341913	/nfs/dbraw/zinc/34/19/13/276341913.db2.gz	DFHAAUONQAVMGJ-QGZVFWFLSA-N	2	2	346.519	2.875	20	70		EFIDLP
O=C1[C@@H]([NH+]2CCC(n3cc[nH+]c3)CC2)CCCN1c1ccccc1F	ZINC000160710903	473164365	/nfs/dbraw/zinc/16/43/65/473164365.db2.gz	YQQJIZOEUIFLQQ-SFHVURJKSA-N	2	2	342.418	2.855	20	70		EFIDLP
C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160242930	533856353	/nfs/dbraw/zinc/85/63/53/533856353.db2.gz	SLJCCMYQZSVKQL-KRWDZBQOSA-N	3	2	341.503	2.549	20	70		EFIDLP
CC(C)c1ccc(C[N@H+](CC(=O)N2CC[NH+](C)CC2)C2CC2)cc1	ZINC000216716962	519835803	/nfs/dbraw/zinc/83/58/03/519835803.db2.gz	RXLYZQSNVDQTFE-UHFFFAOYSA-N	2	2	329.488	2.548	20	70		EFIDLP
CC(C)c1ccc(C[N@@H+](CC(=O)N2CC[NH+](C)CC2)C2CC2)cc1	ZINC000216716962	519835804	/nfs/dbraw/zinc/83/58/04/519835804.db2.gz	RXLYZQSNVDQTFE-UHFFFAOYSA-N	2	2	329.488	2.548	20	70		EFIDLP
CCOC(=O)[C@H](CC)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160034382	528007506	/nfs/dbraw/zinc/00/75/06/528007506.db2.gz	OIDZWURWHILCQL-KRWDZBQOSA-N	2	2	333.476	2.962	20	70		EFIDLP
CCOC(=O)[C@H](CC)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160034382	528007508	/nfs/dbraw/zinc/00/75/08/528007508.db2.gz	OIDZWURWHILCQL-KRWDZBQOSA-N	2	2	333.476	2.962	20	70		EFIDLP
CCC[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159919	529021282	/nfs/dbraw/zinc/02/12/82/529021282.db2.gz	PVPSSFPANPIQBU-HYVNUMGLSA-N	2	2	349.544	2.874	20	70		EFIDLP
CCC[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159919	529021285	/nfs/dbraw/zinc/02/12/85/529021285.db2.gz	PVPSSFPANPIQBU-HYVNUMGLSA-N	2	2	349.544	2.874	20	70		EFIDLP
C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160243066	533393843	/nfs/dbraw/zinc/39/38/43/533393843.db2.gz	SLJCCMYQZSVKQL-QGZVFWFLSA-N	3	2	341.503	2.549	20	70		EFIDLP
O=C(C[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1cccc2ccccc21	ZINC000161295239	544811233	/nfs/dbraw/zinc/81/12/33/544811233.db2.gz	CBFLCZORZDKPGZ-UHFFFAOYSA-N	2	2	346.434	2.996	20	70		EFIDLP
CC(C)N(C(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccccc1	ZINC000161286701	544811260	/nfs/dbraw/zinc/81/12/60/544811260.db2.gz	PQTFEBFRWZLXHR-UHFFFAOYSA-N	2	2	338.455	2.645	20	70		EFIDLP
Cc1cc(C)c(NC(=O)C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(C)c1	ZINC000161299876	544812619	/nfs/dbraw/zinc/81/26/19/544812619.db2.gz	MDNAQGWSYHBJTH-UHFFFAOYSA-N	2	2	338.455	2.768	20	70		EFIDLP
C[C@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161382289	544814106	/nfs/dbraw/zinc/81/41/06/544814106.db2.gz	KBRCWGLOJSJUKC-CYBMUJFWSA-N	2	2	346.381	2.509	20	70		EFIDLP
CC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000161159256	473213336	/nfs/dbraw/zinc/21/33/36/473213336.db2.gz	MHBILGZOEHEWCI-KBPBESRZSA-N	2	2	338.883	2.916	20	70		EFIDLP
CC[N@H+]1CCCC[C@H]1C[NH2+][C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000161159256	473213340	/nfs/dbraw/zinc/21/33/40/473213340.db2.gz	MHBILGZOEHEWCI-KBPBESRZSA-N	2	2	338.883	2.916	20	70		EFIDLP
CC[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)N1CCN(c2cccc[nH+]2)CC1	ZINC000161421185	473234388	/nfs/dbraw/zinc/23/43/88/473234388.db2.gz	VZGRZSQNHBLHFV-QZTJIDSGSA-N	2	2	344.503	2.679	20	70		EFIDLP
CCCNC(=O)[C@@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160003073	473080432	/nfs/dbraw/zinc/08/04/32/473080432.db2.gz	XVZPMIJKKVGDRZ-MRXNPFEDSA-N	2	2	332.492	2.535	20	70		EFIDLP
CCCNC(=O)[C@@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160003073	473080437	/nfs/dbraw/zinc/08/04/37/473080437.db2.gz	XVZPMIJKKVGDRZ-MRXNPFEDSA-N	2	2	332.492	2.535	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1cnccn1	ZINC000160315749	473106352	/nfs/dbraw/zinc/10/63/52/473106352.db2.gz	HBBGLPGNQZZYIF-ZACQAIPSSA-N	2	2	340.471	2.937	20	70		EFIDLP
C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CC[NH+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311253	473106579	/nfs/dbraw/zinc/10/65/79/473106579.db2.gz	AXQUUBLSHNYOCX-DCXXXQMHSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+][C@@H]2CC[NH+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311253	473106592	/nfs/dbraw/zinc/10/65/92/473106592.db2.gz	AXQUUBLSHNYOCX-DCXXXQMHSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311253	473106599	/nfs/dbraw/zinc/10/65/99/473106599.db2.gz	AXQUUBLSHNYOCX-DCXXXQMHSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311253	473106607	/nfs/dbraw/zinc/10/66/07/473106607.db2.gz	AXQUUBLSHNYOCX-DCXXXQMHSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cnccn1	ZINC000160315470	473107470	/nfs/dbraw/zinc/10/74/70/473107470.db2.gz	HBBGLPGNQZZYIF-BBWFWOEESA-N	2	2	340.471	2.937	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cnccn1	ZINC000160315470	473107477	/nfs/dbraw/zinc/10/74/77/473107477.db2.gz	HBBGLPGNQZZYIF-BBWFWOEESA-N	2	2	340.471	2.937	20	70		EFIDLP
Cc1cc(N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1	ZINC000160491667	473132114	/nfs/dbraw/zinc/13/21/14/473132114.db2.gz	JPTNLSLSKTVMQI-UXLLHSPISA-N	2	2	330.476	2.740	20	70		EFIDLP
Cc1cc(N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1	ZINC000160491667	473132122	/nfs/dbraw/zinc/13/21/22/473132122.db2.gz	JPTNLSLSKTVMQI-UXLLHSPISA-N	2	2	330.476	2.740	20	70		EFIDLP
O=C(c1cccc(F)c1)N1CCC[N@H+](CCC[NH+]2CCCCC2)CC1	ZINC000160527705	473137884	/nfs/dbraw/zinc/13/78/84/473137884.db2.gz	UQTRVNFGHGXKLJ-UHFFFAOYSA-N	2	2	347.478	2.850	20	70		EFIDLP
O=C(c1cccc(F)c1)N1CCC[N@@H+](CCC[NH+]2CCCCC2)CC1	ZINC000160527705	473137888	/nfs/dbraw/zinc/13/78/88/473137888.db2.gz	UQTRVNFGHGXKLJ-UHFFFAOYSA-N	2	2	347.478	2.850	20	70		EFIDLP
CCn1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCOCC3)cc2)cn1	ZINC000160569100	473143086	/nfs/dbraw/zinc/14/30/86/473143086.db2.gz	KMWREPLESMDSTJ-INIZCTEOSA-N	2	2	328.460	2.586	20	70		EFIDLP
CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1	ZINC000160284277	528155257	/nfs/dbraw/zinc/15/52/57/528155257.db2.gz	RCQUQBMUQPMERT-IEBWSBKVSA-N	3	2	333.520	2.980	20	70		EFIDLP
CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000160284277	528155258	/nfs/dbraw/zinc/15/52/58/528155258.db2.gz	RCQUQBMUQPMERT-IEBWSBKVSA-N	3	2	333.520	2.980	20	70		EFIDLP
Cc1c(Cl)cccc1NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161291133	544810905	/nfs/dbraw/zinc/81/09/05/544810905.db2.gz	JBFWPLKVKRJHMX-UHFFFAOYSA-N	2	2	344.846	2.804	20	70		EFIDLP
Cc1cc(N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1	ZINC000160491547	301335843	/nfs/dbraw/zinc/33/58/43/301335843.db2.gz	JPTNLSLSKTVMQI-HLLBOEOZSA-N	2	2	330.476	2.740	20	70		EFIDLP
Cc1cc(N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1	ZINC000160491547	301335847	/nfs/dbraw/zinc/33/58/47/301335847.db2.gz	JPTNLSLSKTVMQI-HLLBOEOZSA-N	2	2	330.476	2.740	20	70		EFIDLP
Cc1ccc(-n2cc[nH+]c2)c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1	ZINC000161146900	473212067	/nfs/dbraw/zinc/21/20/67/473212067.db2.gz	JKOJKQKSHCWGDP-RDJZCZTQSA-N	2	2	326.444	2.639	20	70		EFIDLP
Cc1ccc(-n2cc[nH+]c2)c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1	ZINC000161146900	473212069	/nfs/dbraw/zinc/21/20/69/473212069.db2.gz	JKOJKQKSHCWGDP-RDJZCZTQSA-N	2	2	326.444	2.639	20	70		EFIDLP
CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@H]1CCn2cc[nH+]c2C1	ZINC000161252957	473220476	/nfs/dbraw/zinc/22/04/76/473220476.db2.gz	IPMTVYWSXHWXKT-SFHVURJKSA-N	2	2	340.471	2.556	20	70		EFIDLP
CC(C)(C)OC(=O)N1CCC[N@H+](CCC[NH+]2CCCCC2)CC1	ZINC000161319049	473225650	/nfs/dbraw/zinc/22/56/50/473225650.db2.gz	JVYRTAMZDIYJCF-UHFFFAOYSA-N	2	2	325.497	2.805	20	70		EFIDLP
CC(C)(C)OC(=O)N1CCC[N@@H+](CCC[NH+]2CCCCC2)CC1	ZINC000161319049	473225654	/nfs/dbraw/zinc/22/56/54/473225654.db2.gz	JVYRTAMZDIYJCF-UHFFFAOYSA-N	2	2	325.497	2.805	20	70		EFIDLP
C[C@@](O)(C[NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccsc1	ZINC000159914351	473072210	/nfs/dbraw/zinc/07/22/10/473072210.db2.gz	VPOLIQBURJRCRA-GOSISDBHSA-N	2	2	331.485	2.605	20	70		EFIDLP
Cc1ccc(C[NH+]2CCN(CC[N@@H+](C)Cc3ccccc3)CC2)nc1	ZINC000160119299	473089549	/nfs/dbraw/zinc/08/95/49/473089549.db2.gz	QDDZFMPQPUSROG-UHFFFAOYSA-N	2	2	338.499	2.640	20	70		EFIDLP
Cc1ccc(C[NH+]2CCN(CC[N@H+](C)Cc3ccccc3)CC2)nc1	ZINC000160119299	473089553	/nfs/dbraw/zinc/08/95/53/473089553.db2.gz	QDDZFMPQPUSROG-UHFFFAOYSA-N	2	2	338.499	2.640	20	70		EFIDLP
CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)cn1	ZINC000160422704	473121666	/nfs/dbraw/zinc/12/16/66/473121666.db2.gz	GTTZCBNVTGZLHU-MRXNPFEDSA-N	2	2	328.460	2.586	20	70		EFIDLP
C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160728722	473166893	/nfs/dbraw/zinc/16/68/93/473166893.db2.gz	STJLOTVGVMLSBZ-FXAWDEMLSA-N	3	2	342.487	2.760	20	70		EFIDLP
C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160728722	473166902	/nfs/dbraw/zinc/16/69/02/473166902.db2.gz	STJLOTVGVMLSBZ-FXAWDEMLSA-N	3	2	342.487	2.760	20	70		EFIDLP
C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160728854	473167120	/nfs/dbraw/zinc/16/71/20/473167120.db2.gz	STJLOTVGVMLSBZ-YLJYHZDGSA-N	3	2	342.487	2.760	20	70		EFIDLP
C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1ccc(-n2cc[nH+]c2)cc1	ZINC000160728854	473167127	/nfs/dbraw/zinc/16/71/27/473167127.db2.gz	STJLOTVGVMLSBZ-YLJYHZDGSA-N	3	2	342.487	2.760	20	70		EFIDLP
C[NH+](C)Cc1ccc(C[NH2+]C2CC[NH+](Cc3cccnc3)CC2)cc1	ZINC000160898560	473188081	/nfs/dbraw/zinc/18/80/81/473188081.db2.gz	UIIRFZKZNXSXDE-UHFFFAOYSA-N	3	2	338.499	2.897	20	70		EFIDLP
CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000159830542	206265221	/nfs/dbraw/zinc/26/52/21/206265221.db2.gz	UXVTXAGZFBPCKU-DLBZAZTESA-N	2	2	331.504	2.670	20	70		EFIDLP
CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@@H](C)[N@H+]1CCc2ccccc2C1	ZINC000159830542	206265225	/nfs/dbraw/zinc/26/52/25/206265225.db2.gz	UXVTXAGZFBPCKU-DLBZAZTESA-N	2	2	331.504	2.670	20	70		EFIDLP
CCC[C@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(OC)cc1	ZINC000160371756	206293140	/nfs/dbraw/zinc/29/31/40/206293140.db2.gz	KLFQVXNTRHNPNU-IBGZPJMESA-N	2	2	347.503	2.679	20	70		EFIDLP
CCc1ccc([C@H](CC)[NH2+]C2CC[NH+](CC(=O)N(C)C)CC2)cc1	ZINC000160392054	206294904	/nfs/dbraw/zinc/29/49/04/206294904.db2.gz	HMRIYVKKDWNNGO-IBGZPJMESA-N	2	2	331.504	2.842	20	70		EFIDLP
c1cc2ncnc(N3CC[NH+](CCC[NH+]4CCCCC4)CC3)c2s1	ZINC000161377127	206344237	/nfs/dbraw/zinc/34/42/37/206344237.db2.gz	WRINBUVYFMTTDK-UHFFFAOYSA-N	2	2	345.516	2.689	20	70		EFIDLP
Cc1cc(Cl)ccc1NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161310799	544813867	/nfs/dbraw/zinc/81/38/67/544813867.db2.gz	WOVAYJJMXXFZHR-UHFFFAOYSA-N	2	2	344.846	2.804	20	70		EFIDLP
CC[NH+](CC)[C@H](C[NH2+]C1CCC(NC(C)=O)CC1)Cc1ccccc1	ZINC000161273902	473222796	/nfs/dbraw/zinc/22/27/96/473222796.db2.gz	ULILQHHEVCJSLQ-CBNMVNINSA-N	2	2	345.531	2.976	20	70		EFIDLP
CC[NH+](CC)[C@@H](C[NH2+]C1CCC(NC(C)=O)CC1)Cc1ccccc1	ZINC000161274031	473222942	/nfs/dbraw/zinc/22/29/42/473222942.db2.gz	ULILQHHEVCJSLQ-XVAXZDLZSA-N	2	2	345.531	2.976	20	70		EFIDLP
c1cn(CCSc2[nH+]cnc3c2cnn3Cc2ccccc2)c[nH+]1	ZINC000160197039	473094914	/nfs/dbraw/zinc/09/49/14/473094914.db2.gz	IQQWKUAXYIWTLK-UHFFFAOYSA-N	2	2	336.424	2.863	20	70		EFIDLP
O=C(c1ccccc1F)N1CCC[N@H+](CCC[NH+]2CCCCC2)CC1	ZINC000160419337	473121453	/nfs/dbraw/zinc/12/14/53/473121453.db2.gz	QMTHLGMCGJHLQB-UHFFFAOYSA-N	2	2	347.478	2.850	20	70		EFIDLP
O=C(c1ccccc1F)N1CCC[N@@H+](CCC[NH+]2CCCCC2)CC1	ZINC000160419337	473121458	/nfs/dbraw/zinc/12/14/58/473121458.db2.gz	QMTHLGMCGJHLQB-UHFFFAOYSA-N	2	2	347.478	2.850	20	70		EFIDLP
CCn1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCOCC3)cc2)cn1	ZINC000160568988	473143192	/nfs/dbraw/zinc/14/31/92/473143192.db2.gz	KMWREPLESMDSTJ-MRXNPFEDSA-N	2	2	328.460	2.586	20	70		EFIDLP
O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)N1CCCC[C@H]1c1[nH]cc[nH+]1	ZINC000160814300	473178818	/nfs/dbraw/zinc/17/88/18/473178818.db2.gz	KSGXSHUYDDNAKK-HOCLYGCPSA-N	2	2	331.464	2.663	20	70		EFIDLP
O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@H]1c1[nH]cc[nH+]1	ZINC000160814300	473178822	/nfs/dbraw/zinc/17/88/22/473178822.db2.gz	KSGXSHUYDDNAKK-HOCLYGCPSA-N	2	2	331.464	2.663	20	70		EFIDLP
Cc1nnc(C[N@@H+]2CC[C@H](CNc3cccc(C)[nH+]3)C2)n1C1CC1	ZINC000160914411	473191103	/nfs/dbraw/zinc/19/11/03/473191103.db2.gz	HRWQXBRTQOOEDZ-OAHLLOKOSA-N	2	2	326.448	2.559	20	70		EFIDLP
Cc1nnc(C[N@H+]2CC[C@H](CNc3cccc(C)[nH+]3)C2)n1C1CC1	ZINC000160914411	473191108	/nfs/dbraw/zinc/19/11/08/473191108.db2.gz	HRWQXBRTQOOEDZ-OAHLLOKOSA-N	2	2	326.448	2.559	20	70		EFIDLP
CCCCC[N@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccc(F)cc1	ZINC000216721447	520155369	/nfs/dbraw/zinc/15/53/69/520155369.db2.gz	FVGZMPAMVYOWAP-UHFFFAOYSA-N	2	2	335.467	2.592	20	70		EFIDLP
CCCCC[N@@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccc(F)cc1	ZINC000216721447	520155381	/nfs/dbraw/zinc/15/53/81/520155381.db2.gz	FVGZMPAMVYOWAP-UHFFFAOYSA-N	2	2	335.467	2.592	20	70		EFIDLP
CC[N@H+](CCCNC(=O)N1CCC[NH+](CC)CC1)c1ccccc1	ZINC000159557182	528453492	/nfs/dbraw/zinc/45/34/92/528453492.db2.gz	MUWYOLCENQBDOU-UHFFFAOYSA-N	2	2	332.492	2.640	20	70		EFIDLP
CC[N@@H+](CCCNC(=O)N1CCC[NH+](CC)CC1)c1ccccc1	ZINC000159557182	528453495	/nfs/dbraw/zinc/45/34/95/528453495.db2.gz	MUWYOLCENQBDOU-UHFFFAOYSA-N	2	2	332.492	2.640	20	70		EFIDLP
CC[NH+](CCCNC(=O)N1CCC[N@H+](CC)CC1)c1ccccc1	ZINC000159557182	528453501	/nfs/dbraw/zinc/45/35/01/528453501.db2.gz	MUWYOLCENQBDOU-UHFFFAOYSA-N	2	2	332.492	2.640	20	70		EFIDLP
CC[NH+](CCCNC(=O)N1CCC[N@@H+](CC)CC1)c1ccccc1	ZINC000159557182	528453506	/nfs/dbraw/zinc/45/35/06/528453506.db2.gz	MUWYOLCENQBDOU-UHFFFAOYSA-N	2	2	332.492	2.640	20	70		EFIDLP
CSc1cccc(NC(=O)C[NH+]2CCN(c3cc[nH+]cc3)CC2)c1	ZINC000161305294	544812360	/nfs/dbraw/zinc/81/23/60/544812360.db2.gz	OFWBSBJONASSIC-UHFFFAOYSA-N	2	2	342.468	2.564	20	70		EFIDLP
C[C@@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161382164	544813974	/nfs/dbraw/zinc/81/39/74/544813974.db2.gz	KBRCWGLOJSJUKC-ZDUSSCGKSA-N	2	2	346.381	2.509	20	70		EFIDLP
O=C(C[NH2+]C1CCN(c2cccc[nH+]2)CC1)Nc1ccc(Cl)cc1	ZINC000161107165	473207509	/nfs/dbraw/zinc/20/75/09/473207509.db2.gz	KXTWREGBMDHASF-UHFFFAOYSA-N	2	2	344.846	2.932	20	70		EFIDLP
COc1ccc(F)cc1C[NH+]1CCN(CCC[NH+]2CCCCC2)CC1	ZINC000161216820	473217678	/nfs/dbraw/zinc/21/76/78/473217678.db2.gz	AJHOGIUFKYVKNZ-UHFFFAOYSA-N	2	2	349.494	2.828	20	70		EFIDLP
C[N@@H+]1CCC[C@@H]2C[NH+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392203	473231771	/nfs/dbraw/zinc/23/17/71/473231771.db2.gz	YHIWAPXVGPJSDF-HHXXYDBFSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[N@H+]1CCC[C@@H]2C[NH+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392203	473231776	/nfs/dbraw/zinc/23/17/76/473231776.db2.gz	YHIWAPXVGPJSDF-HHXXYDBFSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[NH+]1CCC[C@@H]2C[N@@H+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392203	473231780	/nfs/dbraw/zinc/23/17/80/473231780.db2.gz	YHIWAPXVGPJSDF-HHXXYDBFSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[NH+]1CCC[C@@H]2C[N@H+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392203	473231786	/nfs/dbraw/zinc/23/17/86/473231786.db2.gz	YHIWAPXVGPJSDF-HHXXYDBFSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[C@](O)(C[NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccsc1	ZINC000159914483	473071091	/nfs/dbraw/zinc/07/10/91/473071091.db2.gz	VPOLIQBURJRCRA-SFHVURJKSA-N	2	2	331.485	2.605	20	70		EFIDLP
Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c(C)n1	ZINC000160451237	473127288	/nfs/dbraw/zinc/12/72/88/473127288.db2.gz	ZIVHKGMAUUBJOE-OAHLLOKOSA-N	2	2	340.471	2.776	20	70		EFIDLP
C[NH+](C)Cc1cccc(NC(=O)N[C@H]2CCN(c3cccc[nH+]3)C2)c1	ZINC000160649217	473156111	/nfs/dbraw/zinc/15/61/11/473156111.db2.gz	KGQHQZBHRKAKEX-KRWDZBQOSA-N	2	2	339.443	2.544	20	70		EFIDLP
C[N@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1Cl	ZINC000160820784	473178599	/nfs/dbraw/zinc/17/85/99/473178599.db2.gz	IGXVAHSYEKHLQP-UHFFFAOYSA-N	2	2	345.878	2.514	20	70		EFIDLP
C[N@@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1Cl	ZINC000160820784	473178603	/nfs/dbraw/zinc/17/86/03/473178603.db2.gz	IGXVAHSYEKHLQP-UHFFFAOYSA-N	2	2	345.878	2.514	20	70		EFIDLP
CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCC(n2cc[nH+]c2)CC1	ZINC000160967035	473194997	/nfs/dbraw/zinc/19/49/97/473194997.db2.gz	GJZXSPRRIAXCRI-GOSISDBHSA-N	2	2	347.507	2.740	20	70		EFIDLP
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC(n2cc[nH+]c2)CC1	ZINC000160967035	473194998	/nfs/dbraw/zinc/19/49/98/473194998.db2.gz	GJZXSPRRIAXCRI-GOSISDBHSA-N	2	2	347.507	2.740	20	70		EFIDLP
Cc1ccc(-n2cc[nH+]c2)c(C(=O)N2CCC([NH2+]CC3CC3)CC2)c1	ZINC000159863112	534240464	/nfs/dbraw/zinc/24/04/64/534240464.db2.gz	HWCOCKAIKFXYBU-UHFFFAOYSA-N	2	2	338.455	2.785	20	70		EFIDLP
CCOC(=O)[C@@H](CC)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160034497	527773229	/nfs/dbraw/zinc/77/32/29/527773229.db2.gz	OIDZWURWHILCQL-QGZVFWFLSA-N	2	2	333.476	2.962	20	70		EFIDLP
CCOC(=O)[C@@H](CC)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160034497	527773235	/nfs/dbraw/zinc/77/32/35/527773235.db2.gz	OIDZWURWHILCQL-QGZVFWFLSA-N	2	2	333.476	2.962	20	70		EFIDLP
CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000159830795	528035122	/nfs/dbraw/zinc/03/51/22/528035122.db2.gz	UXVTXAGZFBPCKU-IRXDYDNUSA-N	2	2	331.504	2.670	20	70		EFIDLP
CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@H](C)[N@H+]1CCc2ccccc2C1	ZINC000159830795	528035124	/nfs/dbraw/zinc/03/51/24/528035124.db2.gz	UXVTXAGZFBPCKU-IRXDYDNUSA-N	2	2	331.504	2.670	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NCC(C)C	ZINC000160018301	528348818	/nfs/dbraw/zinc/34/88/18/528348818.db2.gz	BCVYISZPBWRKKE-QGZVFWFLSA-N	2	2	346.519	2.781	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NCC(C)C	ZINC000160018301	528348823	/nfs/dbraw/zinc/34/88/23/528348823.db2.gz	BCVYISZPBWRKKE-QGZVFWFLSA-N	2	2	346.519	2.781	20	70		EFIDLP
COCC[N@H+](C)CC[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C	ZINC000159381442	225207503	/nfs/dbraw/zinc/20/75/03/225207503.db2.gz	AXBWQEWKVDPPNH-ZDUSSCGKSA-N	2	2	334.489	2.742	20	70		EFIDLP
COCC[N@@H+](C)CC[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C	ZINC000159381442	225207506	/nfs/dbraw/zinc/20/75/06/225207506.db2.gz	AXBWQEWKVDPPNH-ZDUSSCGKSA-N	2	2	334.489	2.742	20	70		EFIDLP
CC(C)CCC[C@H](C)NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161388425	544814085	/nfs/dbraw/zinc/81/40/85/544814085.db2.gz	KINRBWLEQDMCAB-KRWDZBQOSA-N	2	2	332.492	2.535	20	70		EFIDLP
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159365281	473021381	/nfs/dbraw/zinc/02/13/81/473021381.db2.gz	GKHRIWUQVPEZQL-SUMWQHHRSA-N	2	2	335.879	2.815	20	70		EFIDLP
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159365281	473021387	/nfs/dbraw/zinc/02/13/87/473021387.db2.gz	GKHRIWUQVPEZQL-SUMWQHHRSA-N	2	2	335.879	2.815	20	70		EFIDLP
CC[C@H](c1ccc(F)cc1)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159402125	473026239	/nfs/dbraw/zinc/02/62/39/473026239.db2.gz	CGJMPHPNZYPOQL-QZTJIDSGSA-N	2	2	333.451	2.691	20	70		EFIDLP
CC[C@H](c1ccc(F)cc1)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159402125	473026244	/nfs/dbraw/zinc/02/62/44/473026244.db2.gz	CGJMPHPNZYPOQL-QZTJIDSGSA-N	2	2	333.451	2.691	20	70		EFIDLP
O[C@H](C[NH2+]Cc1ccc(F)c(Cl)c1)C[N@@H+]1CCc2ccccc2C1	ZINC000159951627	473076194	/nfs/dbraw/zinc/07/61/94/473076194.db2.gz	DFGXLCYMNVJGOA-QGZVFWFLSA-N	2	2	348.849	2.988	20	70		EFIDLP
O[C@H](C[NH2+]Cc1ccc(F)c(Cl)c1)C[N@H+]1CCc2ccccc2C1	ZINC000159951627	473076198	/nfs/dbraw/zinc/07/61/98/473076198.db2.gz	DFGXLCYMNVJGOA-QGZVFWFLSA-N	2	2	348.849	2.988	20	70		EFIDLP
CCc1ccc([C@@H](CC)[NH2+]C2CC[NH+](CC(=O)N(C)C)CC2)cc1	ZINC000160391936	473117364	/nfs/dbraw/zinc/11/73/64/473117364.db2.gz	HMRIYVKKDWNNGO-LJQANCHMSA-N	2	2	331.504	2.842	20	70		EFIDLP
CC(C)(C)n1ncc2c1nc[nH+]c2NCCc1cn2c([nH+]1)CCCC2	ZINC000160489373	473132760	/nfs/dbraw/zinc/13/27/60/473132760.db2.gz	FWCCGVOWOQUBCI-UHFFFAOYSA-N	2	2	339.447	2.769	20	70		EFIDLP
C[N@H+](Cc1cnc2ccccn12)C1CC[NH+](CCc2ccccn2)CC1	ZINC000160536361	473139523	/nfs/dbraw/zinc/13/95/23/473139523.db2.gz	YYPXYPJYPINBLO-UHFFFAOYSA-N	2	2	349.482	2.868	20	70		EFIDLP
C[N@@H+](Cc1cnc2ccccn12)C1CC[NH+](CCc2ccccn2)CC1	ZINC000160536361	473139527	/nfs/dbraw/zinc/13/95/27/473139527.db2.gz	YYPXYPJYPINBLO-UHFFFAOYSA-N	2	2	349.482	2.868	20	70		EFIDLP
C[C@@H](C[NH2+]C1CCN(CC(F)F)CC1)[N@H+](C)Cc1ccccc1	ZINC000160867182	473185242	/nfs/dbraw/zinc/18/52/42/473185242.db2.gz	QLXJSKDLRCSTLS-HNNXBMFYSA-N	2	2	325.447	2.826	20	70		EFIDLP
C[C@@H](C[NH2+]C1CCN(CC(F)F)CC1)[N@@H+](C)Cc1ccccc1	ZINC000160867182	473185247	/nfs/dbraw/zinc/18/52/47/473185247.db2.gz	QLXJSKDLRCSTLS-HNNXBMFYSA-N	2	2	325.447	2.826	20	70		EFIDLP
CC(=O)NC1CCC([NH2+][C@H](C[NH+]2CCCC2)c2ccccc2)CC1	ZINC000161203878	526702387	/nfs/dbraw/zinc/70/23/87/526702387.db2.gz	SSRXEFWHEQQZDN-SOAGJPPSSA-N	2	2	329.488	2.860	20	70		EFIDLP
O=C(NCC[NH2+]C1CCCCCC1)c1cccc(-n2cc[nH+]c2)c1	ZINC000159709596	239033209	/nfs/dbraw/zinc/03/32/09/239033209.db2.gz	SIMRPVIGDQKPJX-UHFFFAOYSA-N	2	2	326.444	2.915	20	70		EFIDLP
Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c(C)c1	ZINC000161377621	544813720	/nfs/dbraw/zinc/81/37/20/544813720.db2.gz	PNYJULULEGJKDV-QGZVFWFLSA-N	2	2	338.455	2.848	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)N(C)C(C)C	ZINC000160034656	276121470	/nfs/dbraw/zinc/12/14/70/276121470.db2.gz	DFHAAUONQAVMGJ-KRWDZBQOSA-N	2	2	346.519	2.875	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)N(C)C(C)C	ZINC000160034656	276121471	/nfs/dbraw/zinc/12/14/71/276121471.db2.gz	DFHAAUONQAVMGJ-KRWDZBQOSA-N	2	2	346.519	2.875	20	70		EFIDLP
CCC(CC)(C[NH3+])C(=O)NCc1cc[nH+]c(N2CCCCCC2)c1	ZINC000161285061	276208548	/nfs/dbraw/zinc/20/85/48/276208548.db2.gz	REEBPEIIPAIVHG-UHFFFAOYSA-N	2	2	332.492	2.843	20	70		EFIDLP
CCN(CC)c1ccc(CNC(=O)c2ccc(C[NH+](C)C)cc2)c[nH+]1	ZINC000160343600	310697902	/nfs/dbraw/zinc/69/79/02/310697902.db2.gz	YWZQGROOHZHYRH-UHFFFAOYSA-N	2	2	340.471	2.919	20	70		EFIDLP
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1	ZINC000161124718	473208977	/nfs/dbraw/zinc/20/89/77/473208977.db2.gz	IQVADGMGPYJXQV-JYBIWHBTSA-N	3	2	330.520	2.754	20	70		EFIDLP
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1	ZINC000161124718	473208983	/nfs/dbraw/zinc/20/89/83/473208983.db2.gz	IQVADGMGPYJXQV-JYBIWHBTSA-N	3	2	330.520	2.754	20	70		EFIDLP
CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1	ZINC000161398230	473232554	/nfs/dbraw/zinc/23/25/54/473232554.db2.gz	ULSFFBQKYXMDPD-MRXNPFEDSA-N	2	2	325.497	2.804	20	70		EFIDLP
CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](CCC[NH+]2CCCCC2)C1	ZINC000161398230	473232556	/nfs/dbraw/zinc/23/25/56/473232556.db2.gz	ULSFFBQKYXMDPD-MRXNPFEDSA-N	2	2	325.497	2.804	20	70		EFIDLP
CC[C@@H](c1ccc(F)cc1)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159401986	473025645	/nfs/dbraw/zinc/02/56/45/473025645.db2.gz	CGJMPHPNZYPOQL-ZWKOTPCHSA-N	2	2	333.451	2.691	20	70		EFIDLP
CC[C@@H](c1ccc(F)cc1)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159401986	473025649	/nfs/dbraw/zinc/02/56/49/473025649.db2.gz	CGJMPHPNZYPOQL-ZWKOTPCHSA-N	2	2	333.451	2.691	20	70		EFIDLP
Brc1ccccc1[C@H]1CN(CCn2cc[nH+]c2)CCO1	ZINC000159789231	473060990	/nfs/dbraw/zinc/06/09/90/473060990.db2.gz	JVNCLERYHCRXEQ-OAHLLOKOSA-N	2	2	336.233	2.719	20	70		EFIDLP
Brc1ccccc1[C@H]1C[N@H+](CCn2cc[nH+]c2)CCO1	ZINC000159789231	473060997	/nfs/dbraw/zinc/06/09/97/473060997.db2.gz	JVNCLERYHCRXEQ-OAHLLOKOSA-N	2	2	336.233	2.719	20	70		EFIDLP
Brc1ccccc1[C@H]1C[N@@H+](CCn2cc[nH+]c2)CCO1	ZINC000159789231	473061009	/nfs/dbraw/zinc/06/10/09/473061009.db2.gz	JVNCLERYHCRXEQ-OAHLLOKOSA-N	2	2	336.233	2.719	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1)c1cnccn1	ZINC000160315614	473106413	/nfs/dbraw/zinc/10/64/13/473106413.db2.gz	HBBGLPGNQZZYIF-ULQDDVLXSA-N	2	2	340.471	2.937	20	70		EFIDLP
C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CC[NH+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311637	473106666	/nfs/dbraw/zinc/10/66/66/473106666.db2.gz	AXQUUBLSHNYOCX-UGNRZPKXSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+][C@H]2CC[NH+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311637	473106679	/nfs/dbraw/zinc/10/66/79/473106679.db2.gz	AXQUUBLSHNYOCX-UGNRZPKXSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311637	473106686	/nfs/dbraw/zinc/10/66/86/473106686.db2.gz	AXQUUBLSHNYOCX-UGNRZPKXSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)C[C@H](C)O1	ZINC000160311637	473106692	/nfs/dbraw/zinc/10/66/92/473106692.db2.gz	AXQUUBLSHNYOCX-UGNRZPKXSA-N	3	2	345.531	2.868	20	70		EFIDLP
CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493686	473132475	/nfs/dbraw/zinc/13/24/75/473132475.db2.gz	RPJWNZZJDLCQQN-VQIMIIECSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493686	473132485	/nfs/dbraw/zinc/13/24/85/473132485.db2.gz	RPJWNZZJDLCQQN-VQIMIIECSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493686	473132491	/nfs/dbraw/zinc/13/24/91/473132491.db2.gz	RPJWNZZJDLCQQN-VQIMIIECSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[NH+](C)C[C@H]1CC[N@H+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493686	473132495	/nfs/dbraw/zinc/13/24/95/473132495.db2.gz	RPJWNZZJDLCQQN-VQIMIIECSA-N	2	2	347.478	2.985	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1cncc(F)c1	ZINC000160619033	473152877	/nfs/dbraw/zinc/15/28/77/473152877.db2.gz	PWNJJCJTRHXFJU-HNNXBMFYSA-N	2	2	329.419	2.904	20	70		EFIDLP
Brc1ccc([C@@H]2C[N@H+](CCn3cc[nH+]c3)CCO2)cc1	ZINC000159776136	526644412	/nfs/dbraw/zinc/64/44/12/526644412.db2.gz	PNVFNGRLPFLBME-HNNXBMFYSA-N	2	2	336.233	2.719	20	70		EFIDLP
Brc1ccc([C@@H]2C[N@@H+](CCn3cc[nH+]c3)CCO2)cc1	ZINC000159776136	526644413	/nfs/dbraw/zinc/64/44/13/526644413.db2.gz	PNVFNGRLPFLBME-HNNXBMFYSA-N	2	2	336.233	2.719	20	70		EFIDLP
CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000159830658	528033917	/nfs/dbraw/zinc/03/39/17/528033917.db2.gz	UXVTXAGZFBPCKU-SJORKVTESA-N	2	2	331.504	2.670	20	70		EFIDLP
CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@H](C)[N@H+]1CCc2ccccc2C1	ZINC000159830658	528033919	/nfs/dbraw/zinc/03/39/19/528033919.db2.gz	UXVTXAGZFBPCKU-SJORKVTESA-N	2	2	331.504	2.670	20	70		EFIDLP
Clc1ccc(CN2CC[NH+](CCC[NH+]3CCCCC3)CC2)cn1	ZINC000161140081	206329568	/nfs/dbraw/zinc/32/95/68/206329568.db2.gz	WXCKRYLDFHOWTN-UHFFFAOYSA-N	2	2	336.911	2.729	20	70		EFIDLP
CCN(C(=O)[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccccc1	ZINC000161334514	544813049	/nfs/dbraw/zinc/81/30/49/544813049.db2.gz	QIBUFRZABDUFOE-QGZVFWFLSA-N	2	2	338.455	2.645	20	70		EFIDLP
C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161342588	544813192	/nfs/dbraw/zinc/81/31/92/544813192.db2.gz	HUDZYLHRLLOXAE-MTNOOBJLSA-N	2	2	344.503	2.533	20	70		EFIDLP
Brc1ccccc1[C@@H]1C[N@H+](CCn2cc[nH+]c2)CCO1	ZINC000159789096	275375388	/nfs/dbraw/zinc/37/53/88/275375388.db2.gz	JVNCLERYHCRXEQ-HNNXBMFYSA-N	2	2	336.233	2.719	20	70		EFIDLP
Brc1ccccc1[C@@H]1C[N@@H+](CCn2cc[nH+]c2)CCO1	ZINC000159789096	275375389	/nfs/dbraw/zinc/37/53/89/275375389.db2.gz	JVNCLERYHCRXEQ-HNNXBMFYSA-N	2	2	336.233	2.719	20	70		EFIDLP
[NH3+]C1(CNC(=O)[C@H](c2ccccc2)[NH+]2CCSCC2)CCCCC1	ZINC000159673948	303359399	/nfs/dbraw/zinc/35/93/99/303359399.db2.gz	VGQWYERJPDXEBP-KRWDZBQOSA-N	2	2	347.528	2.554	20	70		EFIDLP
COc1ccc(OCC[NH+]2CCN(c3cc(C)cc[nH+]3)CC2)cc1	ZINC000161134718	473210451	/nfs/dbraw/zinc/21/04/51/473210451.db2.gz	MLMKPFAHCABZQV-UHFFFAOYSA-N	2	2	327.428	2.600	20	70		EFIDLP
O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161331079	473226864	/nfs/dbraw/zinc/22/68/64/473226864.db2.gz	RHXRTFGWCQNEMZ-QGZVFWFLSA-N	2	2	338.455	2.723	20	70		EFIDLP
Cc1c(C[NH2+]C[C@@H](C(C)C)[N@@H+]2CCc3ccccc3C2)cnn1C	ZINC000159758689	473057981	/nfs/dbraw/zinc/05/79/81/473057981.db2.gz	ZPEVKJKLXLCGEL-FQEVSTJZSA-N	2	2	326.488	2.901	20	70		EFIDLP
Cc1c(C[NH2+]C[C@@H](C(C)C)[N@H+]2CCc3ccccc3C2)cnn1C	ZINC000159758689	473057985	/nfs/dbraw/zinc/05/79/85/473057985.db2.gz	ZPEVKJKLXLCGEL-FQEVSTJZSA-N	2	2	326.488	2.901	20	70		EFIDLP
C[NH+](C)CCCC1CCN(C(=O)NCc2cn3ccccc3[nH+]2)CC1	ZINC000159888910	473068816	/nfs/dbraw/zinc/06/88/16/473068816.db2.gz	KSEUMKQPNQNALZ-UHFFFAOYSA-N	2	2	343.475	2.598	20	70		EFIDLP
CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493546	473132839	/nfs/dbraw/zinc/13/28/39/473132839.db2.gz	RPJWNZZJDLCQQN-QFBILLFUSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493546	473132845	/nfs/dbraw/zinc/13/28/45/473132845.db2.gz	RPJWNZZJDLCQQN-QFBILLFUSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493546	473132850	/nfs/dbraw/zinc/13/28/50/473132850.db2.gz	RPJWNZZJDLCQQN-QFBILLFUSA-N	2	2	347.478	2.985	20	70		EFIDLP
CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000160493546	473132856	/nfs/dbraw/zinc/13/28/56/473132856.db2.gz	RPJWNZZJDLCQQN-QFBILLFUSA-N	2	2	347.478	2.985	20	70		EFIDLP
COCC[N@H+](C)CC[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C	ZINC000159381323	225206500	/nfs/dbraw/zinc/20/65/00/225206500.db2.gz	AXBWQEWKVDPPNH-CYBMUJFWSA-N	2	2	334.489	2.742	20	70		EFIDLP
COCC[N@@H+](C)CC[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C	ZINC000159381323	225206503	/nfs/dbraw/zinc/20/65/03/225206503.db2.gz	AXBWQEWKVDPPNH-CYBMUJFWSA-N	2	2	334.489	2.742	20	70		EFIDLP
CCC[NH+]1CCC([NH2+][C@@H](CN2CCCC2=O)c2ccccc2)CC1	ZINC000160649545	544807189	/nfs/dbraw/zinc/80/71/89/544807189.db2.gz	UCUIDNRIXJCPNF-IBGZPJMESA-N	2	2	329.488	2.814	20	70		EFIDLP
Cc1ccc(NC(=O)C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1Cl	ZINC000161294587	544810891	/nfs/dbraw/zinc/81/08/91/544810891.db2.gz	XQIMIRDLYZXMNL-UHFFFAOYSA-N	2	2	344.846	2.804	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]CC(C)(C)[N@@H+]2CCc3ccccc3C2)CC1	ZINC000161372035	278088398	/nfs/dbraw/zinc/08/83/98/278088398.db2.gz	DVFWJOBSLMHASM-UHFFFAOYSA-N	2	2	343.515	2.860	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]CC(C)(C)[N@H+]2CCc3ccccc3C2)CC1	ZINC000161372035	278088400	/nfs/dbraw/zinc/08/84/00/278088400.db2.gz	DVFWJOBSLMHASM-UHFFFAOYSA-N	2	2	343.515	2.860	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]C[C@@H](c2ccccc2)[NH+]2CCCC2)CC1	ZINC000161210513	278088517	/nfs/dbraw/zinc/08/85/17/278088517.db2.gz	RRJFPMCQWXYKPO-MHJFOBGBSA-N	2	2	329.488	2.860	20	70		EFIDLP
[NH3+]C1(CNC(=O)[C@@H](c2ccccc2)[NH+]2CCSCC2)CCCCC1	ZINC000159674085	303359143	/nfs/dbraw/zinc/35/91/43/303359143.db2.gz	VGQWYERJPDXEBP-QGZVFWFLSA-N	2	2	347.528	2.554	20	70		EFIDLP
CCc1nn(C)c(CC)c1C[NH2+]C1CC[NH+](Cc2ccccn2)CC1	ZINC000160256483	310696701	/nfs/dbraw/zinc/69/67/01/310696701.db2.gz	HVCSNTCAAMUOOL-UHFFFAOYSA-N	2	2	341.503	2.694	20	70		EFIDLP
CC[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)N1CCN(c2cccc[nH+]2)CC1	ZINC000161421046	473234898	/nfs/dbraw/zinc/23/48/98/473234898.db2.gz	VZGRZSQNHBLHFV-ROUUACIJSA-N	2	2	344.503	2.679	20	70		EFIDLP
Cc1c([C@H](C)[NH2+]C2CC[NH+](C)CC2)nnn1-c1ccc(Cl)cc1	ZINC000161486487	473238630	/nfs/dbraw/zinc/23/86/30/473238630.db2.gz	YOPDVMPVTPGBME-LBPRGKRZSA-N	2	2	333.867	2.974	20	70		EFIDLP
C[C@H](c1ccccc1Cl)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159370671	473022374	/nfs/dbraw/zinc/02/23/74/473022374.db2.gz	BYRUMAYWSZSGNE-CXAGYDPISA-N	2	2	335.879	2.815	20	70		EFIDLP
C[C@H](c1ccccc1Cl)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159370671	473022376	/nfs/dbraw/zinc/02/23/76/473022376.db2.gz	BYRUMAYWSZSGNE-CXAGYDPISA-N	2	2	335.879	2.815	20	70		EFIDLP
C[NH+](C)Cc1ccc(C(=O)NCc2cccc(Cn3cc[nH+]c3)c2)cc1	ZINC000159948707	473075062	/nfs/dbraw/zinc/07/50/62/473075062.db2.gz	WWLCKPSVDIGKRX-UHFFFAOYSA-N	2	2	348.450	2.923	20	70		EFIDLP
Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+](CC(=O)N(C)C)CC2)cc1C	ZINC000160441035	473125611	/nfs/dbraw/zinc/12/56/11/473125611.db2.gz	RXFYKEXSPBSVCG-KRWDZBQOSA-N	2	2	331.504	2.815	20	70		EFIDLP
C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1cncc(F)c1	ZINC000160486190	473130963	/nfs/dbraw/zinc/13/09/63/473130963.db2.gz	PFPBDQNAORBRER-OAHLLOKOSA-N	2	2	329.419	2.904	20	70		EFIDLP
Cc1cc(N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C(C)C)[nH+]1	ZINC000160502128	473134108	/nfs/dbraw/zinc/13/41/08/473134108.db2.gz	CAXBCKPRVOCAEM-IXDOHACOSA-N	2	2	332.492	2.986	20	70		EFIDLP
Cc1cc(N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C(C)C)[nH+]1	ZINC000160502128	473134114	/nfs/dbraw/zinc/13/41/14/473134114.db2.gz	CAXBCKPRVOCAEM-IXDOHACOSA-N	2	2	332.492	2.986	20	70		EFIDLP
Cc1cc(N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C(C)C)[nH+]1	ZINC000160502270	473134395	/nfs/dbraw/zinc/13/43/95/473134395.db2.gz	CAXBCKPRVOCAEM-BBWFWOEESA-N	2	2	332.492	2.986	20	70		EFIDLP
Cc1cc(N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nc(C(C)C)[nH+]1	ZINC000160502270	473134397	/nfs/dbraw/zinc/13/43/97/473134397.db2.gz	CAXBCKPRVOCAEM-BBWFWOEESA-N	2	2	332.492	2.986	20	70		EFIDLP
CCN(CC)C(=O)[C@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160069369	528057671	/nfs/dbraw/zinc/05/76/71/528057671.db2.gz	ATOAYDZUFRMTAL-KRWDZBQOSA-N	2	2	346.519	2.877	20	70		EFIDLP
CCN(CC)C(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160069369	528057679	/nfs/dbraw/zinc/05/76/79/528057679.db2.gz	ATOAYDZUFRMTAL-KRWDZBQOSA-N	2	2	346.519	2.877	20	70		EFIDLP
CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1	ZINC000160284424	528155714	/nfs/dbraw/zinc/15/57/14/528155714.db2.gz	RCQUQBMUQPMERT-MJGOQNOKSA-N	3	2	333.520	2.980	20	70		EFIDLP
CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000160284424	528155722	/nfs/dbraw/zinc/15/57/22/528155722.db2.gz	RCQUQBMUQPMERT-MJGOQNOKSA-N	3	2	333.520	2.980	20	70		EFIDLP
CCC[NH+]1CCC([NH2+][C@H](CN2CCCC2=O)c2ccccc2)CC1	ZINC000160649663	544807854	/nfs/dbraw/zinc/80/78/54/544807854.db2.gz	UCUIDNRIXJCPNF-LJQANCHMSA-N	2	2	329.488	2.814	20	70		EFIDLP
CCN(C(=O)[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1)C1CCCCC1	ZINC000161398926	544813233	/nfs/dbraw/zinc/81/32/33/544813233.db2.gz	VSXMLPAWTXUVPI-KRWDZBQOSA-N	2	2	344.503	2.773	20	70		EFIDLP
CC(C)CCC[C@@H](C)NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161388307	544813665	/nfs/dbraw/zinc/81/36/65/544813665.db2.gz	KINRBWLEQDMCAB-QGZVFWFLSA-N	2	2	332.492	2.535	20	70		EFIDLP
C[N@@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1cccc(Cl)c1	ZINC000161131877	473210045	/nfs/dbraw/zinc/21/00/45/473210045.db2.gz	FVNXKTDOVSDLAK-UHFFFAOYSA-N	2	2	345.878	2.514	20	70		EFIDLP
C[N@H+](Cc1cnc(N2CC[NH+](C)CC2)nc1)Cc1cccc(Cl)c1	ZINC000161131877	473210050	/nfs/dbraw/zinc/21/00/50/473210050.db2.gz	FVNXKTDOVSDLAK-UHFFFAOYSA-N	2	2	345.878	2.514	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]C[C@@H](c2cccs2)[NH+]2CCCC2)CC1	ZINC000161210757	473217981	/nfs/dbraw/zinc/21/79/81/473217981.db2.gz	DHUWWAKZBFGLAK-JCYILVPMSA-N	2	2	335.517	2.922	20	70		EFIDLP
O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1CCn2cc[nH+]c2C1	ZINC000161331174	473227211	/nfs/dbraw/zinc/22/72/11/473227211.db2.gz	RHXRTFGWCQNEMZ-KRWDZBQOSA-N	2	2	338.455	2.723	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NC(C)(C)C	ZINC000160002784	473080278	/nfs/dbraw/zinc/08/02/78/473080278.db2.gz	XCXBXQTVXLTFIC-MRXNPFEDSA-N	2	2	346.519	2.923	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NC(C)(C)C	ZINC000160002784	473080284	/nfs/dbraw/zinc/08/02/84/473080284.db2.gz	XCXBXQTVXLTFIC-MRXNPFEDSA-N	2	2	346.519	2.923	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NC(C)(C)C	ZINC000160002653	473080579	/nfs/dbraw/zinc/08/05/79/473080579.db2.gz	XCXBXQTVXLTFIC-INIZCTEOSA-N	2	2	346.519	2.923	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NC(C)(C)C	ZINC000160002653	473080584	/nfs/dbraw/zinc/08/05/84/473080584.db2.gz	XCXBXQTVXLTFIC-INIZCTEOSA-N	2	2	346.519	2.923	20	70		EFIDLP
CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000160085031	473086214	/nfs/dbraw/zinc/08/62/14/473086214.db2.gz	FKIISBNZWVGBNY-MSOLQXFVSA-N	2	2	335.536	2.830	20	70		EFIDLP
CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000160085031	473086220	/nfs/dbraw/zinc/08/62/20/473086220.db2.gz	FKIISBNZWVGBNY-MSOLQXFVSA-N	2	2	335.536	2.830	20	70		EFIDLP
CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000160085031	473086224	/nfs/dbraw/zinc/08/62/24/473086224.db2.gz	FKIISBNZWVGBNY-MSOLQXFVSA-N	2	2	335.536	2.830	20	70		EFIDLP
CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000160085031	473086229	/nfs/dbraw/zinc/08/62/29/473086229.db2.gz	FKIISBNZWVGBNY-MSOLQXFVSA-N	2	2	335.536	2.830	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H]1CCN(C(C)C)C1=O	ZINC000160024784	528348852	/nfs/dbraw/zinc/34/88/52/528348852.db2.gz	RJNYDYFIJXBJTB-GOSISDBHSA-N	2	2	344.503	2.629	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H]1CCN(C(C)C)C1=O	ZINC000160024784	528348859	/nfs/dbraw/zinc/34/88/59/528348859.db2.gz	RJNYDYFIJXBJTB-GOSISDBHSA-N	2	2	344.503	2.629	20	70		EFIDLP
CCCCNC(=O)[C@@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160032686	528523289	/nfs/dbraw/zinc/52/32/89/528523289.db2.gz	ZVXHIDCXQLFBRM-QGZVFWFLSA-N	2	2	346.519	2.925	20	70		EFIDLP
CCCCNC(=O)[C@@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160032686	528523294	/nfs/dbraw/zinc/52/32/94/528523294.db2.gz	ZVXHIDCXQLFBRM-QGZVFWFLSA-N	2	2	346.519	2.925	20	70		EFIDLP
Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c(C)n1	ZINC000160451357	282165729	/nfs/dbraw/zinc/16/57/29/282165729.db2.gz	ZIVHKGMAUUBJOE-HNNXBMFYSA-N	2	2	340.471	2.776	20	70		EFIDLP
C[NH+]1CCC([NH2+][C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CC1	ZINC000159569640	530050625	/nfs/dbraw/zinc/05/06/25/530050625.db2.gz	GDNRGLBTWOPZNC-HXUWFJFHSA-N	2	2	337.467	2.920	20	70		EFIDLP
Cc1cccc(C)c1NC(=O)[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161385266	544813024	/nfs/dbraw/zinc/81/30/24/544813024.db2.gz	HOKJBWOQQPSJJK-QGZVFWFLSA-N	2	2	338.455	2.848	20	70		EFIDLP
Cc1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c1	ZINC000161376038	544813284	/nfs/dbraw/zinc/81/32/84/544813284.db2.gz	KHAGWWCJGDIEBO-KRWDZBQOSA-N	2	2	338.455	2.848	20	70		EFIDLP
Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1F	ZINC000161383559	544813738	/nfs/dbraw/zinc/81/37/38/544813738.db2.gz	YIVCBCTZMTVNJJ-OAHLLOKOSA-N	2	2	342.418	2.678	20	70		EFIDLP
Cc1ccc(NC(=O)[C@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1F	ZINC000161383651	544814013	/nfs/dbraw/zinc/81/40/13/544814013.db2.gz	YIVCBCTZMTVNJJ-HNNXBMFYSA-N	2	2	342.418	2.678	20	70		EFIDLP
CC[C@@H](C[NH2+]C1CCC(NC(C)=O)CC1)[N@@H+]1CCc2ccccc2C1	ZINC000161255384	473220610	/nfs/dbraw/zinc/22/06/10/473220610.db2.gz	JTTJTNPLBIMAEW-CBNMVNINSA-N	2	2	343.515	2.860	20	70		EFIDLP
CC[C@@H](C[NH2+]C1CCC(NC(C)=O)CC1)[N@H+]1CCc2ccccc2C1	ZINC000161255384	473220613	/nfs/dbraw/zinc/22/06/13/473220613.db2.gz	JTTJTNPLBIMAEW-CBNMVNINSA-N	2	2	343.515	2.860	20	70		EFIDLP
CCC(CC)(C[NH3+])C(=O)N(C)Cc1[nH+]ccn1Cc1ccccc1	ZINC000161293659	473225143	/nfs/dbraw/zinc/22/51/43/473225143.db2.gz	FECHJDOTHGVYAN-UHFFFAOYSA-N	2	2	328.460	2.655	20	70		EFIDLP
C[N@H+](CCC[NH+]1CCCCC1)C1CC[NH+](CCc2ccccn2)CC1	ZINC000161398534	473232598	/nfs/dbraw/zinc/23/25/98/473232598.db2.gz	HXNITWQFPXIWJD-UHFFFAOYSA-N	3	2	344.547	2.896	20	70		EFIDLP
C[N@@H+](CCC[NH+]1CCCCC1)C1CC[NH+](CCc2ccccn2)CC1	ZINC000161398534	473232600	/nfs/dbraw/zinc/23/26/00/473232600.db2.gz	HXNITWQFPXIWJD-UHFFFAOYSA-N	3	2	344.547	2.896	20	70		EFIDLP
CCCNC(=O)[C@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160003207	473080545	/nfs/dbraw/zinc/08/05/45/473080545.db2.gz	XVZPMIJKKVGDRZ-INIZCTEOSA-N	2	2	332.492	2.535	20	70		EFIDLP
CCCNC(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160003207	473080550	/nfs/dbraw/zinc/08/05/50/473080550.db2.gz	XVZPMIJKKVGDRZ-INIZCTEOSA-N	2	2	332.492	2.535	20	70		EFIDLP
C[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCN(c3nc(C(C)(C)C)ns3)CC1)C2	ZINC000160118787	473088318	/nfs/dbraw/zinc/08/83/18/473088318.db2.gz	NCQSFSKKEOALIV-YIONKMFJSA-N	2	2	349.548	2.583	20	70		EFIDLP
C[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCN(c3nc(C(C)(C)C)ns3)CC1)C2	ZINC000160118787	473088322	/nfs/dbraw/zinc/08/83/22/473088322.db2.gz	NCQSFSKKEOALIV-YIONKMFJSA-N	2	2	349.548	2.583	20	70		EFIDLP
Brc1ccc([C@H]2C[N@H+](CCn3cc[nH+]c3)CCO2)cc1	ZINC000159776281	526644183	/nfs/dbraw/zinc/64/41/83/526644183.db2.gz	PNVFNGRLPFLBME-OAHLLOKOSA-N	2	2	336.233	2.719	20	70		EFIDLP
Brc1ccc([C@H]2C[N@@H+](CCn3cc[nH+]c3)CCO2)cc1	ZINC000159776281	526644188	/nfs/dbraw/zinc/64/41/88/526644188.db2.gz	PNVFNGRLPFLBME-OAHLLOKOSA-N	2	2	336.233	2.719	20	70		EFIDLP
CCC[C@@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(OC)cc1	ZINC000160371914	529004223	/nfs/dbraw/zinc/00/42/23/529004223.db2.gz	KLFQVXNTRHNPNU-LJQANCHMSA-N	2	2	347.503	2.679	20	70		EFIDLP
Cc1cc(C)c([C@@H](C)[NH2+]C2CC[NH+](CC(=O)N(C)C)CC2)cc1C	ZINC000160440911	206297339	/nfs/dbraw/zinc/29/73/39/206297339.db2.gz	RXFYKEXSPBSVCG-QGZVFWFLSA-N	2	2	331.504	2.815	20	70		EFIDLP
O=C1[C@H]([NH+]2CCC(n3cc[nH+]c3)CC2)CCCN1c1ccccc1F	ZINC000160711050	206309717	/nfs/dbraw/zinc/30/97/17/206309717.db2.gz	YQQJIZOEUIFLQQ-GOSISDBHSA-N	2	2	342.418	2.855	20	70		EFIDLP
Cc1c([C@@H](C)[NH2+]C2CC[NH+](C)CC2)nnn1-c1cccc(Cl)c1	ZINC000161414932	206346747	/nfs/dbraw/zinc/34/67/47/206346747.db2.gz	PLRGFXGVKDKESL-GFCCVEGCSA-N	2	2	333.867	2.974	20	70		EFIDLP
Cc1c([C@@H](C)[NH2+]C2CC[NH+](C)CC2)nnn1-c1ccc(Cl)cc1	ZINC000161486350	206351515	/nfs/dbraw/zinc/35/15/15/206351515.db2.gz	YOPDVMPVTPGBME-GFCCVEGCSA-N	2	2	333.867	2.974	20	70		EFIDLP
C[C@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161306619	544812497	/nfs/dbraw/zinc/81/24/97/544812497.db2.gz	XGLVSAMVZXUVDU-CQSZACIVSA-N	2	2	344.846	2.884	20	70		EFIDLP
Cc1ccc(NC(=O)[C@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c(C)c1	ZINC000161377757	544813589	/nfs/dbraw/zinc/81/35/89/544813589.db2.gz	PNYJULULEGJKDV-KRWDZBQOSA-N	2	2	338.455	2.848	20	70		EFIDLP
Cc1ccc(C)c(NC(=O)[C@@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c1	ZINC000161375911	544814043	/nfs/dbraw/zinc/81/40/43/544814043.db2.gz	KHAGWWCJGDIEBO-QGZVFWFLSA-N	2	2	338.455	2.848	20	70		EFIDLP
CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161252833	473221116	/nfs/dbraw/zinc/22/11/16/473221116.db2.gz	IPMTVYWSXHWXKT-GOSISDBHSA-N	2	2	340.471	2.556	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]C2CC[NH+](Cc3ccc(F)cc3)CC2)CC1	ZINC000161316852	473225757	/nfs/dbraw/zinc/22/57/57/473225757.db2.gz	DLQJPHOHHOPOMT-UHFFFAOYSA-N	2	2	347.478	2.827	20	70		EFIDLP
CC[C@H]1CCCC[C@H]1[NH2+]CCC(=O)N1CCN(c2cccc[nH+]2)CC1	ZINC000161421346	473234508	/nfs/dbraw/zinc/23/45/08/473234508.db2.gz	VZGRZSQNHBLHFV-ZWKOTPCHSA-N	2	2	344.503	2.679	20	70		EFIDLP
O[C@H](C[NH2+]Cc1cc(Cl)ccc1F)C[N@@H+]1CCc2ccccc2C1	ZINC000159971495	473077728	/nfs/dbraw/zinc/07/77/28/473077728.db2.gz	XSCKARVJAUPZBI-GOSISDBHSA-N	2	2	348.849	2.988	20	70		EFIDLP
O[C@H](C[NH2+]Cc1cc(Cl)ccc1F)C[N@H+]1CCc2ccccc2C1	ZINC000159971495	473077734	/nfs/dbraw/zinc/07/77/34/473077734.db2.gz	XSCKARVJAUPZBI-GOSISDBHSA-N	2	2	348.849	2.988	20	70		EFIDLP
C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@H]2CC[NH+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311503	473107379	/nfs/dbraw/zinc/10/73/79/473107379.db2.gz	AXQUUBLSHNYOCX-WIRSXHRWSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[N@H+](Cc2ccccc2C[NH2+][C@H]2CC[NH+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311503	473107388	/nfs/dbraw/zinc/10/73/88/473107388.db2.gz	AXQUUBLSHNYOCX-WIRSXHRWSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311503	473107395	/nfs/dbraw/zinc/10/73/95/473107395.db2.gz	AXQUUBLSHNYOCX-WIRSXHRWSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)C[C@H](C)O1	ZINC000160311503	473107397	/nfs/dbraw/zinc/10/73/97/473107397.db2.gz	AXQUUBLSHNYOCX-WIRSXHRWSA-N	3	2	345.531	2.868	20	70		EFIDLP
C[NH+](C)Cc1cccc(NC(=O)N[C@@H]2CCN(c3cccc[nH+]3)C2)c1	ZINC000160649079	473156404	/nfs/dbraw/zinc/15/64/04/473156404.db2.gz	KGQHQZBHRKAKEX-QGZVFWFLSA-N	2	2	339.443	2.544	20	70		EFIDLP
CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)N1CCC(n2cc[nH+]c2)CC1	ZINC000160967182	473195438	/nfs/dbraw/zinc/19/54/38/473195438.db2.gz	GJZXSPRRIAXCRI-SFHVURJKSA-N	2	2	347.507	2.740	20	70		EFIDLP
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC(n2cc[nH+]c2)CC1	ZINC000160967182	473195442	/nfs/dbraw/zinc/19/54/42/473195442.db2.gz	GJZXSPRRIAXCRI-SFHVURJKSA-N	2	2	347.507	2.740	20	70		EFIDLP
O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)N1CCCC[C@H]1c1[nH]cc[nH+]1	ZINC000160814032	284053845	/nfs/dbraw/zinc/05/38/45/284053845.db2.gz	KSGXSHUYDDNAKK-ZBFHGGJFSA-N	2	2	331.464	2.663	20	70		EFIDLP
O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@H]1c1[nH]cc[nH+]1	ZINC000160814032	284053846	/nfs/dbraw/zinc/05/38/46/284053846.db2.gz	KSGXSHUYDDNAKK-ZBFHGGJFSA-N	2	2	331.464	2.663	20	70		EFIDLP
C[C@@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161332463	544814137	/nfs/dbraw/zinc/81/41/37/544814137.db2.gz	TYNZSSUODDPDPQ-AWEZNQCLSA-N	2	2	344.846	2.884	20	70		EFIDLP
CC(=O)NC1CCC([NH2+]C[C@H](c2ccccc2)[NH+]2CCCC2)CC1	ZINC000161210616	275477394	/nfs/dbraw/zinc/47/73/94/275477394.db2.gz	RRJFPMCQWXYKPO-SOAGJPPSSA-N	2	2	329.488	2.860	20	70		EFIDLP
CC[NH+](CC)CCCNC(=O)NCCNc1ccc2ccccc2[nH+]1	ZINC000161155281	473212854	/nfs/dbraw/zinc/21/28/54/473212854.db2.gz	YMUOBCGLWNHPCP-UHFFFAOYSA-N	2	2	343.475	2.678	20	70		EFIDLP
CC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000161159126	473213421	/nfs/dbraw/zinc/21/34/21/473213421.db2.gz	MHBILGZOEHEWCI-UONOGXRCSA-N	2	2	338.883	2.916	20	70		EFIDLP
CC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)CC(=O)Nc1cccnc1Cl	ZINC000161159126	473213426	/nfs/dbraw/zinc/21/34/26/473213426.db2.gz	MHBILGZOEHEWCI-UONOGXRCSA-N	2	2	338.883	2.916	20	70		EFIDLP
CC(=O)NC1CCC([NH2+][C@@H](C[NH+]2CCCC2)c2ccccc2)CC1	ZINC000161203776	473216888	/nfs/dbraw/zinc/21/68/88/473216888.db2.gz	SSRXEFWHEQQZDN-MHJFOBGBSA-N	2	2	329.488	2.860	20	70		EFIDLP
CC[N@@H+]1CCCC[C@@H]1CN[C@@H]1CC[NH+](Cc2ccccn2)C[C@@H]1C	ZINC000161206844	473217378	/nfs/dbraw/zinc/21/73/78/473217378.db2.gz	NVFNEROHNDPSBW-DFQSSKMNSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[N@H+]1CCCC[C@@H]1CN[C@@H]1CC[NH+](Cc2ccccn2)C[C@@H]1C	ZINC000161206844	473217380	/nfs/dbraw/zinc/21/73/80/473217380.db2.gz	NVFNEROHNDPSBW-DFQSSKMNSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[NH+]1CCCC[C@@H]1CN[C@@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C	ZINC000161206844	473217385	/nfs/dbraw/zinc/21/73/85/473217385.db2.gz	NVFNEROHNDPSBW-DFQSSKMNSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[NH+]1CCCC[C@@H]1CN[C@@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C	ZINC000161206844	473217390	/nfs/dbraw/zinc/21/73/90/473217390.db2.gz	NVFNEROHNDPSBW-DFQSSKMNSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[C@H](C[NH2+]C1CCC(NC(C)=O)CC1)[N@@H+]1CCc2ccccc2C1	ZINC000161255505	473221009	/nfs/dbraw/zinc/22/10/09/473221009.db2.gz	JTTJTNPLBIMAEW-XVAXZDLZSA-N	2	2	343.515	2.860	20	70		EFIDLP
CC[C@H](C[NH2+]C1CCC(NC(C)=O)CC1)[N@H+]1CCc2ccccc2C1	ZINC000161255505	473221013	/nfs/dbraw/zinc/22/10/13/473221013.db2.gz	JTTJTNPLBIMAEW-XVAXZDLZSA-N	2	2	343.515	2.860	20	70		EFIDLP
CN(C(=O)OC(C)(C)C)[C@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1	ZINC000161398369	473232588	/nfs/dbraw/zinc/23/25/88/473232588.db2.gz	ULSFFBQKYXMDPD-INIZCTEOSA-N	2	2	325.497	2.804	20	70		EFIDLP
CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](CCC[NH+]2CCCCC2)C1	ZINC000161398369	473232589	/nfs/dbraw/zinc/23/25/89/473232589.db2.gz	ULSFFBQKYXMDPD-INIZCTEOSA-N	2	2	325.497	2.804	20	70		EFIDLP
CC1(C)CC([NH2+]C2CC[NH+](Cc3ccncc3)CC2)CC(C)(C)[NH2+]1	ZINC000159599262	473043001	/nfs/dbraw/zinc/04/30/01/473043001.db2.gz	QLMLBTSBLWRWJG-UHFFFAOYSA-N	3	2	330.520	2.945	20	70		EFIDLP
O[C@@H](C[NH2+]Cc1cc(Cl)ccc1F)C[N@@H+]1CCc2ccccc2C1	ZINC000159971633	473077532	/nfs/dbraw/zinc/07/75/32/473077532.db2.gz	XSCKARVJAUPZBI-SFHVURJKSA-N	2	2	348.849	2.988	20	70		EFIDLP
O[C@@H](C[NH2+]Cc1cc(Cl)ccc1F)C[N@H+]1CCc2ccccc2C1	ZINC000159971633	473077534	/nfs/dbraw/zinc/07/75/34/473077534.db2.gz	XSCKARVJAUPZBI-SFHVURJKSA-N	2	2	348.849	2.988	20	70		EFIDLP
C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1cncc(F)c1	ZINC000160486076	473130898	/nfs/dbraw/zinc/13/08/98/473130898.db2.gz	PFPBDQNAORBRER-HNNXBMFYSA-N	2	2	329.419	2.904	20	70		EFIDLP
Cc1ccc(Cl)cc1NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161293169	544811383	/nfs/dbraw/zinc/81/13/83/544811383.db2.gz	NELUSHOWBFDDES-UHFFFAOYSA-N	2	2	344.846	2.804	20	70		EFIDLP
C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161332617	544813258	/nfs/dbraw/zinc/81/32/58/544813258.db2.gz	TYNZSSUODDPDPQ-CQSZACIVSA-N	2	2	344.846	2.884	20	70		EFIDLP
CCc1ccc(NC(=O)[C@@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1	ZINC000161397875	544813611	/nfs/dbraw/zinc/81/36/11/544813611.db2.gz	HGWHHNBQOWPVLU-MRXNPFEDSA-N	2	2	338.455	2.793	20	70		EFIDLP
CCc1ccc(NC(=O)[C@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1	ZINC000161398005	544813633	/nfs/dbraw/zinc/81/36/33/544813633.db2.gz	HGWHHNBQOWPVLU-INIZCTEOSA-N	2	2	338.455	2.793	20	70		EFIDLP
CCc1cccc(C)c1NC(=O)C[NH+]1CCN(c2cc[nH+]cc2)CC1	ZINC000161308775	544813755	/nfs/dbraw/zinc/81/37/55/544813755.db2.gz	ORROBKZDLBPQAE-UHFFFAOYSA-N	2	2	338.455	2.713	20	70		EFIDLP
CC(C)c1nc(N(CC[NH+](C)C)Cc2cccs2)nc(N(C)C)[nH+]1	ZINC000160513710	310699988	/nfs/dbraw/zinc/69/99/88/310699988.db2.gz	QUMDHPRNJHJLCH-UHFFFAOYSA-N	2	2	348.520	2.691	20	70		EFIDLP
C[N@@H+]1CCC[C@H]2C[NH+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392075	473231538	/nfs/dbraw/zinc/23/15/38/473231538.db2.gz	YHIWAPXVGPJSDF-VDZJLULYSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[N@H+]1CCC[C@H]2C[NH+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392075	473231543	/nfs/dbraw/zinc/23/15/43/473231543.db2.gz	YHIWAPXVGPJSDF-VDZJLULYSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[NH+]1CCC[C@H]2C[N@@H+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392075	473231548	/nfs/dbraw/zinc/23/15/48/473231548.db2.gz	YHIWAPXVGPJSDF-VDZJLULYSA-N	2	2	345.462	2.737	20	70		EFIDLP
C[NH+]1CCC[C@H]2C[N@H+]([C@@H]3CCCN(c4ccccc4F)C3=O)CC[C@@H]21	ZINC000161392075	473231550	/nfs/dbraw/zinc/23/15/50/473231550.db2.gz	YHIWAPXVGPJSDF-VDZJLULYSA-N	2	2	345.462	2.737	20	70		EFIDLP
CC[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)N1CCN(c2cccc[nH+]2)CC1	ZINC000161420901	473234755	/nfs/dbraw/zinc/23/47/55/473234755.db2.gz	VZGRZSQNHBLHFV-MSOLQXFVSA-N	2	2	344.503	2.679	20	70		EFIDLP
C[NH+]1CCC([NH+]2CCC(NC(=O)C3CCC(C)(C)CC3)CC2)CC1	ZINC000159609901	473044390	/nfs/dbraw/zinc/04/43/90/473044390.db2.gz	MJZXJSQYFIUCCH-UHFFFAOYSA-N	2	2	335.536	2.878	20	70		EFIDLP
Cc1c(C[NH2+]C[C@H](C(C)C)[N@@H+]2CCc3ccccc3C2)cnn1C	ZINC000159758806	473058269	/nfs/dbraw/zinc/05/82/69/473058269.db2.gz	ZPEVKJKLXLCGEL-HXUWFJFHSA-N	2	2	326.488	2.901	20	70		EFIDLP
Cc1c(C[NH2+]C[C@H](C(C)C)[N@H+]2CCc3ccccc3C2)cnn1C	ZINC000159758806	473058271	/nfs/dbraw/zinc/05/82/71/473058271.db2.gz	ZPEVKJKLXLCGEL-HXUWFJFHSA-N	2	2	326.488	2.901	20	70		EFIDLP
CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCOCC2)cn1	ZINC000160422801	473121715	/nfs/dbraw/zinc/12/17/15/473121715.db2.gz	GTTZCBNVTGZLHU-INIZCTEOSA-N	2	2	328.460	2.586	20	70		EFIDLP
C[NH+](C)CCCC1CCN(C(=O)NCCCNc2cccc[nH+]2)CC1	ZINC000160435245	473123774	/nfs/dbraw/zinc/12/37/74/473123774.db2.gz	SWKFRRFVBJWAKU-UHFFFAOYSA-N	2	2	347.507	2.647	20	70		EFIDLP
Cc1nnc(C[N@@H+]2CC[C@@H](CNc3cccc(C)[nH+]3)C2)n1C1CC1	ZINC000160914311	473190284	/nfs/dbraw/zinc/19/02/84/473190284.db2.gz	HRWQXBRTQOOEDZ-HNNXBMFYSA-N	2	2	326.448	2.559	20	70		EFIDLP
Cc1nnc(C[N@H+]2CC[C@@H](CNc3cccc(C)[nH+]3)C2)n1C1CC1	ZINC000160914311	473190287	/nfs/dbraw/zinc/19/02/87/473190287.db2.gz	HRWQXBRTQOOEDZ-HNNXBMFYSA-N	2	2	326.448	2.559	20	70		EFIDLP
CCC[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159826	528240538	/nfs/dbraw/zinc/24/05/38/528240538.db2.gz	PVPSSFPANPIQBU-PVAVHDDUSA-N	2	2	349.544	2.874	20	70		EFIDLP
CCC[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159826	528240544	/nfs/dbraw/zinc/24/05/44/528240544.db2.gz	PVPSSFPANPIQBU-PVAVHDDUSA-N	2	2	349.544	2.874	20	70		EFIDLP
CCC[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159712	529019484	/nfs/dbraw/zinc/01/94/84/529019484.db2.gz	PVPSSFPANPIQBU-DJIMGWMZSA-N	2	2	349.544	2.874	20	70		EFIDLP
CCC[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)C(=O)N1CCc2sccc2C1	ZINC000160159712	529019490	/nfs/dbraw/zinc/01/94/90/529019490.db2.gz	PVPSSFPANPIQBU-DJIMGWMZSA-N	2	2	349.544	2.874	20	70		EFIDLP
C[N@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccc(-c2ccccc2)cc1	ZINC000216666163	545559566	/nfs/dbraw/zinc/55/95/66/545559566.db2.gz	OOCHSEYZISUIIO-UHFFFAOYSA-N	2	2	337.467	2.559	20	70		EFIDLP
C[N@@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccc(-c2ccccc2)cc1	ZINC000216666163	545559572	/nfs/dbraw/zinc/55/95/72/545559572.db2.gz	OOCHSEYZISUIIO-UHFFFAOYSA-N	2	2	337.467	2.559	20	70		EFIDLP
NC(=O)[C@@H]1CCC[N@@H+]1C1CC[NH+](CCCc2ccc(Cl)cc2)CC1	ZINC000159411601	283321023	/nfs/dbraw/zinc/32/10/23/283321023.db2.gz	MPMAOTBLSYCQDI-SFHVURJKSA-N	2	2	349.906	2.687	20	70		EFIDLP
NC(=O)[C@@H]1CCC[N@H+]1C1CC[NH+](CCCc2ccc(Cl)cc2)CC1	ZINC000159411601	283321025	/nfs/dbraw/zinc/32/10/25/283321025.db2.gz	MPMAOTBLSYCQDI-SFHVURJKSA-N	2	2	349.906	2.687	20	70		EFIDLP
O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1[nH]cc[nH+]1	ZINC000160814158	284053790	/nfs/dbraw/zinc/05/37/90/284053790.db2.gz	KSGXSHUYDDNAKK-GDBMZVCRSA-N	2	2	331.464	2.663	20	70		EFIDLP
O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCCC[C@@H]1c1[nH]cc[nH+]1	ZINC000160814158	284053791	/nfs/dbraw/zinc/05/37/91/284053791.db2.gz	KSGXSHUYDDNAKK-GDBMZVCRSA-N	2	2	331.464	2.663	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NCC(C)C	ZINC000160018157	276341795	/nfs/dbraw/zinc/34/17/95/276341795.db2.gz	BCVYISZPBWRKKE-KRWDZBQOSA-N	2	2	346.519	2.781	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NCC(C)C	ZINC000160018157	276341797	/nfs/dbraw/zinc/34/17/97/276341797.db2.gz	BCVYISZPBWRKKE-KRWDZBQOSA-N	2	2	346.519	2.781	20	70		EFIDLP
CC[N@@H+]1CCCC[C@H]1CN[C@@H]1CC[NH+](Cc2ccccn2)C[C@@H]1C	ZINC000161206976	473217465	/nfs/dbraw/zinc/21/74/65/473217465.db2.gz	NVFNEROHNDPSBW-YSIASYRMSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[N@H+]1CCCC[C@H]1CN[C@@H]1CC[NH+](Cc2ccccn2)C[C@@H]1C	ZINC000161206976	473217467	/nfs/dbraw/zinc/21/74/67/473217467.db2.gz	NVFNEROHNDPSBW-YSIASYRMSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[NH+]1CCCC[C@H]1CN[C@@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C	ZINC000161206976	473217468	/nfs/dbraw/zinc/21/74/68/473217468.db2.gz	NVFNEROHNDPSBW-YSIASYRMSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC[NH+]1CCCC[C@H]1CN[C@@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C	ZINC000161206976	473217469	/nfs/dbraw/zinc/21/74/69/473217469.db2.gz	NVFNEROHNDPSBW-YSIASYRMSA-N	2	2	330.520	2.756	20	70		EFIDLP
CC(C)COC(=O)N1CCC[N@H+](CCC[NH+]2CCCCC2)CC1	ZINC000161313165	473225420	/nfs/dbraw/zinc/22/54/20/473225420.db2.gz	AEAVAAQZZCFRSG-UHFFFAOYSA-N	2	2	325.497	2.663	20	70		EFIDLP
CC(C)COC(=O)N1CCC[N@@H+](CCC[NH+]2CCCCC2)CC1	ZINC000161313165	473225423	/nfs/dbraw/zinc/22/54/23/473225423.db2.gz	AEAVAAQZZCFRSG-UHFFFAOYSA-N	2	2	325.497	2.663	20	70		EFIDLP
O=C1OCCN1c1cccc2c1CC[N@H+](CCC[NH+]1CCCCC1)C2	ZINC000161379835	473231310	/nfs/dbraw/zinc/23/13/10/473231310.db2.gz	SNLDFSSHLUNWKI-UHFFFAOYSA-N	2	2	343.471	2.877	20	70		EFIDLP
O=C1OCCN1c1cccc2c1CC[N@@H+](CCC[NH+]1CCCCC1)C2	ZINC000161379835	473231315	/nfs/dbraw/zinc/23/13/15/473231315.db2.gz	SNLDFSSHLUNWKI-UHFFFAOYSA-N	2	2	343.471	2.877	20	70		EFIDLP
C[C@H](c1cccc(Cl)c1)[NH+]1CCC([N@@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159365399	473022117	/nfs/dbraw/zinc/02/21/17/473022117.db2.gz	GKHRIWUQVPEZQL-CXAGYDPISA-N	2	2	335.879	2.815	20	70		EFIDLP
C[C@H](c1cccc(Cl)c1)[NH+]1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1	ZINC000159365399	473022119	/nfs/dbraw/zinc/02/21/19/473022119.db2.gz	GKHRIWUQVPEZQL-CXAGYDPISA-N	2	2	335.879	2.815	20	70		EFIDLP
O[C@@H](C[NH2+]Cc1ccc(F)c(Cl)c1)C[N@@H+]1CCc2ccccc2C1	ZINC000159951772	473075575	/nfs/dbraw/zinc/07/55/75/473075575.db2.gz	DFGXLCYMNVJGOA-KRWDZBQOSA-N	2	2	348.849	2.988	20	70		EFIDLP
O[C@@H](C[NH2+]Cc1ccc(F)c(Cl)c1)C[N@H+]1CCc2ccccc2C1	ZINC000159951772	473075584	/nfs/dbraw/zinc/07/55/84/473075584.db2.gz	DFGXLCYMNVJGOA-KRWDZBQOSA-N	2	2	348.849	2.988	20	70		EFIDLP
C[C@H](C[NH2+]C1CCN(CC(F)F)CC1)[N@H+](C)Cc1ccccc1	ZINC000160867299	473185176	/nfs/dbraw/zinc/18/51/76/473185176.db2.gz	QLXJSKDLRCSTLS-OAHLLOKOSA-N	2	2	325.447	2.826	20	70		EFIDLP
C[C@H](C[NH2+]C1CCN(CC(F)F)CC1)[N@@H+](C)Cc1ccccc1	ZINC000160867299	473185184	/nfs/dbraw/zinc/18/51/84/473185184.db2.gz	QLXJSKDLRCSTLS-OAHLLOKOSA-N	2	2	325.447	2.826	20	70		EFIDLP
O=C(c1ccc(Cn2cc[nH+]c2)cc1)N1CCC([NH2+]CC2CC2)CC1	ZINC000159871255	534703992	/nfs/dbraw/zinc/70/39/92/534703992.db2.gz	LGBDWQQKHZNZEJ-UHFFFAOYSA-N	2	2	338.455	2.536	20	70		EFIDLP
CCN(CC)C(=O)[C@@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160069244	528048623	/nfs/dbraw/zinc/04/86/23/528048623.db2.gz	ATOAYDZUFRMTAL-QGZVFWFLSA-N	2	2	346.519	2.877	20	70		EFIDLP
CCN(CC)C(=O)[C@@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160069244	528048626	/nfs/dbraw/zinc/04/86/26/528048626.db2.gz	ATOAYDZUFRMTAL-QGZVFWFLSA-N	2	2	346.519	2.877	20	70		EFIDLP
CC[NH2+]CC1CCN(C(=O)/C=C/c2ccc(-n3cc[nH+]c3)cc2)CC1	ZINC000161060817	528276624	/nfs/dbraw/zinc/27/66/24/528276624.db2.gz	BCRLXWJIYVZQDV-VMPITWQZSA-N	2	2	338.455	2.734	20	70		EFIDLP
CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H]1CCN(C(C)C)C1=O	ZINC000160024928	528348157	/nfs/dbraw/zinc/34/81/57/528348157.db2.gz	RJNYDYFIJXBJTB-SFHVURJKSA-N	2	2	344.503	2.629	20	70		EFIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H]1CCN(C(C)C)C1=O	ZINC000160024928	528348162	/nfs/dbraw/zinc/34/81/62/528348162.db2.gz	RJNYDYFIJXBJTB-SFHVURJKSA-N	2	2	344.503	2.629	20	70		EFIDLP
CCCCNC(=O)[C@H](C)[N@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160032813	528536882	/nfs/dbraw/zinc/53/68/82/528536882.db2.gz	ZVXHIDCXQLFBRM-KRWDZBQOSA-N	2	2	346.519	2.925	20	70		EFIDLP
CCCCNC(=O)[C@H](C)[N@@H+](CC)CC1CCN(c2cccc[nH+]2)CC1	ZINC000160032813	528536887	/nfs/dbraw/zinc/53/68/87/528536887.db2.gz	ZVXHIDCXQLFBRM-KRWDZBQOSA-N	2	2	346.519	2.925	20	70		EFIDLP