smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)NC2CCCCC2)no1)Cc1ccccc1	ZINC000008623785	291367870	/nfs/dbraw/zinc/36/78/70/291367870.db2.gz	WDMOBNHDQGQOLM-VXKWHMMOSA-N	2	1	438.616	3.914	40	0	biogenic,in-vitro	IHABMP
C[N@@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)NC2CCCCC2)no1)Cc1ccccc1	ZINC000008623785	291367871	/nfs/dbraw/zinc/36/78/71/291367871.db2.gz	WDMOBNHDQGQOLM-VXKWHMMOSA-N	2	1	438.616	3.914	40	0	biogenic,in-vitro	IHABMP
O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)[C@@H]1CCC[N@@H+](Cc2ccccc2Cl)C1	ZINC000038830739	556621793	/nfs/dbraw/zinc/62/17/93/556621793.db2.gz	IVGZEJHKQXDHTA-HSZRJFAPSA-N	2	1	442.003	3.701	40	0		IHABMP
O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2Cl)C1	ZINC000038830739	556621794	/nfs/dbraw/zinc/62/17/94/556621794.db2.gz	IVGZEJHKQXDHTA-HSZRJFAPSA-N	2	1	442.003	3.701	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019454000	556764331	/nfs/dbraw/zinc/76/43/31/556764331.db2.gz	WWMAELAHMBLDAN-REWPJTCUSA-N	2	1	439.579	3.910	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019454000	556764335	/nfs/dbraw/zinc/76/43/35/556764335.db2.gz	WWMAELAHMBLDAN-REWPJTCUSA-N	2	1	439.579	3.910	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@@H]2c2cccc(C[NH2+]C3CCCC3)c2)cc1	ZINC000585262565	557202252	/nfs/dbraw/zinc/20/22/52/557202252.db2.gz	SYYHQKQUDAAKHR-FTJBHMTQSA-N	2	1	435.612	3.732	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@@H]2c2cccc(C[NH2+]C3CCCC3)c2)cc1	ZINC000585262563	557202265	/nfs/dbraw/zinc/20/22/65/557202265.db2.gz	SYYHQKQUDAAKHR-CLJLJLNGSA-N	2	1	435.612	3.732	40	0		IHABMP
CCOc1ccccc1OC[C@H](O)C[N@@H+](C)Cc1cccc(OCC[NH+]2CCCCC2)c1	ZINC000585270641	568617195	/nfs/dbraw/zinc/61/71/95/568617195.db2.gz	AKURVLJRGGRXEI-HSZRJFAPSA-N	2	1	442.600	3.822	40	0		IHABMP
CC(=O)N1CCC([NH2+][C@H]2C[C@@H](Cc3cc(C[N@@H+](C)Cc4ccccc4)on3)C2(C)C)CC1	ZINC000067890278	291364346	/nfs/dbraw/zinc/36/43/46/291364346.db2.gz	SGGYZGOYVYYOHZ-BWKNWUBXSA-N	2	1	438.616	3.864	40	0	biogenic,in-vitro	IHABMP
CC(=O)N1CCC([NH2+][C@H]2C[C@@H](Cc3cc(C[N@H+](C)Cc4ccccc4)on3)C2(C)C)CC1	ZINC000067890278	291364347	/nfs/dbraw/zinc/36/43/47/291364347.db2.gz	SGGYZGOYVYYOHZ-BWKNWUBXSA-N	2	1	438.616	3.864	40	0	biogenic,in-vitro	IHABMP
C[N@H+](Cc1cc(C[C@@H]2CC[C@H](O)[C@@H](C[NH2+]Cc3ccccc3)O2)no1)Cc1ccccc1	ZINC000096296029	291367850	/nfs/dbraw/zinc/36/78/50/291367850.db2.gz	HTKCHFUIANIGNL-AYRHNUGRSA-N	2	1	435.568	3.547	40	0	biogenic,in-vitro	IHABMP
C[N@@H+](Cc1cc(C[C@@H]2CC[C@H](O)[C@@H](C[NH2+]Cc3ccccc3)O2)no1)Cc1ccccc1	ZINC000096296029	291367851	/nfs/dbraw/zinc/36/78/51/291367851.db2.gz	HTKCHFUIANIGNL-AYRHNUGRSA-N	2	1	435.568	3.547	40	0	biogenic,in-vitro	IHABMP
C[NH+]1CCN(c2ccc(NC(=O)[C@H]3CCC[N@@H+](Cc4ccccc4Cl)C3)cc2)CC1	ZINC000096627169	557203677	/nfs/dbraw/zinc/20/36/77/557203677.db2.gz	FGPGKODDQSKTEO-FQEVSTJZSA-N	2	1	426.992	3.943	40	0		IHABMP
Cc1[nH+]ccn1CCOc1cccc(C[NH+]2CCC(O)(COc3ccc(F)cc3)CC2)c1	ZINC000585270919	568617834	/nfs/dbraw/zinc/61/78/34/568617834.db2.gz	DOTNOILIBWOZJV-UHFFFAOYSA-N	2	1	439.531	3.816	40	0		IHABMP
Cc1cc(OC[C@@]2(CC(=O)N3CC[NH+](C)CC3)CCC[N@H+](CC3CC3)C2)ccc1Cl	ZINC000257343428	568729925	/nfs/dbraw/zinc/72/99/25/568729925.db2.gz	ZSZPFOPVFMEFHK-XMMPIXPASA-N	2	1	434.024	3.684	40	0		IHABMP
Cc1cc(OC[C@@]2(CC(=O)N3CC[NH+](C)CC3)CCC[N@@H+](CC3CC3)C2)ccc1Cl	ZINC000257343428	568729926	/nfs/dbraw/zinc/72/99/26/568729926.db2.gz	ZSZPFOPVFMEFHK-XMMPIXPASA-N	2	1	434.024	3.684	40	0		IHABMP
CN(Cc1ccccc1)C(=O)[C@@H]1C[N@@H+](C)CC2(CC[NH+](Cc3cccc(Cl)c3)CC2)O1	ZINC000306123088	568762570	/nfs/dbraw/zinc/76/25/70/568762570.db2.gz	AEEXCRTZDNHSEV-QHCPKHFHSA-N	2	1	442.003	3.664	40	0		IHABMP
CN(Cc1ccccc1)C(=O)[C@H]1C[N@@H+](C)CC2(CC[NH+](Cc3ccc(Cl)cc3)CC2)O1	ZINC000306126539	568764244	/nfs/dbraw/zinc/76/42/44/568764244.db2.gz	DYTIVWMIHYDEMQ-HSZRJFAPSA-N	2	1	442.003	3.664	40	0		IHABMP
CN(Cc1ccccc1)C(=O)[C@@H]1C[N@@H+](C)CC2(CC[NH+](Cc3ccc(Cl)cc3)CC2)O1	ZINC000306126540	568764228	/nfs/dbraw/zinc/76/42/28/568764228.db2.gz	DYTIVWMIHYDEMQ-QHCPKHFHSA-N	2	1	442.003	3.664	40	0		IHABMP
O=c1c2c(nc3n1CC1(C3)CC[NH+](Cc3cccs3)CC1)CC[N@H+](Cc1ccccc1)C2	ZINC000306139744	568771320	/nfs/dbraw/zinc/77/13/20/568771320.db2.gz	TZARINPOEQHSKP-UHFFFAOYSA-N	2	1	446.620	3.702	40	0		IHABMP
C[NH+]1CCC([NH2+][C@H]2CC(C)(C)[C@@H]3C[C@@](C)(O)CC[C@]23CCC(=O)NCc2ccco2)CC1	ZINC000020464660	523777289	/nfs/dbraw/zinc/77/72/89/523777289.db2.gz	SKLPTHIGWZWAHN-JPMIEVGJSA-N	2	1	445.648	3.696	40	0	biogenic,in-vitro	IHABMP
COc1cc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)ccc1O	ZINC000019587655	556823697	/nfs/dbraw/zinc/82/36/97/556823697.db2.gz	GXDZFAJUVFBSHZ-DENIHFKCSA-N	2	1	441.547	3.711	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[N@@H+]2C[C@H](O)[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000585268829	557210247	/nfs/dbraw/zinc/21/02/47/557210247.db2.gz	NNFHDFIPUIHFDN-GOTSBHOMSA-N	2	1	427.932	3.548	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[N@H+]2C[C@H](O)[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000585268829	557210251	/nfs/dbraw/zinc/21/02/51/557210251.db2.gz	NNFHDFIPUIHFDN-GOTSBHOMSA-N	2	1	427.932	3.548	40	0		IHABMP
CC[NH+]1CCC(CC(=O)N2CCO[C@@H](c3cc(Nc4cccc(C)n4)cc(C)[nH+]3)C2)CC1	ZINC000257233184	568680726	/nfs/dbraw/zinc/68/07/26/568680726.db2.gz	GOESMZPBBOPXGB-HSZRJFAPSA-N	2	1	437.588	3.859	40	0		IHABMP
COc1cc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)ccc1O	ZINC000019587657	569227153	/nfs/dbraw/zinc/22/71/53/569227153.db2.gz	GXDZFAJUVFBSHZ-UGKGYDQZSA-N	2	1	441.547	3.711	40	0		IHABMP
Cc1cc(Nc2cnccn2)cc([C@@H]2CCCN(C(=O)C[N@@H+]3CCc4ccccc4C3)C2)[nH+]1	ZINC000072374935	556949422	/nfs/dbraw/zinc/94/94/22/556949422.db2.gz	ZIFDFBOBAOCCHS-JOCHJYFZSA-N	2	1	442.567	3.688	40	0		IHABMP
Cc1cc(Nc2cnccn2)cc([C@@H]2CCCN(C(=O)C[N@H+]3CCc4ccccc4C3)C2)[nH+]1	ZINC000072374935	556949424	/nfs/dbraw/zinc/94/94/24/556949424.db2.gz	ZIFDFBOBAOCCHS-JOCHJYFZSA-N	2	1	442.567	3.688	40	0		IHABMP
COc1ccc(C[NH+]2CCC3(C[C@@H](CC(=O)N4CC[NH+](C)CC4)c4ccccc43)CC2)cc1	ZINC000096052939	557166494	/nfs/dbraw/zinc/16/64/94/557166494.db2.gz	DNRREPBVDHTBMY-HSZRJFAPSA-N	2	1	447.623	3.880	40	0		IHABMP
COc1ccc([C@H]2C[N@H+](Cc3ccccc3OCC[NH+]3CCCC3)CCN2C(C)=O)cc1	ZINC000585261969	557198040	/nfs/dbraw/zinc/19/80/40/557198040.db2.gz	XAUJWOFZBRXQRK-RUZDIDTESA-N	2	1	437.584	3.575	40	0		IHABMP
COc1ccc([C@H]2C[N@@H+](Cc3ccccc3OCC[NH+]3CCCC3)CCN2C(C)=O)cc1	ZINC000585261969	557198041	/nfs/dbraw/zinc/19/80/41/557198041.db2.gz	XAUJWOFZBRXQRK-RUZDIDTESA-N	2	1	437.584	3.575	40	0		IHABMP
COc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130547	569207213	/nfs/dbraw/zinc/20/72/13/569207213.db2.gz	NCDNKBWKCYFGNK-HFMPRLQTSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[N@H+]2CCC[C@H]([C@@H]3C[C@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130547	569207214	/nfs/dbraw/zinc/20/72/14/569207214.db2.gz	NCDNKBWKCYFGNK-HFMPRLQTSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@@H]3C[C@H](C(=O)Nc4ccccc4OC)C[N@@H+]3C)C2)c1	ZINC000248130547	569207215	/nfs/dbraw/zinc/20/72/15/569207215.db2.gz	NCDNKBWKCYFGNK-HFMPRLQTSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@@H]3C[C@H](C(=O)Nc4ccccc4OC)C[N@H+]3C)C2)c1	ZINC000248130547	569207216	/nfs/dbraw/zinc/20/72/16/569207216.db2.gz	NCDNKBWKCYFGNK-HFMPRLQTSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(NC(=O)[C@H]2C[C@H](C3CC[NH+](Cc4cccc(OC)c4)CC3)[N@@H+](C)C2)cc1	ZINC000019587705	556823904	/nfs/dbraw/zinc/82/39/04/556823904.db2.gz	FUEYDAISFXSBBV-SQJMNOBHSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(NC(=O)[C@@H]2C[C@H](C3CC[NH+](Cc4ccccc4OC)CC3)[N@@H+](C)C2)cc1	ZINC000019587711	556824127	/nfs/dbraw/zinc/82/41/27/556824127.db2.gz	CGGRSJSDHFWMTR-ZJSXRUAMSA-N	2	1	437.584	3.875	40	0		IHABMP
Cc1[nH+]ccn1CCOc1cccc(C[NH+]2CCC(O)(COc3ccc(C)cc3)CC2)c1	ZINC000585274236	557218313	/nfs/dbraw/zinc/21/83/13/557218313.db2.gz	XUQUQUSQQNFZLW-UHFFFAOYSA-N	2	1	435.568	3.985	40	0		IHABMP
c1cc2c(C[C@H]3COCC[N@H+](Cc4ccccc4OCC[NH+]4CCCC4)C3)nccn2c1	ZINC000257256227	568691596	/nfs/dbraw/zinc/69/15/96/568691596.db2.gz	KKNRHPSMESEIHN-JOCHJYFZSA-N	2	1	434.584	3.500	40	0		IHABMP
COc1cc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)ccc1O	ZINC000019587652	569227223	/nfs/dbraw/zinc/22/72/23/569227223.db2.gz	GXDZFAJUVFBSHZ-KNQAVFIVSA-N	2	1	441.547	3.711	40	0		IHABMP
C[NH+]1CCN(c2ccc(-c3noc([C@@H]4CCC[N@@H+]4CCCc4ccccc4)n3)cn2)CC1	ZINC000049155119	291368339	/nfs/dbraw/zinc/36/83/39/291368339.db2.gz	KZWLLKLUNUUFAO-QFIPXVFZSA-N	2	1	432.572	3.653	40	0	biogenic,in-vitro	IHABMP
C[NH+]1CCN(c2ccc(-c3noc([C@@H]4CCC[N@H+]4CCCc4ccccc4)n3)cn2)CC1	ZINC000049155119	291368340	/nfs/dbraw/zinc/36/83/40/291368340.db2.gz	KZWLLKLUNUUFAO-QFIPXVFZSA-N	2	1	432.572	3.653	40	0	biogenic,in-vitro	IHABMP
COc1cc(C[N@@H+](C)C[C@@H](O)Cn2c(C)c(C)c3ccccc32)ccc1OCC[NH+](C)C	ZINC000585270844	557150731	/nfs/dbraw/zinc/15/07/31/557150731.db2.gz	BVEOJHOEHPYWJD-JOCHJYFZSA-N	2	1	439.600	3.700	40	0		IHABMP
CC[NH+](CC)CCNc1nc(-c2ccncc2)nc2c1CC[N@H+](Cc1ccc(OC)cc1)C2	ZINC000057743639	557258210	/nfs/dbraw/zinc/25/82/10/557258210.db2.gz	OJBFGAGWGKSYMQ-UHFFFAOYSA-N	2	1	446.599	3.859	40	0		IHABMP
CC[NH+](CC)CCNc1nc(-c2ccncc2)nc2c1CC[N@@H+](Cc1ccc(OC)cc1)C2	ZINC000057743639	557258213	/nfs/dbraw/zinc/25/82/13/557258213.db2.gz	OJBFGAGWGKSYMQ-UHFFFAOYSA-N	2	1	446.599	3.859	40	0		IHABMP
Cc1cc(C)cc(C[NH+]2CCC3(CC2)C[N@H+](C)C[C@@H](C(=O)N(C)Cc2ccccc2)O3)c1	ZINC000306137907	568770249	/nfs/dbraw/zinc/77/02/49/568770249.db2.gz	RJUUSEQRGUUJCT-VWLOTQADSA-N	2	1	435.612	3.627	40	0		IHABMP
COc1ccc(NC(=O)[C@H]2C[C@@H](C3CC[NH+](Cc4cccc(OC)c4)CC3)[N@@H+](C)C2)cc1	ZINC000019587700	569227202	/nfs/dbraw/zinc/22/72/02/569227202.db2.gz	FUEYDAISFXSBBV-OFVILXPXSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(NC(=O)[C@@H]2C[C@@H](C3CC[NH+](Cc4cccc(OC)c4)CC3)[N@@H+](C)C2)cc1	ZINC000019587698	569227337	/nfs/dbraw/zinc/22/73/37/569227337.db2.gz	FUEYDAISFXSBBV-BWKNWUBXSA-N	2	1	437.584	3.875	40	0		IHABMP
C[N@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)NCc2ccccc2)no1)Cc1ccccc1	ZINC000012482046	523171679	/nfs/dbraw/zinc/17/16/79/523171679.db2.gz	YLBCCTGZAUWTCI-ZEQRLZLVSA-N	2	1	446.595	3.781	40	0	biogenic,in-vitro	IHABMP
C[N@@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)NCc2ccccc2)no1)Cc1ccccc1	ZINC000012482046	523171691	/nfs/dbraw/zinc/17/16/91/523171691.db2.gz	YLBCCTGZAUWTCI-ZEQRLZLVSA-N	2	1	446.595	3.781	40	0	biogenic,in-vitro	IHABMP
CNc1nc([C@@H]2CCCCN2C(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)nc2c1CC[N@H+](C)C2	ZINC000019708670	556869775	/nfs/dbraw/zinc/86/97/75/556869775.db2.gz	VIEGKRPHYOQAMZ-FQEVSTJZSA-N	2	1	442.652	3.507	40	0		IHABMP
CNc1nc([C@@H]2CCCCN2C(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)nc2c1CC[N@@H+](C)C2	ZINC000019708670	556869777	/nfs/dbraw/zinc/86/97/77/556869777.db2.gz	VIEGKRPHYOQAMZ-FQEVSTJZSA-N	2	1	442.652	3.507	40	0		IHABMP
Cc1ccc(Cl)c(OC[C@@]2(O)CCC[N@H+](Cc3ccc(OCC[NH+](C)C)cc3)C2)c1	ZINC000585272713	557217174	/nfs/dbraw/zinc/21/71/74/557217174.db2.gz	OBUYGUODFBZEJH-XMMPIXPASA-N	2	1	432.992	3.995	40	0		IHABMP
COc1cccc(C[NH+]2CCC3(CC2)C[N@H+](C)C[C@H](C(=O)Nc2cccc(Cl)c2)O3)c1	ZINC000306139107	568771006	/nfs/dbraw/zinc/77/10/06/568771006.db2.gz	SPSVFGPMBVZJLI-JOCHJYFZSA-N	2	1	443.975	3.653	40	0		IHABMP
COc1cccc(C[NH+]2CCC3(CC2)C[N@@H+](C)C[C@H](C(=O)Nc2cccc(Cl)c2)O3)c1	ZINC000306139107	568771009	/nfs/dbraw/zinc/77/10/09/568771009.db2.gz	SPSVFGPMBVZJLI-JOCHJYFZSA-N	2	1	443.975	3.653	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@@H]2c2cccc(C[NH+]3CCCCC3)c2)cc1	ZINC000257272553	556713879	/nfs/dbraw/zinc/71/38/79/556713879.db2.gz	NCVVLVPLSQZEEH-FTJBHMTQSA-N	2	1	435.612	3.685	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@@H]2c2ccc(C[NH2+]C3CCCC3)cc2)cc1	ZINC000585169186	557132433	/nfs/dbraw/zinc/13/24/33/557132433.db2.gz	CZRLDURDFZEVIG-FTJBHMTQSA-N	2	1	435.612	3.732	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@@H](O)COc2ccccc2)ccc1OCC[NH+]1CCC(C)CC1	ZINC000585270651	568617125	/nfs/dbraw/zinc/61/71/25/568617125.db2.gz	ALCNRXPWHDABGC-HSZRJFAPSA-N	2	1	442.600	3.678	40	0		IHABMP
COc1cccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130542	569207182	/nfs/dbraw/zinc/20/71/82/569207182.db2.gz	NCDNKBWKCYFGNK-AWRGLXIESA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[N@H+]2CCC[C@H]([C@H]3C[C@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130542	569207183	/nfs/dbraw/zinc/20/71/83/569207183.db2.gz	NCDNKBWKCYFGNK-AWRGLXIESA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@H]3C[C@H](C(=O)Nc4ccccc4OC)C[N@@H+]3C)C2)c1	ZINC000248130542	569207184	/nfs/dbraw/zinc/20/71/84/569207184.db2.gz	NCDNKBWKCYFGNK-AWRGLXIESA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@H]3C[C@H](C(=O)Nc4ccccc4OC)C[N@H+]3C)C2)c1	ZINC000248130542	569207185	/nfs/dbraw/zinc/20/71/85/569207185.db2.gz	NCDNKBWKCYFGNK-AWRGLXIESA-N	2	1	437.584	3.875	40	0		IHABMP
C[C@@H]1CCC[C@H](C)[N@@H+]1C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1	ZINC000011582541	569302592	/nfs/dbraw/zinc/30/25/92/569302592.db2.gz	ODYINPFMZIJYIN-FMWSTDPOSA-N	2	1	448.648	3.692	40	0		IHABMP
CCn1ncc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)c1C	ZINC000019523931	556781342	/nfs/dbraw/zinc/78/13/42/556781342.db2.gz	WASZKEBCFSFDHY-AUSIDOKSSA-N	2	1	427.568	3.522	40	0		IHABMP
CNc1nc([C@H]2CCCCN2C(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)nc2c1CC[N@H+](C)C2	ZINC000019708671	556869789	/nfs/dbraw/zinc/86/97/89/556869789.db2.gz	VIEGKRPHYOQAMZ-HXUWFJFHSA-N	2	1	442.652	3.507	40	0		IHABMP
CNc1nc([C@H]2CCCCN2C(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)nc2c1CC[N@@H+](C)C2	ZINC000019708671	556869792	/nfs/dbraw/zinc/86/97/92/556869792.db2.gz	VIEGKRPHYOQAMZ-HXUWFJFHSA-N	2	1	442.652	3.507	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[NH+]2CCC(O)(COc3ccc(F)cc3)CC2)cc1	ZINC000585272101	557216780	/nfs/dbraw/zinc/21/67/80/557216780.db2.gz	FPBQTLOCZJBLGP-UHFFFAOYSA-N	2	1	439.531	3.816	40	0		IHABMP
CCc1[nH+]ccn1CCOc1cccc(C[N@@H+]2CCC[C@@](O)(COc3ccccc3)C2)c1	ZINC000585272029	557216790	/nfs/dbraw/zinc/21/67/90/557216790.db2.gz	DYYBUVZNMMFOSN-SANMLTNESA-N	2	1	435.568	3.930	40	0		IHABMP
CCc1[nH+]ccn1CCOc1cccc(C[N@H+]2CCC[C@@](O)(COc3ccccc3)C2)c1	ZINC000585272029	557216791	/nfs/dbraw/zinc/21/67/91/557216791.db2.gz	DYYBUVZNMMFOSN-SANMLTNESA-N	2	1	435.568	3.930	40	0		IHABMP
O=C(NCCC[NH+]1CCOCC1)c1ccc(C[NH+]2CCC(Cc3ccccc3)CC2)cc1	ZINC000219961822	557272724	/nfs/dbraw/zinc/27/27/24/557272724.db2.gz	UZYQCXDUZPWZHJ-UHFFFAOYSA-N	2	1	435.612	3.593	40	0		IHABMP
COc1ccc(NC(=O)CN2CCC(c3cc(Nc4ncccn4)cc(C)n3)CC2)cc1	ZINC000257262339	568694106	/nfs/dbraw/zinc/69/41/06/568694106.db2.gz	LLAHQVJOMUHLBD-UHFFFAOYSA-N	2	1	432.528	3.750	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@H]2c2cccc(C[NH+]3CCCCC3)c2)cc1	ZINC000257272555	556713718	/nfs/dbraw/zinc/71/37/18/556713718.db2.gz	NCVVLVPLSQZEEH-UIOOFZCWSA-N	2	1	435.612	3.685	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019525736	556783535	/nfs/dbraw/zinc/78/35/35/556783535.db2.gz	HNRAOESWOAWKRT-REWPJTCUSA-N	2	1	439.579	3.739	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019525736	556783538	/nfs/dbraw/zinc/78/35/38/556783538.db2.gz	HNRAOESWOAWKRT-REWPJTCUSA-N	2	1	439.579	3.739	40	0		IHABMP
C[NH+]1CCN(c2ncc(-c3ccncc3)c([C@H]3CCC[N@H+](Cc4ccc(F)cc4)C3)n2)CC1	ZINC000019590124	556824948	/nfs/dbraw/zinc/82/49/48/556824948.db2.gz	DEEMJQCZSHRIGI-QFIPXVFZSA-N	2	1	446.574	3.809	40	0		IHABMP
C[NH+]1CCN(c2ncc(-c3ccncc3)c([C@H]3CCC[N@@H+](Cc4ccc(F)cc4)C3)n2)CC1	ZINC000019590124	556824953	/nfs/dbraw/zinc/82/49/53/556824953.db2.gz	DEEMJQCZSHRIGI-QFIPXVFZSA-N	2	1	446.574	3.809	40	0		IHABMP
Cc1ccccc1C[NH2+]C[C@H]1O[C@H](Cc2cc(C[N@@H+](C)Cc3ccccc3)on2)CC[C@@H]1O	ZINC000096268991	560054269	/nfs/dbraw/zinc/05/42/69/560054269.db2.gz	UNXCHGXKTZMTEC-DOEKTCAHSA-N	2	1	449.595	3.856	40	0	biogenic,in-vitro	IHABMP
Cc1ccccc1C[NH2+]C[C@H]1O[C@H](Cc2cc(C[N@H+](C)Cc3ccccc3)on2)CC[C@@H]1O	ZINC000096268991	560054270	/nfs/dbraw/zinc/05/42/70/560054270.db2.gz	UNXCHGXKTZMTEC-DOEKTCAHSA-N	2	1	449.595	3.856	40	0	biogenic,in-vitro	IHABMP
Cc1ccc(C[NH2+]C[C@H]2O[C@H](Cc3cc(C[N@@H+](C)Cc4ccccc4)on3)CC[C@@H]2O)cc1	ZINC000096268992	560054281	/nfs/dbraw/zinc/05/42/81/560054281.db2.gz	FMIHEGIKJSDLIF-DOEKTCAHSA-N	2	1	449.595	3.856	40	0	biogenic,in-vitro	IHABMP
Cc1ccc(C[NH2+]C[C@H]2O[C@H](Cc3cc(C[N@H+](C)Cc4ccccc4)on3)CC[C@@H]2O)cc1	ZINC000096268992	560054282	/nfs/dbraw/zinc/05/42/82/560054282.db2.gz	FMIHEGIKJSDLIF-DOEKTCAHSA-N	2	1	449.595	3.856	40	0	biogenic,in-vitro	IHABMP
O[C@]1(COc2ccccc2F)CCC[N@@H+](Cc2cccc(OCCn3ccnc3)c2)CC1	ZINC000585272827	568618151	/nfs/dbraw/zinc/61/81/51/568618151.db2.gz	OWIWONQJOZOAKE-RUZDIDTESA-N	2	1	439.531	3.897	40	0		IHABMP
COc1cccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130549	569207118	/nfs/dbraw/zinc/20/71/18/569207118.db2.gz	NCDNKBWKCYFGNK-YZUZCNPQSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[N@H+]2CCC[C@H]([C@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000248130549	569207120	/nfs/dbraw/zinc/20/71/20/569207120.db2.gz	NCDNKBWKCYFGNK-YZUZCNPQSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[N@@H+]3C)C2)c1	ZINC000248130549	569207122	/nfs/dbraw/zinc/20/71/22/569207122.db2.gz	NCDNKBWKCYFGNK-YZUZCNPQSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[N@H+]3C)C2)c1	ZINC000248130549	569207123	/nfs/dbraw/zinc/20/71/23/569207123.db2.gz	NCDNKBWKCYFGNK-YZUZCNPQSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(OC)cc4)C[N@H+]3C)CC2)cc1	ZINC000019587673	569227241	/nfs/dbraw/zinc/22/72/41/569227241.db2.gz	LPNRMLKFLUZTBF-OFVILXPXSA-N	2	1	437.584	3.875	40	0		IHABMP
C[N@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)Nc2nccs2)no1)Cc1ccccc1	ZINC000012482038	523171921	/nfs/dbraw/zinc/17/19/21/523171921.db2.gz	UCRRMFAAQQXDGH-OALUTQOASA-N	2	1	439.585	3.560	40	0	biogenic,in-vitro	IHABMP
C[N@@H+](Cc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)Nc2nccs2)no1)Cc1ccccc1	ZINC000012482038	523171929	/nfs/dbraw/zinc/17/19/29/523171929.db2.gz	UCRRMFAAQQXDGH-OALUTQOASA-N	2	1	439.585	3.560	40	0	biogenic,in-vitro	IHABMP
CCCc1ncc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019525734	556783607	/nfs/dbraw/zinc/78/36/07/556783607.db2.gz	HNRAOESWOAWKRT-OFNKIYASSA-N	2	1	439.579	3.739	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019525734	556783610	/nfs/dbraw/zinc/78/36/10/556783610.db2.gz	HNRAOESWOAWKRT-OFNKIYASSA-N	2	1	439.579	3.739	40	0		IHABMP
CC[NH+]1CCC(CC(=O)N2CCO[C@H](c3cc(Nc4cccc(C)n4)cc(C)[nH+]3)C2)CC1	ZINC000257233185	568680807	/nfs/dbraw/zinc/68/08/07/568680807.db2.gz	GOESMZPBBOPXGB-QHCPKHFHSA-N	2	1	437.588	3.859	40	0		IHABMP
Cc1[nH+]ccn1-c1cccc([C@@H]2CCCN2C(=O)COc2ccc(C[NH+]3CCCC3)cc2)n1	ZINC000257249123	568688150	/nfs/dbraw/zinc/68/81/50/568688150.db2.gz	JGXAEOZRKXBTBA-DEOSSOPVSA-N	2	1	445.567	3.914	40	0		IHABMP
Cc1cc(OC[C@]2(CC(=O)N3CC[NH+](C)CC3)CCC[N@H+](CC3CC3)C2)ccc1Cl	ZINC000257343427	568729881	/nfs/dbraw/zinc/72/98/81/568729881.db2.gz	ZSZPFOPVFMEFHK-DEOSSOPVSA-N	2	1	434.024	3.684	40	0		IHABMP
Cc1cc(OC[C@]2(CC(=O)N3CC[NH+](C)CC3)CCC[N@@H+](CC3CC3)C2)ccc1Cl	ZINC000257343427	568729882	/nfs/dbraw/zinc/72/98/82/568729882.db2.gz	ZSZPFOPVFMEFHK-DEOSSOPVSA-N	2	1	434.024	3.684	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@@H]2c2cccc(C[NH+]3CCCCC3)c2)cc1	ZINC000257272552	556713886	/nfs/dbraw/zinc/71/38/86/556713886.db2.gz	NCVVLVPLSQZEEH-CLJLJLNGSA-N	2	1	435.612	3.685	40	0		IHABMP
CCN1CC[C@@]2(C[N@@H+](Cc3cccnc3)CC23CC[NH+](Cc2ccc(C)s2)CC3)C1=O	ZINC000096036467	557163394	/nfs/dbraw/zinc/16/33/94/557163394.db2.gz	OLWNDFHGHPIQEE-RUZDIDTESA-N	2	1	438.641	3.788	40	0		IHABMP
CCc1[nH+]ccn1CCOc1cccc(C[N@@H+]2CCC[C@](O)(COc3ccccc3)C2)c1	ZINC000585272026	557216746	/nfs/dbraw/zinc/21/67/46/557216746.db2.gz	DYYBUVZNMMFOSN-AREMUKBSSA-N	2	1	435.568	3.930	40	0		IHABMP
CCc1[nH+]ccn1CCOc1cccc(C[N@H+]2CCC[C@](O)(COc3ccccc3)C2)c1	ZINC000585272026	557216747	/nfs/dbraw/zinc/21/67/47/557216747.db2.gz	DYYBUVZNMMFOSN-AREMUKBSSA-N	2	1	435.568	3.930	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@H](O)COc2ccc(C)cc2C)ccc1OCCC[NH+](C)C	ZINC000585270738	568617252	/nfs/dbraw/zinc/61/72/52/568617252.db2.gz	APBKOJBRONAOSM-QFIPXVFZSA-N	2	1	430.589	3.514	40	0		IHABMP
CC[N@@H+](CC(=O)Nc1c(C)n[nH]c1C)[C@@H]1CCOC2(CC[NH+](Cc3ccccc3)CC2)C1	ZINC000257234606	568681383	/nfs/dbraw/zinc/68/13/83/568681383.db2.gz	GUIHMCZCRRALQT-JOCHJYFZSA-N	2	1	439.604	3.501	40	0		IHABMP
CC[N@@H+](CC(=O)Nc1c(C)n[nH]c1C)[C@H]1CCOC2(CC[NH+](Cc3ccccc3)CC2)C1	ZINC000257234607	568681389	/nfs/dbraw/zinc/68/13/89/568681389.db2.gz	GUIHMCZCRRALQT-QFIPXVFZSA-N	2	1	439.604	3.501	40	0		IHABMP
CN(C)c1nc2c(c(N3CCC([NH+]4CCCCC4)CC3)n1)CC[N@H+](Cc1ccccc1)C2	ZINC000012142765	522334345	/nfs/dbraw/zinc/33/43/45/522334345.db2.gz	BTHKVIZMATTXHQ-UHFFFAOYSA-N	2	1	434.632	3.556	40	0		IHABMP
CN(C)c1nc2c(c(N3CCC([NH+]4CCCCC4)CC3)n1)CC[N@@H+](Cc1ccccc1)C2	ZINC000012142765	522334352	/nfs/dbraw/zinc/33/43/52/522334352.db2.gz	BTHKVIZMATTXHQ-UHFFFAOYSA-N	2	1	434.632	3.556	40	0		IHABMP
CCn1ncc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)c1C	ZINC000019523933	556781324	/nfs/dbraw/zinc/78/13/24/556781324.db2.gz	WASZKEBCFSFDHY-WMZHIEFXSA-N	2	1	427.568	3.522	40	0		IHABMP
CCN1CC[C@]2(C[N@@H+](Cc3cccnc3)CC23CC[NH+](Cc2ccc(C)s2)CC3)C1=O	ZINC000096036466	557163574	/nfs/dbraw/zinc/16/35/74/557163574.db2.gz	OLWNDFHGHPIQEE-VWLOTQADSA-N	2	1	438.641	3.788	40	0		IHABMP
C[NH+]1CCN(c2ccc(NC(=O)[C@@H]3CCC[N@@H+](Cc4ccccc4Cl)C3)cc2)CC1	ZINC000096627168	557203620	/nfs/dbraw/zinc/20/36/20/557203620.db2.gz	FGPGKODDQSKTEO-HXUWFJFHSA-N	2	1	426.992	3.943	40	0		IHABMP
CCc1[nH+]ccn1CCOc1ccc(C[N@@H+]2C[C@H](O)[C@@H](Oc3ccc(C)c(C)c3)C2)cc1	ZINC000585268846	557210362	/nfs/dbraw/zinc/21/03/62/557210362.db2.gz	XOKPRMKOMRVQGD-DQEYMECFSA-N	2	1	435.568	3.765	40	0		IHABMP
CCc1[nH+]ccn1CCOc1ccc(C[N@H+]2C[C@H](O)[C@@H](Oc3ccc(C)c(C)c3)C2)cc1	ZINC000585268846	557210366	/nfs/dbraw/zinc/21/03/66/557210366.db2.gz	XOKPRMKOMRVQGD-DQEYMECFSA-N	2	1	435.568	3.765	40	0		IHABMP
Cc1cc(Nc2ncccc2C)cc([C@@H]2CN(C(=O)C3CC[NH+](C(C)C)CC3)CCO2)[nH+]1	ZINC000257239871	568683862	/nfs/dbraw/zinc/68/38/62/568683862.db2.gz	HRDUATRNIUQJSE-QHCPKHFHSA-N	2	1	437.588	3.857	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@H](O)Cn2c(C)c(C)c3ccccc32)ccc1OCC[NH+](C)C	ZINC000585270851	557150647	/nfs/dbraw/zinc/15/06/47/557150647.db2.gz	BVEOJHOEHPYWJD-QFIPXVFZSA-N	2	1	439.600	3.700	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019525737	556783579	/nfs/dbraw/zinc/78/35/79/556783579.db2.gz	HNRAOESWOAWKRT-NZQKXSOJSA-N	2	1	439.579	3.739	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019525737	556783582	/nfs/dbraw/zinc/78/35/82/556783582.db2.gz	HNRAOESWOAWKRT-NZQKXSOJSA-N	2	1	439.579	3.739	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@H]2c2ccc(C[NH2+]C3CCCC3)cc2)cc1	ZINC000585169187	557132449	/nfs/dbraw/zinc/13/24/49/557132449.db2.gz	CZRLDURDFZEVIG-IZZNHLLZSA-N	2	1	435.612	3.732	40	0		IHABMP
COc1ccc(NC(=O)C[NH+]2CCC(c3cc(Nc4cnccn4)cc(C)[nH+]3)CC2)cc1	ZINC000257231052	568679421	/nfs/dbraw/zinc/67/94/21/568679421.db2.gz	GEZQGKROLNLVCM-UHFFFAOYSA-N	2	1	432.528	3.750	40	0		IHABMP
c1cc2c(C[C@@H]3COCC[N@H+](Cc4ccccc4OCC[NH+]4CCCC4)C3)nccn2c1	ZINC000257256228	568691610	/nfs/dbraw/zinc/69/16/10/568691610.db2.gz	KKNRHPSMESEIHN-QFIPXVFZSA-N	2	1	434.584	3.500	40	0		IHABMP
COc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000019587541	569227287	/nfs/dbraw/zinc/22/72/87/569227287.db2.gz	NCDNKBWKCYFGNK-IMSXRSKXSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[N@H+]2CCC[C@H]([C@@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[NH+]3C)C2)c1	ZINC000019587541	569227288	/nfs/dbraw/zinc/22/72/88/569227288.db2.gz	NCDNKBWKCYFGNK-IMSXRSKXSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[N@@H+]3C)C2)c1	ZINC000019587541	569227289	/nfs/dbraw/zinc/22/72/89/569227289.db2.gz	NCDNKBWKCYFGNK-IMSXRSKXSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cccc(C[NH+]2CCC[C@H]([C@@H]3C[C@@H](C(=O)Nc4ccccc4OC)C[N@H+]3C)C2)c1	ZINC000019587541	569227290	/nfs/dbraw/zinc/22/72/90/569227290.db2.gz	NCDNKBWKCYFGNK-IMSXRSKXSA-N	2	1	437.584	3.875	40	0		IHABMP
C[C@@H]1CCC[C@@H](C)[NH+]1C[C@H](O)COc1ccc(OC[C@H](O)C[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1	ZINC000009082770	569293677	/nfs/dbraw/zinc/29/36/77/569293677.db2.gz	ODYINPFMZIJYIN-WVYLNQBTSA-N	2	1	448.648	3.692	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@@H]2c2ccc(C[NH2+]C3CCCC3)cc2)cc1	ZINC000585169185	557132520	/nfs/dbraw/zinc/13/25/20/557132520.db2.gz	CZRLDURDFZEVIG-CLJLJLNGSA-N	2	1	435.612	3.732	40	0		IHABMP
C[C@@H]1CCC[C@H](C)[N@@H+]1C[C@@H](O)COc1ccc(OC[C@H](O)C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1	ZINC000101263551	557285550	/nfs/dbraw/zinc/28/55/50/557285550.db2.gz	ODYINPFMZIJYIN-MRIDXKINSA-N	2	1	448.648	3.692	40	0		IHABMP
CCn1ncc(C[NH+]2CCC([C@@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)c1C	ZINC000019523932	556781332	/nfs/dbraw/zinc/78/13/32/556781332.db2.gz	WASZKEBCFSFDHY-CVDCTZTESA-N	2	1	427.568	3.522	40	0		IHABMP
C[NH+]1CCN(c2ncc(-c3ccncc3)c([C@@H]3CCC[N@H+](Cc4ccc(F)cc4)C3)n2)CC1	ZINC000019590123	556824875	/nfs/dbraw/zinc/82/48/75/556824875.db2.gz	DEEMJQCZSHRIGI-JOCHJYFZSA-N	2	1	446.574	3.809	40	0		IHABMP
C[NH+]1CCN(c2ncc(-c3ccncc3)c([C@@H]3CCC[N@@H+](Cc4ccc(F)cc4)C3)n2)CC1	ZINC000019590123	556824877	/nfs/dbraw/zinc/82/48/77/556824877.db2.gz	DEEMJQCZSHRIGI-JOCHJYFZSA-N	2	1	446.574	3.809	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[N@@H+]2C[C@H](O)[C@@H](Oc3cc(C)cc(C)c3C)C2)cc1	ZINC000585268819	557210420	/nfs/dbraw/zinc/21/04/20/557210420.db2.gz	KWZQEHVJAZOZRI-AHWVRZQESA-N	2	1	435.568	3.820	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[N@H+]2C[C@H](O)[C@@H](Oc3cc(C)cc(C)c3C)C2)cc1	ZINC000585268819	557210421	/nfs/dbraw/zinc/21/04/21/557210421.db2.gz	KWZQEHVJAZOZRI-AHWVRZQESA-N	2	1	435.568	3.820	40	0		IHABMP
O[C@@]1(COc2ccccc2F)CCC[N@@H+](Cc2cccc(OCCn3ccnc3)c2)CC1	ZINC000585272830	568617873	/nfs/dbraw/zinc/61/78/73/568617873.db2.gz	OWIWONQJOZOAKE-VWLOTQADSA-N	2	1	439.531	3.897	40	0		IHABMP
CNC(=[NH2+])c1ccc(NC(=N)c2cccc(C(=[NH2+])Nc3ccc(C(=[NH2+])NC)cc3)c2)cc1	ZINC000008626476	556193598	/nfs/dbraw/zinc/19/35/98/556193598.db2.gz	VTGCXWBEYAILBI-UHFFFAOYSA-N	3	1	426.528	3.651	40	0		IHABMP
Cc1ccccc1C[N@H+]1CCC[C@@H](c2nc(N3CC[NH+](C)CC3)ncc2-c2ccncc2)C1	ZINC000019237178	556722178	/nfs/dbraw/zinc/72/21/78/556722178.db2.gz	UBEIEZIFIYGRSU-XMMPIXPASA-N	2	1	442.611	3.978	40	0		IHABMP
Cc1ccccc1C[N@@H+]1CCC[C@@H](c2nc(N3CC[NH+](C)CC3)ncc2-c2ccncc2)C1	ZINC000019237178	556722182	/nfs/dbraw/zinc/72/21/82/556722182.db2.gz	UBEIEZIFIYGRSU-XMMPIXPASA-N	2	1	442.611	3.978	40	0		IHABMP
Cc1ccccc1-c1ncc(C[N@@H+]2CC=CC[C@@]3(C(=O)N4CC[NH+](C)CC4)CCC[C@@H]23)cn1	ZINC000019237540	556722396	/nfs/dbraw/zinc/72/23/96/556722396.db2.gz	URXQMLRSSMRDIF-SHQCIBLASA-N	2	1	445.611	3.527	40	0		IHABMP
Cc1ccccc1-c1ncc(C[N@H+]2CC=CC[C@@]3(C(=O)N4CC[NH+](C)CC4)CCC[C@@H]23)cn1	ZINC000019237540	556722398	/nfs/dbraw/zinc/72/23/98/556722398.db2.gz	URXQMLRSSMRDIF-SHQCIBLASA-N	2	1	445.611	3.527	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@H]2c2ccc(C[NH2+]C3CCCC3)cc2)cc1	ZINC000585169188	557132471	/nfs/dbraw/zinc/13/24/71/557132471.db2.gz	CZRLDURDFZEVIG-UIOOFZCWSA-N	2	1	435.612	3.732	40	0		IHABMP
O=C1CCCC[C@]2(C[N@@H+](CC3CC[NH+](Cc4ccccc4)CC3)C[C@H]2c2ccccn2)N1	ZINC000019371828	556748780	/nfs/dbraw/zinc/74/87/80/556748780.db2.gz	GHDFZAWKKGCZHD-RPLLCQBOSA-N	2	1	432.612	3.822	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[NH+]2CCC(O)(COc3ccc(C)cc3)CC2)cc1	ZINC000585271658	557214926	/nfs/dbraw/zinc/21/49/26/557214926.db2.gz	BHPWTPJUGCCOJH-UHFFFAOYSA-N	2	1	435.568	3.985	40	0		IHABMP
Cc1cc(C)cc(C[NH+]2CCC3(CC2)C[N@H+](C)C[C@H](C(=O)N(C)Cc2ccccc2)O3)c1	ZINC000306137906	568770095	/nfs/dbraw/zinc/77/00/95/568770095.db2.gz	RJUUSEQRGUUJCT-RUZDIDTESA-N	2	1	435.612	3.627	40	0		IHABMP
COc1cccc(C[NH+]2CCC3(CC2)C[N@H+](C)C[C@@H](C(=O)Nc2cccc(Cl)c2)O3)c1	ZINC000306139108	568771061	/nfs/dbraw/zinc/77/10/61/568771061.db2.gz	SPSVFGPMBVZJLI-QFIPXVFZSA-N	2	1	443.975	3.653	40	0		IHABMP
COc1cccc(C[NH+]2CCC3(CC2)C[N@@H+](C)C[C@@H](C(=O)Nc2cccc(Cl)c2)O3)c1	ZINC000306139108	568771063	/nfs/dbraw/zinc/77/10/63/568771063.db2.gz	SPSVFGPMBVZJLI-QFIPXVFZSA-N	2	1	443.975	3.653	40	0		IHABMP
COc1ccc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(OC)cc4)C[N@H+]3C)CC2)cc1	ZINC000019587671	556823560	/nfs/dbraw/zinc/82/35/60/556823560.db2.gz	LPNRMLKFLUZTBF-PXDATVDWSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@H](O)COC2CCCCC2)ccc1OCC[NH+]1CCC(C)CC1	ZINC000585272045	557216750	/nfs/dbraw/zinc/21/67/50/557216750.db2.gz	FDHKPGIUVFSCJB-QHCPKHFHSA-N	2	1	448.648	3.948	40	0		IHABMP
Cc1ccc(Cl)c(OC[C@]2(O)CCC[N@H+](Cc3ccc(OCC[NH+](C)C)cc3)C2)c1	ZINC000585272708	557217313	/nfs/dbraw/zinc/21/73/13/557217313.db2.gz	OBUYGUODFBZEJH-DEOSSOPVSA-N	2	1	432.992	3.995	40	0		IHABMP
Cc1[nH+]ccn1CCOc1cccc(C[NH+]2CCC(O)(COc3ccccc3F)CC2)c1	ZINC000585274179	557218356	/nfs/dbraw/zinc/21/83/56/557218356.db2.gz	XDKDYCSSVMIGPT-UHFFFAOYSA-N	2	1	439.531	3.816	40	0		IHABMP
CCOc1ccccc1OC[C@@H](O)C[N@@H+](C)Cc1cccc(OCC[NH+]2CCCCC2)c1	ZINC000585270648	568617165	/nfs/dbraw/zinc/61/71/65/568617165.db2.gz	AKURVLJRGGRXEI-QHCPKHFHSA-N	2	1	442.600	3.822	40	0		IHABMP
CN(Cc1ccccc1)C(=O)[C@H]1C[N@@H+](C)CC2(CC[NH+](Cc3cccc(Cl)c3)CC2)O1	ZINC000306123087	568762519	/nfs/dbraw/zinc/76/25/19/568762519.db2.gz	AEEXCRTZDNHSEV-HSZRJFAPSA-N	2	1	442.003	3.664	40	0		IHABMP
C[NH+]1CCN(c2nccc(CN(Cc3cccs3)C3CC(C)(C)[NH2+]C(C)(C)C3)n2)CC1	ZINC000019461037	556767537	/nfs/dbraw/zinc/76/75/37/556767537.db2.gz	BLZSZBKRYYRQDX-UHFFFAOYSA-N	2	1	442.677	3.601	40	0		IHABMP
Cc1[nH+]ccn1CCOc1ccc(C[NH+]2CCC(O)(COc3ccccc3F)CC2)cc1	ZINC000585271836	557216137	/nfs/dbraw/zinc/21/61/37/557216137.db2.gz	CYNPBANFQNUQSB-UHFFFAOYSA-N	2	1	439.531	3.816	40	0		IHABMP
C[NH+](C)Cc1ccc(C(=O)N2CC[C@@H]3[C@H](C2)[C@@H](c2cccnc2)C[N@@H+]3Cc2ccccc2)o1	ZINC000257298606	568710658	/nfs/dbraw/zinc/71/06/58/568710658.db2.gz	RMLWPYMIBJSNTK-UBFVSLLYSA-N	2	1	444.579	3.867	40	0		IHABMP
C[NH+](C)Cc1ccc(C(=O)N2CC[C@@H]3[C@H](C2)[C@@H](c2cccnc2)C[N@H+]3Cc2ccccc2)o1	ZINC000257298606	568710661	/nfs/dbraw/zinc/71/06/61/568710661.db2.gz	RMLWPYMIBJSNTK-UBFVSLLYSA-N	2	1	444.579	3.867	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019454002	556764259	/nfs/dbraw/zinc/76/42/59/556764259.db2.gz	WWMAELAHMBLDAN-NZQKXSOJSA-N	2	1	439.579	3.910	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019454002	556764262	/nfs/dbraw/zinc/76/42/62/556764262.db2.gz	WWMAELAHMBLDAN-NZQKXSOJSA-N	2	1	439.579	3.910	40	0		IHABMP
CCN1CC[C@]2(C[N@@H+](Cc3cccnc3)CC23CC[NH+](Cc2ccc(F)cc2)CC3)C1=O	ZINC000096036468	557163549	/nfs/dbraw/zinc/16/35/49/557163549.db2.gz	QHOWOTDPGYPFQG-SANMLTNESA-N	2	1	436.575	3.557	40	0		IHABMP
COc1ccc([C@@H]2C[N@H+](Cc3ccccc3OCC[NH+]3CCCC3)CCN2C(C)=O)cc1	ZINC000585261970	557198058	/nfs/dbraw/zinc/19/80/58/557198058.db2.gz	XAUJWOFZBRXQRK-VWLOTQADSA-N	2	1	437.584	3.575	40	0		IHABMP
COc1ccc([C@@H]2C[N@@H+](Cc3ccccc3OCC[NH+]3CCCC3)CCN2C(C)=O)cc1	ZINC000585261970	557198060	/nfs/dbraw/zinc/19/80/60/557198060.db2.gz	XAUJWOFZBRXQRK-VWLOTQADSA-N	2	1	437.584	3.575	40	0		IHABMP
CCCCc1cc(C[C@H]2C[NH2+]CC[C@H]2CC(=O)N2CC[NH+](Cc3ccccc3)CC2)no1	ZINC000015673342	560230658	/nfs/dbraw/zinc/23/06/58/560230658.db2.gz	KCEUDJCZARJSLT-GOTSBHOMSA-N	2	1	438.616	3.520	40	0	biogenic,in-vitro	IHABMP
COc1cc(C[N@@H+](C)C[C@@H](O)COc2ccc(C)cc2C)ccc1OCCC[NH+](C)C	ZINC000585270710	568617205	/nfs/dbraw/zinc/61/72/05/568617205.db2.gz	APBKOJBRONAOSM-JOCHJYFZSA-N	2	1	430.589	3.514	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@H](O)COc2ccccc2)ccc1OCC[NH+]1CCC(C)CC1	ZINC000585270657	568617350	/nfs/dbraw/zinc/61/73/50/568617350.db2.gz	ALCNRXPWHDABGC-QHCPKHFHSA-N	2	1	442.600	3.678	40	0		IHABMP
C[C@H]1CCC=C2C[C@H]3OC(=O)[C@H](C[NH2+]C4CC[NH+](Cc5ccccc5)CC4)[C@H]3[C@@H](O)[C@@]21C	ZINC000008917847	556851375	/nfs/dbraw/zinc/85/13/75/556851375.db2.gz	NILKEYZRQOIGIQ-UZVXBKDWSA-N	2	1	438.612	3.526	40	0		IHABMP
COc1ccc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(OC)cc4)C[N@H+]3C)CC2)cc1	ZINC000019587669	569227329	/nfs/dbraw/zinc/22/73/29/569227329.db2.gz	LPNRMLKFLUZTBF-BWKNWUBXSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(OC)cc4)C[N@H+]3C)CC2)cc1	ZINC000019587675	556823956	/nfs/dbraw/zinc/82/39/56/556823956.db2.gz	LPNRMLKFLUZTBF-SQJMNOBHSA-N	2	1	437.584	3.875	40	0		IHABMP
CCN1CC[C@@]2(C[N@@H+](Cc3cccnc3)CC23CC[NH+](Cc2ccc(F)cc2)CC3)C1=O	ZINC000096036469	557163347	/nfs/dbraw/zinc/16/33/47/557163347.db2.gz	QHOWOTDPGYPFQG-AREMUKBSSA-N	2	1	436.575	3.557	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@H]2c2cccc(C[NH2+]C3CCCC3)c2)cc1	ZINC000585262566	557202270	/nfs/dbraw/zinc/20/22/70/557202270.db2.gz	SYYHQKQUDAAKHR-IZZNHLLZSA-N	2	1	435.612	3.732	40	0		IHABMP
C[NH+]1CCN(C(=O)C[C@@H]2CC[NH2+]C[C@@H]2Cc2cc(-c3ccc(C(C)(C)C)cc3)on2)CC1	ZINC000015673737	560230753	/nfs/dbraw/zinc/23/07/53/560230753.db2.gz	SMXKTZQYJBEJJI-SFTDATJTSA-N	2	1	438.616	3.571	40	0	biogenic,in-vitro	IHABMP
Cc1cc(Nc2ncccc2C)cc([C@H]2CN(C(=O)C3CC[NH+](C(C)C)CC3)CCO2)[nH+]1	ZINC000257239870	568683801	/nfs/dbraw/zinc/68/38/01/568683801.db2.gz	HRDUATRNIUQJSE-HSZRJFAPSA-N	2	1	437.588	3.857	40	0		IHABMP
COc1ccc(NC(=O)[C@H]2C[C@@H](C3CC[NH+](Cc4ccccc4OC)CC3)[N@@H+](C)C2)cc1	ZINC000019587709	569227366	/nfs/dbraw/zinc/22/73/66/569227366.db2.gz	CGGRSJSDHFWMTR-URXFXBBRSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cc(C[NH+]2CCC([C@H]3C[C@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)ccc1O	ZINC000019587659	556823551	/nfs/dbraw/zinc/82/35/51/556823551.db2.gz	GXDZFAJUVFBSHZ-SIKLNZKXSA-N	2	1	441.547	3.711	40	0		IHABMP
COc1ccc(CCNC(=O)[C@H]2C[N@@H+](C)C[C@H]2c2cccc(C[NH2+]C3CCCC3)c2)cc1	ZINC000585262567	557202305	/nfs/dbraw/zinc/20/23/05/557202305.db2.gz	SYYHQKQUDAAKHR-UIOOFZCWSA-N	2	1	435.612	3.732	40	0		IHABMP
CO[C@@]1(COc2cccc(Cl)c2)COCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1	ZINC000585271725	557216312	/nfs/dbraw/zinc/21/63/12/557216312.db2.gz	JKVXVIZZUOYQRK-XMMPIXPASA-N	2	1	448.991	3.577	40	0		IHABMP
COc1ccc(NC(=O)[C@@H]2C[C@@H](C3CC[NH+](Cc4ccccc4OC)CC3)[N@@H+](C)C2)cc1	ZINC000019587707	569227194	/nfs/dbraw/zinc/22/71/94/569227194.db2.gz	CGGRSJSDHFWMTR-QPPBQGQZSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(CCNC(=O)[C@@H]2C[N@@H+](C)C[C@H]2c2cccc(C[NH+]3CCCCC3)c2)cc1	ZINC000257272554	556713664	/nfs/dbraw/zinc/71/36/64/556713664.db2.gz	NCVVLVPLSQZEEH-IZZNHLLZSA-N	2	1	435.612	3.685	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019525735	556783505	/nfs/dbraw/zinc/78/35/05/556783505.db2.gz	HNRAOESWOAWKRT-NFBKMPQASA-N	2	1	439.579	3.739	40	0		IHABMP
CCCc1ncc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019525735	556783508	/nfs/dbraw/zinc/78/35/08/556783508.db2.gz	HNRAOESWOAWKRT-NFBKMPQASA-N	2	1	439.579	3.739	40	0		IHABMP
c1ccc2c(c1)C[N@H+](Cc1ccc3c(c1)OCO3)CC21CCN(CC[NH+]2CCCC2)CC1	ZINC000096242489	557186617	/nfs/dbraw/zinc/18/66/17/557186617.db2.gz	QHKGUQDYXZXFAT-UHFFFAOYSA-N	2	1	433.596	3.861	40	0		IHABMP
Cc1[nH+]ccn1-c1cccc([C@H]2CCCN2C(=O)COc2ccc(C[NH+]3CCCC3)cc2)n1	ZINC000257249124	568688071	/nfs/dbraw/zinc/68/80/71/568688071.db2.gz	JGXAEOZRKXBTBA-XMMPIXPASA-N	2	1	445.567	3.914	40	0		IHABMP
Cc1cc(Nc2cnccn2)cc([C@H]2CCCN(C(=O)C[N@@H+]3CCc4ccccc4C3)C2)[nH+]1	ZINC000072374936	556949372	/nfs/dbraw/zinc/94/93/72/556949372.db2.gz	ZIFDFBOBAOCCHS-QFIPXVFZSA-N	2	1	442.567	3.688	40	0		IHABMP
Cc1cc(Nc2cnccn2)cc([C@H]2CCCN(C(=O)C[N@H+]3CCc4ccccc4C3)C2)[nH+]1	ZINC000072374936	556949376	/nfs/dbraw/zinc/94/93/76/556949376.db2.gz	ZIFDFBOBAOCCHS-QFIPXVFZSA-N	2	1	442.567	3.688	40	0		IHABMP
COc1ccc(C[NH+]2CCC3(C[C@H](CC(=O)N4CC[NH+](C)CC4)c4ccccc43)CC2)cc1	ZINC000096052940	557166432	/nfs/dbraw/zinc/16/64/32/557166432.db2.gz	DNRREPBVDHTBMY-QHCPKHFHSA-N	2	1	447.623	3.880	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019453998	556764195	/nfs/dbraw/zinc/76/41/95/556764195.db2.gz	WWMAELAHMBLDAN-NFBKMPQASA-N	2	1	439.579	3.910	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019453998	556764198	/nfs/dbraw/zinc/76/41/98/556764198.db2.gz	WWMAELAHMBLDAN-NFBKMPQASA-N	2	1	439.579	3.910	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@@H+]3C)CC2)cn1	ZINC000019453996	556764297	/nfs/dbraw/zinc/76/42/97/556764297.db2.gz	WWMAELAHMBLDAN-OFNKIYASSA-N	2	1	439.579	3.910	40	0		IHABMP
CC(C)c1ncc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)cn1	ZINC000019453996	556764299	/nfs/dbraw/zinc/76/42/99/556764299.db2.gz	WWMAELAHMBLDAN-OFNKIYASSA-N	2	1	439.579	3.910	40	0		IHABMP
CCn1ncc(C[NH+]2CCC([C@@H]3C[C@@H](C(=O)Nc4ccc(F)cc4)C[N@H+]3C)CC2)c1C	ZINC000019523930	556781244	/nfs/dbraw/zinc/78/12/44/556781244.db2.gz	WASZKEBCFSFDHY-XXBNENTESA-N	2	1	427.568	3.522	40	0		IHABMP
COc1ccc(NC(=O)[C@@H]2C[C@H](C3CC[NH+](Cc4cccc(OC)c4)CC3)[N@@H+](C)C2)cc1	ZINC000019587702	556823931	/nfs/dbraw/zinc/82/39/31/556823931.db2.gz	FUEYDAISFXSBBV-PXDATVDWSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1ccc(NC(=O)[C@H]2C[C@H](C3CC[NH+](Cc4ccccc4OC)CC3)[N@@H+](C)C2)cc1	ZINC000019587713	556824157	/nfs/dbraw/zinc/82/41/57/556824157.db2.gz	CGGRSJSDHFWMTR-XUZZJYLKSA-N	2	1	437.584	3.875	40	0		IHABMP
COc1cc(C[N@@H+](C)C[C@@H](O)COC2CCCCC2)ccc1OCC[NH+]1CCC(C)CC1	ZINC000585272034	557216672	/nfs/dbraw/zinc/21/66/72/557216672.db2.gz	FDHKPGIUVFSCJB-HSZRJFAPSA-N	2	1	448.648	3.948	40	0		IHABMP
O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)[C@H]1CCC[N@@H+](Cc2ccccc2Cl)C1	ZINC000038830737	556621784	/nfs/dbraw/zinc/62/17/84/556621784.db2.gz	IVGZEJHKQXDHTA-QHCPKHFHSA-N	2	1	442.003	3.701	40	0		IHABMP
O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)[C@H]1CCC[N@H+](Cc2ccccc2Cl)C1	ZINC000038830737	556621786	/nfs/dbraw/zinc/62/17/86/556621786.db2.gz	IVGZEJHKQXDHTA-QHCPKHFHSA-N	2	1	442.003	3.701	40	0		IHABMP
Cc1ccccc1C[N@H+]1CCC[C@H](c2nc(N3CC[NH+](C)CC3)ncc2-c2ccncc2)C1	ZINC000019237179	556722193	/nfs/dbraw/zinc/72/21/93/556722193.db2.gz	UBEIEZIFIYGRSU-DEOSSOPVSA-N	2	1	442.611	3.978	40	0		IHABMP
Cc1ccccc1C[N@@H+]1CCC[C@H](c2nc(N3CC[NH+](C)CC3)ncc2-c2ccncc2)C1	ZINC000019237179	556722197	/nfs/dbraw/zinc/72/21/97/556722197.db2.gz	UBEIEZIFIYGRSU-DEOSSOPVSA-N	2	1	442.611	3.978	40	0		IHABMP
CO[C@]1(COc2cccc(Cl)c2)COCC[N@@H+](Cc2ccc(OCC[NH+](C)C)cc2)C1	ZINC000585271723	557216145	/nfs/dbraw/zinc/21/61/45/557216145.db2.gz	JKVXVIZZUOYQRK-DEOSSOPVSA-N	2	1	448.991	3.577	40	0		IHABMP
c1cc2ccc(C[C@@H]3COCC[N@H+](Cc4ccccc4OCC[NH+]4CCCC4)C3)nc2[nH]1	ZINC000257316731	568718315	/nfs/dbraw/zinc/71/83/15/568718315.db2.gz	VGSQWRDNADCGHF-NRFANRHFSA-N	2	1	434.584	3.729	40	0		IHABMP
c1cc2ccc(C[C@H]3COCC[N@H+](Cc4ccccc4OCC[NH+]4CCCC4)C3)nc2[nH]1	ZINC000257316732	568718533	/nfs/dbraw/zinc/71/85/33/568718533.db2.gz	VGSQWRDNADCGHF-OAQYLSRUSA-N	2	1	434.584	3.729	40	0		IHABMP