smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1nn(C)c2ncc(C(=O)N[C@H](C)C[N@H+]3CCC[C@H](C)C3)cc12 ZINC000056240565 214366636 /nfs/dbraw/zinc/36/66/36/214366636.db2.gz VAIBNDWMNNXTFZ-QWHCGFSZSA-N 1 1 329.448 2.127 40 0 EEABMO COc1ccc(OC)c(C[N@H+]2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)c1 ZINC000019285209 202003297 /nfs/dbraw/zinc/00/32/97/202003297.db2.gz QSKOJRVVKKWDLB-ZDUSSCGKSA-N 1 1 329.400 2.085 40 0 EEABMO O=c1cc([C@H]2CC[N@H+](Cc3ccccc3F)C2)nc(N2CCCC2)[nH]1 ZINC000019348816 202006349 /nfs/dbraw/zinc/00/63/49/202006349.db2.gz QNRYQEYTUDRENT-HNNXBMFYSA-N 1 1 342.418 2.499 40 0 EEABMO CCCNC(=O)c1cc([C@H]2CCC[N@@H+](Cc3cnn(C)c3C)C2)no1 ZINC000019503737 202010088 /nfs/dbraw/zinc/01/00/88/202010088.db2.gz XIIGPGMSJYURAE-AWEZNQCLSA-N 1 1 345.447 2.236 40 0 EEABMO C[N@@H+]1CCc2nnc(C3CCN(C(=O)C4CCCCC4)CC3)n2CC1 ZINC000019708971 202016424 /nfs/dbraw/zinc/01/64/24/202016424.db2.gz HEUUPCIDYVHZOT-UHFFFAOYSA-N 1 1 345.491 2.052 40 0 EEABMO OCC[C@](CC[NH+]1CCOCC1)(c1ccccc1)C1(O)CCCC1 ZINC000031794791 202209397 /nfs/dbraw/zinc/20/93/97/202209397.db2.gz RJJMFZDUICQIPZ-LJQANCHMSA-N 1 1 333.472 2.334 40 0 EEABMO Cc1nnc(-c2cccc(C(=O)N[C@@H]3CC[N@@H+](CC4CC4)C3)c2)o1 ZINC000073476756 202370280 /nfs/dbraw/zinc/37/02/80/202370280.db2.gz PJLWFTJNJZFBLI-MRXNPFEDSA-N 1 1 326.400 2.259 40 0 EEABMO O=C([C@H]1CCC[N@@H+](Cc2ccccc2)C1)N1CCO[C@@H](C(F)F)C1 ZINC000249297651 201181454 /nfs/dbraw/zinc/18/14/54/201181454.db2.gz RHUAMMDLGJINLD-JKSUJKDBSA-N 1 1 338.398 2.391 40 0 EEABMO c1cc(COCC[C@H]2CO[C@H]3C[N@@H+](CC4CCOCC4)C[C@@H]23)ccn1 ZINC000253480539 244001223 /nfs/dbraw/zinc/00/12/23/244001223.db2.gz XNDCXCNDZWRXCT-UFYCRDLUSA-N 1 1 346.471 2.362 40 0 EEABMO Cc1nc(CN2CC[NH+](Cc3ccc4c(c3)CC(C)(C)O4)CC2)no1 ZINC000093274044 203132991 /nfs/dbraw/zinc/13/29/91/203132991.db2.gz LOSNMSWLQCXCKU-UHFFFAOYSA-N 1 1 342.443 2.409 40 0 EEABMO CC(C)CC[N@H+]1CCc2c(nc(N3C[C@H](C)O[C@@H](C)C3)[nH]c2=O)C1 ZINC000072335562 203202677 /nfs/dbraw/zinc/20/26/77/203202677.db2.gz WWMSGKVGZSKMEB-KBPBESRZSA-N 1 1 334.464 2.200 40 0 EEABMO COc1cc(C[NH+]2CCC(O)(c3cccnc3F)CC2)ccc1O ZINC000072339993 203203714 /nfs/dbraw/zinc/20/37/14/203203714.db2.gz AQSTXKLGWWXQJF-UHFFFAOYSA-N 1 1 332.375 2.419 40 0 EEABMO CNc1cncc(C2CCN(C(=O)[C@]3(C)CCCC[N@H+]3C)CC2)n1 ZINC000072367317 203207596 /nfs/dbraw/zinc/20/75/96/203207596.db2.gz LOACYTLQAISWJB-SFHVURJKSA-N 1 1 331.464 2.099 40 0 EEABMO Cc1[nH+]ccn1-c1cncc([C@@H]2CCCN2C(=O)c2cccnc2)n1 ZINC000072378420 203208584 /nfs/dbraw/zinc/20/85/84/203208584.db2.gz AYNSCROYIVSNSZ-INIZCTEOSA-N 1 1 334.383 2.343 40 0 EEABMO Cc1cccc(N2CCC[C@H](NS(=O)(=O)c3cccs3)C2)[nH+]1 ZINC000257266928 244364951 /nfs/dbraw/zinc/36/49/51/244364951.db2.gz MFENNIHNHWVWQO-ZDUSSCGKSA-N 1 1 337.470 2.399 40 0 EEABMO Cc1nn(-c2ccccc2)c(C)c1CNC[C@@]1(O)CCC[N@H+](C)C1 ZINC000041123503 204007724 /nfs/dbraw/zinc/00/77/24/204007724.db2.gz MLZBUHCRXRZTOA-IBGZPJMESA-N 1 1 328.460 2.035 40 0 EEABMO Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C[C@@]1(O)CCCN(C)C1 ZINC000041123503 204007725 /nfs/dbraw/zinc/00/77/25/204007725.db2.gz MLZBUHCRXRZTOA-IBGZPJMESA-N 1 1 328.460 2.035 40 0 EEABMO Cc1nc2ccccn2c1-c1nnc2sc(C[NH+]3CCCC3)nn21 ZINC000227144000 205173653 /nfs/dbraw/zinc/17/36/53/205173653.db2.gz IETAQRFVXXBPLA-UHFFFAOYSA-N 1 1 339.428 2.405 40 0 EEABMO CC[NH+]1CCN(CC2=CC(C)(C)N3C(=O)C(=O)c4cccc2c43)CC1 ZINC000253495627 276193992 /nfs/dbraw/zinc/19/39/92/276193992.db2.gz LGSKQROEOMGQAD-UHFFFAOYSA-N 1 1 339.439 2.029 40 0 EEABMO Cc1sc(=O)n(CCC(=O)N2CCC(Cc3[nH]cc[nH+]3)CC2)c1C ZINC000329154633 311653065 /nfs/dbraw/zinc/65/30/65/311653065.db2.gz CAYFQZAKWDMJTI-UHFFFAOYSA-N 1 1 348.472 2.121 40 0 EEABMO CCOC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2Cl)C1 ZINC000006327384 462682912 /nfs/dbraw/zinc/68/29/12/462682912.db2.gz QYSZQHCAOHQUST-KGLIPLIRSA-N 1 1 341.835 2.355 40 0 EEABMO O=C(CCCOc1ccc(Cl)cc1)NCCC[NH+]1CCOCC1 ZINC000014398468 462926280 /nfs/dbraw/zinc/92/62/80/462926280.db2.gz BSNRMFHJPVPZJQ-UHFFFAOYSA-N 1 1 340.851 2.338 40 0 EEABMO COc1cccc(C[N@H+]2CCC[C@@H](c3nc(C)cc(=O)[nH]3)C2)c1OC ZINC000019117984 463014232 /nfs/dbraw/zinc/01/42/32/463014232.db2.gz VIGNMFUVXADBRD-OAHLLOKOSA-N 1 1 343.427 2.475 40 0 EEABMO CC(C)CN1C[C@@H](C(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)CC1=O ZINC000019447113 463018285 /nfs/dbraw/zinc/01/82/85/463018285.db2.gz NIURHWQOQNXQCW-ZWKOTPCHSA-N 1 1 343.471 2.006 40 0 EEABMO CC(C)CN1C[C@@H](C(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)CC1=O ZINC000019447113 463018289 /nfs/dbraw/zinc/01/82/89/463018289.db2.gz NIURHWQOQNXQCW-ZWKOTPCHSA-N 1 1 343.471 2.006 40 0 EEABMO C[N@@H+]1CCC[C@H]1c1nnc2n1CCN(C(=O)CCc1ccccc1)C2 ZINC000019707223 463020829 /nfs/dbraw/zinc/02/08/29/463020829.db2.gz NNDKULKQXRWZJB-INIZCTEOSA-N 1 1 339.443 2.020 40 0 EEABMO C[N@H+]1CCC[C@H]1c1nnc2n1CCN(C(=O)CCc1ccccc1)C2 ZINC000019707223 463020832 /nfs/dbraw/zinc/02/08/32/463020832.db2.gz NNDKULKQXRWZJB-INIZCTEOSA-N 1 1 339.443 2.020 40 0 EEABMO O=C1[C@H]2C[N@@H+](Cc3nccs3)C[C@H]2CN1Cc1cccc(F)c1 ZINC000096053711 463156063 /nfs/dbraw/zinc/15/60/63/463156063.db2.gz KLQYEUAOWHNTIE-ZFWWWQNUSA-N 1 1 331.416 2.373 40 0 EEABMO O=C1[C@H]2C[N@H+](Cc3nccs3)C[C@H]2CN1Cc1cccc(F)c1 ZINC000096053711 463156067 /nfs/dbraw/zinc/15/60/67/463156067.db2.gz KLQYEUAOWHNTIE-ZFWWWQNUSA-N 1 1 331.416 2.373 40 0 EEABMO O=C(NCCc1ccncc1)[C@H]1C[C@@H]2CC[N@@H+](CC3CCC3)C[C@H]2O1 ZINC000096066152 463164892 /nfs/dbraw/zinc/16/48/92/463164892.db2.gz XBBBLNITHLIZJD-IPMKNSEASA-N 1 1 343.471 2.020 40 0 EEABMO Cc1ccc(C[N@H+]2CC[C@@]3(CC(C(=O)NCC4CC4)=NO3)C2)s1 ZINC000096074493 463167959 /nfs/dbraw/zinc/16/79/59/463167959.db2.gz VHKHRYAQWKIQHX-QGZVFWFLSA-N 1 1 333.457 2.304 40 0 EEABMO COCCN1C(=O)CCC[C@@]12CCC[N@H+](Cc1csc(C)n1)C2 ZINC000096077068 463168653 /nfs/dbraw/zinc/16/86/53/463168653.db2.gz CSQNBWPEPXFXAQ-KRWDZBQOSA-N 1 1 337.489 2.445 40 0 EEABMO COCCN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1csc(C)n1)C2 ZINC000096077068 463168657 /nfs/dbraw/zinc/16/86/57/463168657.db2.gz CSQNBWPEPXFXAQ-KRWDZBQOSA-N 1 1 337.489 2.445 40 0 EEABMO O=C(NC[C@]12COC[C@H]1C[N@@H+](Cc1cccs1)C2)c1cccnc1 ZINC000096108505 463176611 /nfs/dbraw/zinc/17/66/11/463176611.db2.gz IGXVKOHQEBQJCP-QAPCUYQASA-N 1 1 343.452 2.022 40 0 EEABMO c1ccc(C[N@@H+]2C[C@@H]3COC[C@]3(COCc3cccnc3)C2)nc1 ZINC000096108870 463177474 /nfs/dbraw/zinc/17/74/74/463177474.db2.gz HHESHKRIOIEKRZ-IEBWSBKVSA-N 1 1 325.412 2.142 40 0 EEABMO C[C@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CC[N@@H+](C)C1 ZINC000078999129 463177620 /nfs/dbraw/zinc/17/76/20/463177620.db2.gz PPSRYBZOEHFFMM-RYUDHWBXSA-N 1 1 341.249 2.284 40 0 EEABMO CO[C@@H]1CCN(Cc2ccccn2)[C@@H]2C[N@@H+](Cc3ccco3)C[C@@H]21 ZINC000096108601 463177764 /nfs/dbraw/zinc/17/77/64/463177764.db2.gz INYMASLHZMPLKP-IPMKNSEASA-N 1 1 327.428 2.396 40 0 EEABMO Cc1cccc(N2CC[C@@]3(C2)CCCN(C(=O)c2cnccn2)C3)[nH+]1 ZINC000096158197 463188757 /nfs/dbraw/zinc/18/87/57/463188757.db2.gz MLXVKCSDDBKFHM-LJQANCHMSA-N 1 1 337.427 2.313 40 0 EEABMO Cc1nc(CN2CC[C@]3(CC[N@@H+](Cc4ccncc4)C3)C2=O)cs1 ZINC000096159440 463190818 /nfs/dbraw/zinc/19/08/18/463190818.db2.gz ZQVWHQBXKAYEIR-SFHVURJKSA-N 1 1 342.468 2.471 40 0 EEABMO C[N@H+](Cc1ccco1)[C@@H]1CN(C(=O)c2ccccn2)[C@@H]2CCCO[C@H]12 ZINC000096185984 463197585 /nfs/dbraw/zinc/19/75/85/463197585.db2.gz JLZWTWDSTWLNBM-KURKYZTESA-N 1 1 341.411 2.179 40 0 EEABMO C[N@@H+](Cc1ccco1)[C@@H]1CN(C(=O)c2ccccn2)[C@@H]2CCCO[C@H]12 ZINC000096185984 463197592 /nfs/dbraw/zinc/19/75/92/463197592.db2.gz JLZWTWDSTWLNBM-KURKYZTESA-N 1 1 341.411 2.179 40 0 EEABMO CCOC[C@H]1Cn2cncc2C[N@H+](Cc2ccc3c(c2)OCO3)C1 ZINC000096206922 463209915 /nfs/dbraw/zinc/20/99/15/463209915.db2.gz PPHLLIOUAPFUNY-OAHLLOKOSA-N 1 1 329.400 2.280 40 0 EEABMO CCOC[C@H]1Cn2cncc2C[N@@H+](Cc2ccc3c(c2)OCO3)C1 ZINC000096206922 463209921 /nfs/dbraw/zinc/20/99/21/463209921.db2.gz PPHLLIOUAPFUNY-OAHLLOKOSA-N 1 1 329.400 2.280 40 0 EEABMO Cc1noc(C[C@@H]2CO[C@@H]3C[N@@H+](CCOCc4ccccc4)C[C@H]23)n1 ZINC000096215654 463213881 /nfs/dbraw/zinc/21/38/81/463213881.db2.gz FEOKBTXESPOTDZ-KZNAEPCWSA-N 1 1 343.427 2.084 40 0 EEABMO Fc1ccc(C[N@H+]2CC[C@@H]3CN(c4ncccn4)CCO[C@@H]3C2)cc1 ZINC000096249734 463226883 /nfs/dbraw/zinc/22/68/83/463226883.db2.gz SRLXOVFRUBOMER-SJLPKXTDSA-N 1 1 342.418 2.343 40 0 EEABMO COCC[N@H+]1CC[C@@H](NC(=O)N[C@H](C)c2ccc(Cl)cc2)C1 ZINC000096413259 463246047 /nfs/dbraw/zinc/24/60/47/463246047.db2.gz JQUPKMHMWFQWSW-IUODEOHRSA-N 1 1 325.840 2.421 40 0 EEABMO C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC2(CC1)OC[C@H](C)O2 ZINC000096414914 463246838 /nfs/dbraw/zinc/24/68/38/463246838.db2.gz DMRGGRXNGNZIED-STQMWFEESA-N 1 1 330.388 2.420 40 0 EEABMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cccc(OCC(F)(F)F)n2)C1 ZINC000096416942 463249022 /nfs/dbraw/zinc/24/90/22/463249022.db2.gz SLJNPEZXKOENJT-GFCCVEGCSA-N 1 1 345.365 2.483 40 0 EEABMO CN(C)c1[nH+]cc(CNC(=O)[C@H]2SCCc3ccccc32)n1C ZINC000080243963 463299512 /nfs/dbraw/zinc/29/95/12/463299512.db2.gz DXDXZOSRHHEOCP-HNNXBMFYSA-N 1 1 330.457 2.133 40 0 EEABMO Cc1ncsc1C[N@@H+]1C[C@@H](N2CCCC2=O)[C@H]2OCCC[C@H]2C1 ZINC000097953444 463366366 /nfs/dbraw/zinc/36/63/66/463366366.db2.gz MVQNEZQEXXCWMB-VBQJREDUSA-N 1 1 335.473 2.053 40 0 EEABMO CCOc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc3c(c2)OCO3)cc1 ZINC000072228081 463483840 /nfs/dbraw/zinc/48/38/40/463483840.db2.gz GQSLLKBRBRASEN-SJORKVTESA-N 1 1 326.352 2.229 40 0 EEABMO COc1cccc(C[N@H+]2CC[C@@H](c3n[nH]cc3C(=O)N(C)C)C2)c1F ZINC000257278478 463758214 /nfs/dbraw/zinc/75/82/14/463758214.db2.gz OCKWIMZRPQMBDF-CYBMUJFWSA-N 1 1 346.406 2.249 40 0 EEABMO C[N@H+](Cc1ccc(OCCOCCO)cc1)C[C@H](O)c1ccccc1 ZINC000257231826 463758834 /nfs/dbraw/zinc/75/88/34/463758834.db2.gz GIIFSGCUFJCWFT-FQEVSTJZSA-N 1 1 345.439 2.240 40 0 EEABMO CCc1ccc(C(=O)N2C[C@@H](O)[C@H]([NH+]3CCC(F)(F)CC3)C2)cc1 ZINC000257339235 463783807 /nfs/dbraw/zinc/78/38/07/463783807.db2.gz ZAVIMVKBKWISSM-HZPDHXFCSA-N 1 1 338.398 2.165 40 0 EEABMO Cn1cnc2c1[C@H](C(=O)NCCc1cccs1)C[N@@H+](CC1CC1)C2 ZINC000248005779 464723103 /nfs/dbraw/zinc/72/31/03/464723103.db2.gz BWNCFNRACQFFKD-OAHLLOKOSA-N 1 1 344.484 2.150 40 0 EEABMO CCc1oncc1C(=O)N[C@@H](C)C[NH+]1CCN(c2ccccc2)CC1 ZINC000252482939 464961898 /nfs/dbraw/zinc/96/18/98/464961898.db2.gz DQPMJFDJXHMRMA-HNNXBMFYSA-N 1 1 342.443 2.178 40 0 EEABMO COC(=O)C[C@@H]1CCC[N@H+]1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000253416353 465004236 /nfs/dbraw/zinc/00/42/36/465004236.db2.gz HPGJXZPFXJUPHU-RBUKOAKNSA-N 1 1 346.471 2.305 40 0 EEABMO COC(=O)C[C@@H]1CCCN1C[C@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000253416353 465004238 /nfs/dbraw/zinc/00/42/38/465004238.db2.gz HPGJXZPFXJUPHU-RBUKOAKNSA-N 1 1 346.471 2.305 40 0 EEABMO COC(=O)C[C@@H]1CCCN1C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000253416353 465004240 /nfs/dbraw/zinc/00/42/40/465004240.db2.gz HPGJXZPFXJUPHU-RBUKOAKNSA-N 1 1 346.471 2.305 40 0 EEABMO C[NH+]1CCC(CNC(=O)C(C)(C)C(F)F)(N2CCCCC2)CC1 ZINC000253421305 465009130 /nfs/dbraw/zinc/00/91/30/465009130.db2.gz UJFDPTJCMCVPOB-UHFFFAOYSA-N 1 1 331.451 2.344 40 0 EEABMO Cc1cc(F)ccc1C(=O)N1CC2(C1)C[C@@H](CO)C[N@H+]2CC1CC1 ZINC000585093927 468963080 /nfs/dbraw/zinc/96/30/80/468963080.db2.gz PYCJXGCXAFJCKR-OAHLLOKOSA-N 1 1 332.419 2.053 40 0 EEABMO Cc1cnccc1C[N@@H+]1CCOC[C@](O)(COc2ccc(F)cc2)C1 ZINC000585268937 468997170 /nfs/dbraw/zinc/99/71/70/468997170.db2.gz DZHDSVOYPHMFRG-IBGZPJMESA-N 1 1 346.402 2.171 40 0 EEABMO Cc1cnccc1C[N@H+]1CCOC[C@](O)(COc2ccc(F)cc2)C1 ZINC000585268937 468997181 /nfs/dbraw/zinc/99/71/81/468997181.db2.gz DZHDSVOYPHMFRG-IBGZPJMESA-N 1 1 346.402 2.171 40 0 EEABMO Cc1ccc(C[N@@H+]2CCOC[C@](O)(COc3ccc(F)cc3)C2)cn1 ZINC000585269357 468997481 /nfs/dbraw/zinc/99/74/81/468997481.db2.gz QIHWOIOHYPQEDO-IBGZPJMESA-N 1 1 346.402 2.171 40 0 EEABMO Cc1ccc(C[N@H+]2CCOC[C@](O)(COc3ccc(F)cc3)C2)cn1 ZINC000585269357 468997490 /nfs/dbraw/zinc/99/74/90/468997490.db2.gz QIHWOIOHYPQEDO-IBGZPJMESA-N 1 1 346.402 2.171 40 0 EEABMO O[C@H]1CC[N@H+](C2CCCCC2)C[C@]1(O)COc1ccc(F)c(F)c1 ZINC000585288122 469009172 /nfs/dbraw/zinc/00/91/72/469009172.db2.gz WWXQTPDHJIWMRK-ROUUACIJSA-N 1 1 341.398 2.474 40 0 EEABMO C[C@@]1(O)CC[N@@H+](CC2CC2)[C@@H](c2ccccc2)[C@@H]1NC(=O)C1CC1 ZINC000604383068 485649036 /nfs/dbraw/zinc/64/90/36/485649036.db2.gz CZNNTSRAVGNGHE-CMKODMSKSA-N 1 1 328.456 2.489 40 0 biogenic,in-vitro EEABMO CN(C)c1ncc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cn1 ZINC000189746278 529812224 /nfs/dbraw/zinc/81/22/24/529812224.db2.gz NGKYUUZYIQXHKF-CVEARBPZSA-N 1 1 340.431 2.110 40 0 EEABMO CCc1cc(N(C)C[C@@H]2C[C@H](F)CN2Cc2noc(C)n2)nc(C)[nH+]1 ZINC000281347754 539714998 /nfs/dbraw/zinc/71/49/98/539714998.db2.gz BZIGLSUEBNLVDA-ZFWWWQNUSA-N 1 1 348.426 2.088 40 0 EEABMO c1cncc(C[NH+](CCCN2CCOCC2)Cc2cccnc2)c1 ZINC000019338598 202004155 /nfs/dbraw/zinc/00/41/55/202004155.db2.gz SGSUWZDZKWSYOH-UHFFFAOYSA-N 1 1 326.444 2.201 40 0 EEABMO c1cncc(CN(CCC[NH+]2CCOCC2)Cc2cccnc2)c1 ZINC000019338598 202004156 /nfs/dbraw/zinc/00/41/56/202004156.db2.gz SGSUWZDZKWSYOH-UHFFFAOYSA-N 1 1 326.444 2.201 40 0 EEABMO C[C@@H]1COc2ccccc2CN1C(=O)CCCC[NH+]1CCOCC1 ZINC000272873643 201252951 /nfs/dbraw/zinc/25/29/51/201252951.db2.gz WERQHBNRPXBFPM-MRXNPFEDSA-N 1 1 332.444 2.299 40 0 EEABMO O=C(CN1CCCC1=O)NCCNc1cc[nH+]c2cc(Cl)ccc12 ZINC000225885781 242071840 /nfs/dbraw/zinc/07/18/40/242071840.db2.gz DGFLFPJXPHJDRT-UHFFFAOYSA-N 1 1 346.818 2.039 40 0 EEABMO c1ccc(CC[N@H+]2CCc3nnc([C@@H]4CCCCN4)n3CC2)cc1 ZINC000072372838 203209817 /nfs/dbraw/zinc/20/98/17/203209817.db2.gz YOYLBXCPIOLNJU-KRWDZBQOSA-N 1 1 325.460 2.194 40 0 EEABMO c1ccc(CC[N@@H+]2CCc3nnc([C@@H]4CCCCN4)n3CC2)cc1 ZINC000072372838 203209823 /nfs/dbraw/zinc/20/98/23/203209823.db2.gz YOYLBXCPIOLNJU-KRWDZBQOSA-N 1 1 325.460 2.194 40 0 EEABMO O=C(C[N@@H+]1C[C@@H]2[C@H](Oc3cccnc3)CC[C@@H]2C1)N1CCCCC1 ZINC000257251074 244268762 /nfs/dbraw/zinc/26/87/62/244268762.db2.gz JPHHOSUORDPTKJ-BPQIPLTHSA-N 1 1 329.444 2.183 40 0 EEABMO COc1cccc(C[N@H+]2CCc3nc4ccccc4c(=O)n3CC2)c1 ZINC000019565490 274145955 /nfs/dbraw/zinc/14/59/55/274145955.db2.gz 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COC(=O)C[C@H]1CCCN1C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000253416351 465004440 /nfs/dbraw/zinc/00/44/40/465004440.db2.gz HPGJXZPFXJUPHU-MOPGFXCFSA-N 1 1 346.471 2.305 40 0 EEABMO COC(=O)C[C@H]1CCCN1C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000253416351 465004446 /nfs/dbraw/zinc/00/44/46/465004446.db2.gz HPGJXZPFXJUPHU-MOPGFXCFSA-N 1 1 346.471 2.305 40 0 EEABMO c1cc(N[C@@H]2CCCOC2)nc(N2CCC(OC3CCCC3)CC2)[nH+]1 ZINC000366657330 465859508 /nfs/dbraw/zinc/85/95/08/465859508.db2.gz FVFSKJREDTVYQA-OAHLLOKOSA-N 1 1 346.475 2.996 40 0 EEABMO C[C@@H](c1ccccn1)[NH+]1CCN(c2cc(N3CCCC3)ncn2)CC1 ZINC000302852518 466197639 /nfs/dbraw/zinc/19/76/39/466197639.db2.gz QFBOGZWXLSHDPG-INIZCTEOSA-N 1 1 338.459 2.355 40 0 EEABMO CC(C)c1cc(C(=O)N2[C@@H](C[NH3+])C[C@]3(C)[C@H]2CCCC[C@H]3O)n[nH]1 ZINC000585261605 468995245 /nfs/dbraw/zinc/99/52/45/468995245.db2.gz JWEOKYCYSSYGAG-HALQFCHDSA-N 1 1 334.464 2.016 40 0 EEABMO CNc1ncccc1C[N@H+]1CC[C@@](O)(COc2ccc(F)cc2)C1 ZINC000585269502 468996915 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C[NH+]1CCN(C(=O)COc2ccc(C3SCCS3)cc2)CC1 ZINC000408567414 257896824 /nfs/dbraw/zinc/89/68/24/257896824.db2.gz DPFWEFXZDDASJI-UHFFFAOYSA-N 1 1 338.498 2.318 40 0 EEABMO CC(=O)NC[C@@H]1C=C(C)[C@H](CC(=O)N2CC[NH+](C)CC2)C[C@H]1C(C)C ZINC000030880820 278118617 /nfs/dbraw/zinc/11/86/17/278118617.db2.gz FPPXUZHYZIMPRY-FHWLQOOXSA-N 1 1 349.519 2.141 40 0 biogenic,in-vitro EEABMO O=C(c1ccc2c(c1O)CCCC2)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000333334440 312131919 /nfs/dbraw/zinc/13/19/19/312131919.db2.gz WUOYTDRLOOEZRT-GOSISDBHSA-N 1 1 337.423 2.453 40 0 EEABMO C=Cn1ncc(C[N@@H+]2CCc3nc(-c4ccncc4)[nH]c(=O)c3C2)c1C ZINC000012121909 462843359 /nfs/dbraw/zinc/84/33/59/462843359.db2.gz CPEBFYQNGPAWKM-UHFFFAOYSA-N 1 1 348.410 2.408 40 0 EEABMO C=Cn1ncc(C[N@H+]2CCc3nc(-c4ccncc4)[nH]c(=O)c3C2)c1C ZINC000012121909 462843364 /nfs/dbraw/zinc/84/33/64/462843364.db2.gz CPEBFYQNGPAWKM-UHFFFAOYSA-N 1 1 348.410 2.408 40 0 EEABMO Cc1ccc([C@@]2(O)CCC[C@H]3C[N@@H+](Cc4cnc(N)nc4)C[C@@H]32)cc1 ZINC000012186314 462846650 /nfs/dbraw/zinc/84/66/50/462846650.db2.gz COVSVXKTEGLWQD-QRFRQXIXSA-N 1 1 338.455 2.487 40 0 EEABMO CN(Cc1ccccn1)C(=O)[C@H]1C[C@@H]2CC[N@@H+](CC3CCC3)C[C@@H]2O1 ZINC000096043264 463147651 /nfs/dbraw/zinc/14/76/51/463147651.db2.gz ASNLNUOKXFPZGW-UHOSZYNNSA-N 1 1 343.471 2.320 40 0 EEABMO Cc1ccc(N[C@@H]2C[N@@H+](Cc3ccoc3)C[C@@H]3CCCO[C@H]23)nn1 ZINC000096065196 463162721 /nfs/dbraw/zinc/16/27/21/463162721.db2.gz IYNXHMOGKIZBFX-JZXOWHBKSA-N 1 1 328.416 2.470 40 0 EEABMO Cc1cccc(C[N@H+]2C[C@@H]3CN(Cc4ccoc4)CCO[C@@H]3C2)n1 ZINC000096108189 463175682 /nfs/dbraw/zinc/17/56/82/463175682.db2.gz ZDLKCTLHXBMLDB-PKOBYXMFSA-N 1 1 327.428 2.316 40 0 EEABMO Cc1cccc(CN2C[C@@H]3C[N@H+](Cc4ccoc4)CCO[C@@H]3C2)n1 ZINC000096108189 463175686 /nfs/dbraw/zinc/17/56/86/463175686.db2.gz ZDLKCTLHXBMLDB-PKOBYXMFSA-N 1 1 327.428 2.316 40 0 EEABMO Cc1cccc(CN2C[C@@H]3C[N@@H+](Cc4ccoc4)CCO[C@@H]3C2)n1 ZINC000096108189 463175691 /nfs/dbraw/zinc/17/56/91/463175691.db2.gz ZDLKCTLHXBMLDB-PKOBYXMFSA-N 1 1 327.428 2.316 40 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O=C(C[N@@H+]1CCC[C@@H](COc2ccccc2)C1)NCc1cccnc1 ZINC000096411343 463243498 /nfs/dbraw/zinc/24/34/98/463243498.db2.gz XZCCTHPPVQOXIQ-GOSISDBHSA-N 1 1 339.439 2.489 40 0 EEABMO O=C(C[N@H+]1CCC[C@@H](COc2ccccc2)C1)NCc1cccnc1 ZINC000096411343 463243502 /nfs/dbraw/zinc/24/35/02/463243502.db2.gz XZCCTHPPVQOXIQ-GOSISDBHSA-N 1 1 339.439 2.489 40 0 EEABMO Cn1cccc1[C@@H]1CCC[N@H+]1CCN1C(=O)NC2(CCCC2)C1=O ZINC000096424130 463254744 /nfs/dbraw/zinc/25/47/44/463254744.db2.gz OQEGZQPXUULKEF-HNNXBMFYSA-N 1 1 330.432 2.027 40 0 EEABMO CC[C@@H](C(=O)N1CCC(Nc2cccc(C)[nH+]2)CC1)N1CCCC1=O ZINC000096436591 463265181 /nfs/dbraw/zinc/26/51/81/463265181.db2.gz KFWRLYZAVOLITK-INIZCTEOSA-N 1 1 344.459 2.194 40 0 EEABMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(CC(C)C)[nH]c(=O)c2)[C@H](C)C1 ZINC000096495087 463289505 /nfs/dbraw/zinc/28/95/05/463289505.db2.gz GOJPLOCNCHZUAO-PBHICJAKSA-N 1 1 333.476 2.376 40 0 EEABMO C[C@@H]1C[C@H](NS(=O)(=O)Cc2ccon2)CC[N@H+]1Cc1ccccc1 ZINC000080294472 463306102 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COc1ccc2ccccc2c1C[N@H+]1CC[C@H]2OCC(=O)N(C)[C@H]2C1 ZINC000257313318 463773311 /nfs/dbraw/zinc/77/33/11/463773311.db2.gz URWHYNHPSMBBAF-PKOBYXMFSA-N 1 1 340.423 2.280 40 0 EEABMO OC1(C[N@H+]2CCOC[C@H](Cc3ccc4[nH]ccc4c3)C2)CCOCC1 ZINC000257317097 463774349 /nfs/dbraw/zinc/77/43/49/463774349.db2.gz VIKJPSDFMBSUDG-QGZVFWFLSA-N 1 1 344.455 2.200 40 0 EEABMO O=C([C@@H]1CCCC[N@H+]1Cc1ccccc1)N1CCC[C@H](OCCO)C1 ZINC000178654622 463936660 /nfs/dbraw/zinc/93/66/60/463936660.db2.gz HCZULDVPPDSWJN-OALUTQOASA-N 1 1 346.471 2.041 40 0 EEABMO C[NH+](C)[C@@H](CNC(=O)Nc1nc2c(s1)COCC2)c1ccco1 ZINC000172255791 464031866 /nfs/dbraw/zinc/03/18/66/464031866.db2.gz HQISZLICEXFQEY-NSHDSACASA-N 1 1 336.417 2.233 40 0 EEABMO Cc1ccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)nc1 ZINC000195546841 464074647 /nfs/dbraw/zinc/07/46/47/464074647.db2.gz FFBDJNOPPLPXDL-IEBWSBKVSA-N 1 1 339.439 2.003 40 0 EEABMO Cc1ccc(C(=O)Nc2cnc(N3CC[NH+](C)CC3)nc2)cc1C ZINC000224251609 464150310 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465321322 /nfs/dbraw/zinc/32/13/22/465321322.db2.gz VGSAHPSZIJIVLY-RHSMWYFYSA-N 1 1 336.443 2.898 40 0 EEABMO c1cnc(N2CCC[C@]3(C[N@H+](Cc4cccnc4)CCO3)CC2)nc1 ZINC000306140729 466494668 /nfs/dbraw/zinc/49/46/68/466494668.db2.gz VCHOCVNRGSRLGJ-LJQANCHMSA-N 1 1 339.443 2.133 40 0 EEABMO c1cnc(N2CCC[C@]3(C[N@@H+](Cc4cccnc4)CCO3)CC2)nc1 ZINC000306140729 466494674 /nfs/dbraw/zinc/49/46/74/466494674.db2.gz VCHOCVNRGSRLGJ-LJQANCHMSA-N 1 1 339.443 2.133 40 0 EEABMO Cn1ncnc1CN[C@H](C[N@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000390834792 467414751 /nfs/dbraw/zinc/41/47/51/467414751.db2.gz ZBTUFMWCRRVZPY-QGZVFWFLSA-N 1 1 327.476 2.378 40 0 EEABMO Cn1ncnc1C[NH2+][C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000390834792 467414754 /nfs/dbraw/zinc/41/47/54/467414754.db2.gz ZBTUFMWCRRVZPY-QGZVFWFLSA-N 1 1 327.476 2.378 40 0 EEABMO CN1C(=O)c2cccnc2O[C@H]2C[N@@H+](C3CCC(F)(F)CC3)C[C@H]21 ZINC000514290249 467942060 /nfs/dbraw/zinc/94/20/60/467942060.db2.gz WSZPDSKNIYKTDN-KGLIPLIRSA-N 1 1 337.370 2.177 40 0 biogenic,in-vitro EEABMO CCOc1ccccc1C(=O)N1CCC[C@]2(CC[N@H+]2CCOC)C1 ZINC000585102359 468970805 /nfs/dbraw/zinc/97/08/05/468970805.db2.gz YFWQGDSYTVKRBH-IBGZPJMESA-N 1 1 332.444 2.412 40 0 EEABMO Cc1ccccc1OC[C@@]1(O)COCC[N@@H+](Cc2ncccc2C)C1 ZINC000585275277 468999764 /nfs/dbraw/zinc/99/97/64/468999764.db2.gz BVAQNANFYYCCFF-FQEVSTJZSA-N 1 1 342.439 2.341 40 0 EEABMO Cc1ccccc1OC[C@@]1(O)COCC[N@H+](Cc2ncccc2C)C1 ZINC000585275277 468999765 /nfs/dbraw/zinc/99/97/65/468999765.db2.gz BVAQNANFYYCCFF-FQEVSTJZSA-N 1 1 342.439 2.341 40 0 EEABMO COc1ccc2[nH]c([C@H]3CC[N@H+](C4CCN(C(C)=O)CC4)C3)nc2c1 ZINC000035446821 213028253 /nfs/dbraw/zinc/02/82/53/213028253.db2.gz PJZDXWMPQPXDLG-AWEZNQCLSA-N 1 1 342.443 2.372 40 0 biogenic,in-vitro EEABMO COc1ccc2nc([C@H]3CC[N@@H+](C4CCN(C(C)=O)CC4)C3)[nH]c2c1 ZINC000035446821 213028257 /nfs/dbraw/zinc/02/82/57/213028257.db2.gz PJZDXWMPQPXDLG-AWEZNQCLSA-N 1 1 342.443 2.372 40 0 biogenic,in-vitro EEABMO COc1ccc2nc([C@H]3CC[N@H+](C4CCN(C(C)=O)CC4)C3)[nH]c2c1 ZINC000035446821 213028261 /nfs/dbraw/zinc/02/82/61/213028261.db2.gz PJZDXWMPQPXDLG-AWEZNQCLSA-N 1 1 342.443 2.372 40 0 biogenic,in-vitro EEABMO Cc1ccc(N2CCCC2=O)c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000073476736 216389245 /nfs/dbraw/zinc/38/92/45/216389245.db2.gz LTGAWPPBRQHKHS-MRXNPFEDSA-N 1 1 341.455 2.336 40 0 EEABMO COC[C@@]1([NH3+])[C@@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000218598812 241333399 /nfs/dbraw/zinc/33/33/99/241333399.db2.gz BKDRSCVPSOMDNX-OKZBNKHCSA-N 1 1 349.427 2.418 40 0 EEABMO CCOc1ccccc1C[N@@H+]1CCN(Cc2nccc(N)n2)[C@H](C)C1 ZINC000225649774 241969364 /nfs/dbraw/zinc/96/93/64/241969364.db2.gz IRLPKVLGEFTFKS-OAHLLOKOSA-N 1 1 341.459 2.164 40 0 EEABMO CCOc1ccccc1C[N@H+]1CCN(Cc2nccc(N)n2)[C@H](C)C1 ZINC000225649774 241969368 /nfs/dbraw/zinc/96/93/68/241969368.db2.gz IRLPKVLGEFTFKS-OAHLLOKOSA-N 1 1 341.459 2.164 40 0 EEABMO CC(C)c1ccccc1O[C@@H](C)C(=O)NCCC[NH+]1CCOCC1 ZINC000020481763 212136879 /nfs/dbraw/zinc/13/68/79/212136879.db2.gz BBLMCJVXSCUVGU-INIZCTEOSA-N 1 1 334.460 2.416 40 0 EEABMO Cc1nc2sccn2c1C[N@@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1 ZINC000257209969 244146622 /nfs/dbraw/zinc/14/66/22/244146622.db2.gz BSOOFIVYEZKFNM-HZPDHXFCSA-N 1 1 329.425 2.328 40 0 EEABMO Cc1nc2sccn2c1C[N@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1 ZINC000257209969 244146625 /nfs/dbraw/zinc/14/66/25/244146625.db2.gz BSOOFIVYEZKFNM-HZPDHXFCSA-N 1 1 329.425 2.328 40 0 EEABMO CNC(=O)c1cc(C[C@@H]2CCC[N@@H+](Cc3cccnc3)CC2)ncn1 ZINC000257238612 244236819 /nfs/dbraw/zinc/23/68/19/244236819.db2.gz HLUQIVIABRXTPI-OAHLLOKOSA-N 1 1 339.443 2.076 40 0 EEABMO C[C@H]1C[N@H+]2C[C@H](O)C[C@@H]2CN1Cc1cccn1-c1ccc(F)cc1 ZINC000019575975 212045111 /nfs/dbraw/zinc/04/51/11/212045111.db2.gz YUCPVUGLAQGFPN-GDIGMMSISA-N 1 1 329.419 2.256 40 0 EEABMO COc1ccc(C[N@H+]2CCc3nc(-c4ccncc4)[nH]c(=O)c3C2)cc1 ZINC000019555584 212043078 /nfs/dbraw/zinc/04/30/78/212043078.db2.gz RZQQESNJPDRUCN-UHFFFAOYSA-N 1 1 348.406 2.399 40 0 EEABMO Cc1ccc([C@@H](CNC(=O)C(=O)Nc2ccccc2)[NH+]2CCCC2)o1 ZINC000078393906 217046885 /nfs/dbraw/zinc/04/68/85/217046885.db2.gz VRYALDHQSQHEEO-MRXNPFEDSA-N 1 1 341.411 2.480 40 0 EEABMO CN(C)c1cc[nH+]c(N2CCC(NC(=O)NC3CCCCC3)CC2)n1 ZINC000091458332 218008711 /nfs/dbraw/zinc/00/87/11/218008711.db2.gz QUECNERUVWGDGL-UHFFFAOYSA-N 1 1 346.479 2.143 40 0 EEABMO Cc1nn(C)c(C)c1C(=O)N1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000095437743 218381087 /nfs/dbraw/zinc/38/10/87/218381087.db2.gz LGEAKOFVUJBWIW-UHFFFAOYSA-N 1 1 333.823 2.048 40 0 EEABMO CC(=O)Nc1ccccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000095438995 218383319 /nfs/dbraw/zinc/38/33/19/218383319.db2.gz KMQPRGIYRYIJCF-GOSISDBHSA-N 1 1 340.423 2.443 40 0 EEABMO COC[C@@H](C)n1c(C)cc(C(=O)C[N@@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)c1C ZINC000195537356 285217707 /nfs/dbraw/zinc/21/77/07/285217707.db2.gz HMSKDLNALLBQSN-BJJXKVORSA-N 1 1 349.475 2.081 40 0 EEABMO COC[C@@H](C)n1c(C)cc(C(=O)C[N@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)c1C ZINC000195537356 285217708 /nfs/dbraw/zinc/21/77/08/285217708.db2.gz HMSKDLNALLBQSN-BJJXKVORSA-N 1 1 349.475 2.081 40 0 EEABMO Cn1c2ccc(F)cc2[nH+]c1NCc1cn(Cc2cccnc2)nn1 ZINC000097379545 323323067 /nfs/dbraw/zinc/32/30/67/323323067.db2.gz LPGSGTLGYFYDNL-UHFFFAOYSA-N 1 1 337.362 2.359 40 0 EEABMO C[C@@H](CNC(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)[N@@H+](C)C1CC1 ZINC000163142185 463566521 /nfs/dbraw/zinc/56/65/21/463566521.db2.gz IVXXMWAJYCNGAG-GXTWGEPZSA-N 1 1 346.479 2.054 40 0 EEABMO C[C@@H](CNC(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)[N@H+](C)C1CC1 ZINC000163142185 463566526 /nfs/dbraw/zinc/56/65/26/463566526.db2.gz IVXXMWAJYCNGAG-GXTWGEPZSA-N 1 1 346.479 2.054 40 0 EEABMO C[C@@H](CNC(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)[N@@H+](C)C1CC1 ZINC000163142185 463566531 /nfs/dbraw/zinc/56/65/31/463566531.db2.gz IVXXMWAJYCNGAG-GXTWGEPZSA-N 1 1 346.479 2.054 40 0 EEABMO O=C(C[N@@H+]1CCC[C@H](CO)C1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000075617490 462741203 /nfs/dbraw/zinc/74/12/03/462741203.db2.gz BDRFOZQVONMEFT-INIZCTEOSA-N 1 1 348.462 2.458 40 0 EEABMO COc1cccc(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)c1 ZINC000047227675 462757166 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c1csc(CN2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC000096082358 463170941 /nfs/dbraw/zinc/17/09/41/463170941.db2.gz JIXMCNDVOQNPME-IAGOWNOFSA-N 1 1 344.484 2.261 40 0 EEABMO Cc1cc(C(=O)N2C[C@@H]3C[N@@H+](Cc4ccco4)CCO[C@@H]3C2)c(C)o1 ZINC000096108154 463175977 /nfs/dbraw/zinc/17/59/77/463175977.db2.gz IGGHIROSFDMTNL-MAUKXSAKSA-N 1 1 344.411 2.462 40 0 EEABMO Cn1cccc1C[N@H+]1CC[C@]2(C1)CCCN(c1ncc(F)cn1)C2 ZINC000096158296 463189058 /nfs/dbraw/zinc/18/90/58/463189058.db2.gz BBFBGHGMMMZVEB-SFHVURJKSA-N 1 1 329.423 2.447 40 0 EEABMO Cc1cccc(N2CC[C@]3(C2)CCCN(C(=O)c2cnccn2)C3)[nH+]1 ZINC000096158198 463189072 /nfs/dbraw/zinc/18/90/72/463189072.db2.gz MLXVKCSDDBKFHM-IBGZPJMESA-N 1 1 337.427 2.313 40 0 EEABMO Cc1ccc(C[N@@H+]2C[C@H](NC(=O)c3cscn3)[C@@H]3OCCC[C@@H]32)o1 ZINC000096185950 463197474 /nfs/dbraw/zinc/19/74/74/463197474.db2.gz PLZFBXGAGHEVIA-BPUTZDHNSA-N 1 1 347.440 2.206 40 0 EEABMO Cc1ccc(C[N@H+]2C[C@H](NC(=O)c3cscn3)[C@@H]3OCCC[C@@H]32)o1 ZINC000096185950 463197479 /nfs/dbraw/zinc/19/74/79/463197479.db2.gz PLZFBXGAGHEVIA-BPUTZDHNSA-N 1 1 347.440 2.206 40 0 EEABMO CN(Cc1cncnc1)[C@H]1C[N@@H+](Cc2ccsc2)[C@@H]2CCCO[C@@H]21 ZINC000096186922 463198674 /nfs/dbraw/zinc/19/86/74/463198674.db2.gz IPFAUCHHBYOLCE-SQNIBIBYSA-N 1 1 344.484 2.402 40 0 EEABMO COC[C@H]1CCC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)[N@H+]1C ZINC000096209504 463213486 /nfs/dbraw/zinc/21/34/86/463213486.db2.gz HRYROJCJVOANRF-QGZVFWFLSA-N 1 1 346.471 2.340 40 0 EEABMO Cc1ccnc(OC[C@H]2Cn3cncc3C[N@@H+](CC3CCC3)C2)n1 ZINC000096220217 463217492 /nfs/dbraw/zinc/21/74/92/463217492.db2.gz RDMGUWRPQXEHTP-MRXNPFEDSA-N 1 1 327.432 2.292 40 0 EEABMO O=C(c1ccccn1)N1CCC2(C=C[C@H]([NH+]3CCOCC3)CC2)CC1 ZINC000096240278 463224212 /nfs/dbraw/zinc/22/42/12/463224212.db2.gz URGNTJJIKKLWSZ-KRWDZBQOSA-N 1 1 341.455 2.355 40 0 EEABMO COCC[N@H+]1CC[C@H](NC(=O)/C=C/c2cn(C)c3ccccc23)C1 ZINC000096430950 463260374 /nfs/dbraw/zinc/26/03/74/463260374.db2.gz PTBZQCNQMAWYKQ-WAVCKPEOSA-N 1 1 327.428 2.028 40 0 EEABMO 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O=S1(=O)CC[C@@H]([NH2+]C[C@H](O)c2ccco2)c2cc(Cl)ccc21 ZINC000155018075 462836496 /nfs/dbraw/zinc/83/64/96/462836496.db2.gz ISWJWOSSBHGOHK-OLZOCXBDSA-N 1 1 341.816 2.475 40 0 EEABMO C[N@@H+](Cc1ccco1)[C@@H]1CN(c2ncccn2)C[C@@H]2CCCO[C@H]12 ZINC000096040674 463145130 /nfs/dbraw/zinc/14/51/30/463145130.db2.gz XHKMWCFEMNXBCT-UAGQMJEPSA-N 1 1 328.416 2.185 40 0 EEABMO O=C(C[C@@H]1COC[C@H]2C[N@@H+](Cc3ccoc3)C[C@H]21)Nc1cccnc1 ZINC000096040867 463145293 /nfs/dbraw/zinc/14/52/93/463145293.db2.gz UQTPRCLEPFCXMF-NUJGCVRESA-N 1 1 341.411 2.398 40 0 EEABMO COc1ccc(C[N@H+]2C[C@@H](C(=O)N3CCCC3)C[C@H]3OCC[C@H]32)cc1 ZINC000096057609 463159311 /nfs/dbraw/zinc/15/93/11/463159311.db2.gz WMIFYSGOZOSVJH-QXAKKESOSA-N 1 1 344.455 2.297 40 0 EEABMO C[C@H]1C[N@@H+](Cc2ccncc2)CC[C@]12CC[C@@H](C(=O)NCC1CC1)O2 ZINC000096061299 463161000 /nfs/dbraw/zinc/16/10/00/463161000.db2.gz SUINCIKBJCAYMO-ZAAXVRCTSA-N 1 1 343.471 2.367 40 0 EEABMO O=C(Nc1cnccn1)[C@@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2cccs2)O1 ZINC000096065352 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/nfs/dbraw/zinc/15/67/94/216156794.db2.gz UDDYDAGEKVJNBO-CABCVRRESA-N 1 1 344.459 2.057 40 0 EEABMO C[C@@H]1CCCN(c2nc3c(c(=O)[nH]2)CC[N@@H+](C[C@@H]2CCC=CO2)C3)C1 ZINC000072335624 216156797 /nfs/dbraw/zinc/15/67/97/216156797.db2.gz UDDYDAGEKVJNBO-CABCVRRESA-N 1 1 344.459 2.057 40 0 EEABMO CN(C)C(=O)C[N@H+]1[C@H](c2ccccc2F)C[C@H]2NC(=O)CCCC[C@@H]21 ZINC000257247003 244261162 /nfs/dbraw/zinc/26/11/62/244261162.db2.gz IWXSBIYUKHZNTF-IKGGRYGDSA-N 1 1 347.434 2.088 40 0 EEABMO CN(C)C(=O)C[N@@H+]1[C@H](c2ccccc2F)C[C@H]2NC(=O)CCCC[C@@H]21 ZINC000257247003 244261166 /nfs/dbraw/zinc/26/11/66/244261166.db2.gz IWXSBIYUKHZNTF-IKGGRYGDSA-N 1 1 347.434 2.088 40 0 EEABMO Cc1[nH+]ccn1CCCCNS(=O)(=O)c1ccc(C)c(F)c1 ZINC000096428251 218801181 /nfs/dbraw/zinc/80/11/81/218801181.db2.gz KCMQKBKKAQELEO-UHFFFAOYSA-N 1 1 325.409 2.398 40 0 EEABMO CC[NH+]1CCN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccc(C)cc2)CC1 ZINC000072238246 285300246 /nfs/dbraw/zinc/30/02/46/285300246.db2.gz CSARYEUKLOWHAF-MJGOQNOKSA-N 1 1 343.471 2.069 40 0 EEABMO C[C@@H]1CN(c2nc3c(c(=O)[nH]2)CC[N@H+](C2CCCCC2)C3)C[C@H](C)O1 ZINC000072335683 274367467 /nfs/dbraw/zinc/36/74/67/274367467.db2.gz HDXZYIVKMCSEBC-OKILXGFUSA-N 1 1 346.475 2.487 40 0 EEABMO CC[N@H+]1CCO[C@@H]2CN(C(=O)c3ccnc4ccccc43)C[C@@H]2C1 ZINC000096107966 276207706 /nfs/dbraw/zinc/20/77/06/276207706.db2.gz XAFKHDVIPSVIFZ-KBXCAEBGSA-N 1 1 325.412 2.028 40 0 EEABMO COC(=O)CCC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000096413970 277315360 /nfs/dbraw/zinc/31/53/60/277315360.db2.gz MTYDOTYAEIOEEL-RDJZCZTQSA-N 1 1 332.444 2.451 40 0 EEABMO C[C@H]1Oc2ccccc2O[C@@H]1C(=O)N1CC[N@@H+](C)CC12CCCC2 ZINC000085472733 280081695 /nfs/dbraw/zinc/08/16/95/280081695.db2.gz HAXWYQQIZVHAQU-PBHICJAKSA-N 1 1 330.428 2.302 40 0 EEABMO Cc1nc([C@H]2CCCC[NH2+]2)nc2c1CCC(=O)N2Cc1ccccn1 ZINC000257295453 281999396 /nfs/dbraw/zinc/99/93/96/281999396.db2.gz QYIODVVPPOUMCY-MRXNPFEDSA-N 1 1 337.427 2.474 40 0 EEABMO C[C@H]1CN(C)CC[N@H+]1CC1CCN(C(=O)NC2CCCCC2)CC1 ZINC000085468314 462548869 /nfs/dbraw/zinc/54/88/69/462548869.db2.gz PQGXCDQSWXQZRY-INIZCTEOSA-N 1 1 336.524 2.377 40 0 EEABMO C[C@@H]1CN(C)CC[N@H+]1CC1CCN(C(=O)NC2CCCCC2)CC1 ZINC000085468309 462549422 /nfs/dbraw/zinc/54/94/22/462549422.db2.gz PQGXCDQSWXQZRY-MRXNPFEDSA-N 1 1 336.524 2.377 40 0 EEABMO C[N@@H+](CCN1CCCC1=O)C[C@@](C)(O)c1ccccc1C(F)(F)F ZINC000075742369 462756432 /nfs/dbraw/zinc/75/64/32/462756432.db2.gz FTKFFEKKKWOJAD-MRXNPFEDSA-N 1 1 344.377 2.467 40 0 EEABMO O=C(C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccccc1)NCc1cccnc1 ZINC000076075136 462801652 /nfs/dbraw/zinc/80/16/52/462801652.db2.gz KFJLAMUQHCIYSP-MOPGFXCFSA-N 1 1 339.439 2.286 40 0 EEABMO CCOC(=O)Cc1csc(NC(=O)C[NH+]2CCCCCC2)n1 ZINC000016740517 462990089 /nfs/dbraw/zinc/99/00/89/462990089.db2.gz ZGRGZPPWFYMPNR-UHFFFAOYSA-N 1 1 325.434 2.063 40 0 EEABMO O=C(NCc1ccco1)[C@@H]1C[N@@H+](Cc2cccs2)C[C@H]2OCC[C@H]21 ZINC000096038895 463143875 /nfs/dbraw/zinc/14/38/75/463143875.db2.gz HMNQPWBMPXTZJT-GVDBMIGSSA-N 1 1 346.452 2.494 40 0 EEABMO Cc1noc([C@@H]2C[C@@H]3CC[N@H+](Cc4ccc5c(c4)OCO5)C[C@H]3O2)n1 ZINC000096042965 463147237 /nfs/dbraw/zinc/14/72/37/463147237.db2.gz OJABJQFQIZTDAW-RRQGHBQHSA-N 1 1 343.383 2.459 40 0 EEABMO Cc1noc([C@@H]2C[C@@H]3CC[N@@H+](Cc4ccc5c(c4)OCO5)C[C@H]3O2)n1 ZINC000096042965 463147241 /nfs/dbraw/zinc/14/72/41/463147241.db2.gz OJABJQFQIZTDAW-RRQGHBQHSA-N 1 1 343.383 2.459 40 0 EEABMO Cc1ccc(C[N@@H+]2CC[C@@]3(CCN(c4cnn(C)c4)C3=O)C2)s1 ZINC000096050522 463154981 /nfs/dbraw/zinc/15/49/81/463154981.db2.gz KGBZDPZHHREVHB-QGZVFWFLSA-N 1 1 330.457 2.419 40 0 EEABMO O=C(N[C@H]1CCC12CC[NH+](Cc1nccs1)CC2)c1cnccn1 ZINC000096051487 463155497 /nfs/dbraw/zinc/15/54/97/463155497.db2.gz SWSXMBLKVNJDBZ-AWEZNQCLSA-N 1 1 343.456 2.108 40 0 EEABMO c1cncc(CO[C@@H]2C[N@@H+](Cc3ccncc3)[C@H]3CCCO[C@H]23)c1 ZINC000096058101 463160545 /nfs/dbraw/zinc/16/05/45/463160545.db2.gz UTECPVGEXDFIFF-OTWHNJEPSA-N 1 1 325.412 2.425 40 0 EEABMO O=C([C@H]1C[C@@H]2CC[N@@H+](Cc3ccsc3)C[C@H]2O1)N1CCCCO1 ZINC000096066154 463164121 /nfs/dbraw/zinc/16/41/21/463164121.db2.gz JBKUFRDRFGSURZ-ARFHVFGLSA-N 1 1 336.457 2.282 40 0 EEABMO c1csc(CN2CCOC[C@@]3(CC[N@H+](C4CCOCC4)C3)C2)c1 ZINC000096202032 463206717 /nfs/dbraw/zinc/20/67/17/463206717.db2.gz MXAVJJUNPUHLGY-SFHVURJKSA-N 1 1 336.501 2.451 40 0 EEABMO Cn1ccnc1CN1CC[C@@]2(C1)COCC[N@@H+](Cc1ccsc1)C2 ZINC000096202070 463207679 /nfs/dbraw/zinc/20/76/79/463207679.db2.gz BFHJDIWEDLZKRM-SFHVURJKSA-N 1 1 346.500 2.206 40 0 EEABMO c1cncc(C[N@H+]2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)c1 ZINC000096206075 463208626 /nfs/dbraw/zinc/20/86/26/463208626.db2.gz ORWURBLONVRJCE-QAPCUYQASA-N 1 1 326.400 2.033 40 0 EEABMO O=C(C[C@H]1OC[C@H]2C[N@@H+](Cc3cccc(F)c3)CC[C@@H]12)N1CCCO1 ZINC000096207155 463209671 /nfs/dbraw/zinc/20/96/71/463209671.db2.gz LUZIDHURBBTEFD-KBAYOESNSA-N 1 1 348.418 2.217 40 0 EEABMO COC[C@H]1CC2(C[N@H+]1Cc1ccncc1)CCN(C(=O)N(C)C)CC2 ZINC000096215746 463213242 /nfs/dbraw/zinc/21/32/42/463213242.db2.gz NLFKTNLQGLFZIR-QGZVFWFLSA-N 1 1 346.475 2.066 40 0 EEABMO Fc1ccc(C[N@H+]2CC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 ZINC000096219386 463215786 /nfs/dbraw/zinc/21/57/86/463215786.db2.gz BIWIINKJSKJOIO-SJLPKXTDSA-N 1 1 328.391 2.461 40 0 EEABMO C[N@H+]1CCOC[C@]2(CCCN(C(=O)c3cc4ccccc4[nH]3)C2)C1 ZINC000096228712 463222593 /nfs/dbraw/zinc/22/25/93/463222593.db2.gz LORPLKQJCNXETK-LJQANCHMSA-N 1 1 327.428 2.352 40 0 EEABMO c1ccc(CN2CC[C@@H]3C[N@@H+](Cc4ccncc4)CCO[C@@H]3C2)nc1 ZINC000096249710 463226837 /nfs/dbraw/zinc/22/68/37/463226837.db2.gz XXRLBMQQKWAHHE-UYAOXDASSA-N 1 1 338.455 2.200 40 0 EEABMO COc1ncccc1C[N@H+]1CCc2ncnc(NC(C)C)c2CC1 ZINC000096255516 463228953 /nfs/dbraw/zinc/22/89/53/463228953.db2.gz FXSCWKWLNFZUQM-UHFFFAOYSA-N 1 1 327.432 2.301 40 0 EEABMO C[C@@H](c1ccc(NC(=O)NCCn2ccnc2)cc1)[NH+]1CCOCC1 ZINC000096410659 463244298 /nfs/dbraw/zinc/24/42/98/463244298.db2.gz KPHXSJHNFHQUFZ-HNNXBMFYSA-N 1 1 343.431 2.098 40 0 EEABMO CCn1cc(S(=O)(=O)Nc2ccc(CC[NH+]3CCCC3)cc2)cn1 ZINC000096413662 463245865 /nfs/dbraw/zinc/24/58/65/463245865.db2.gz WNEMBCVDETVVAB-UHFFFAOYSA-N 1 1 348.472 2.342 40 0 EEABMO Cc1nn2cccnc2c1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000096443942 463269536 /nfs/dbraw/zinc/26/95/36/463269536.db2.gz DIGJAWDEOAZHQV-CABCVRRESA-N 1 1 327.432 2.125 40 0 EEABMO C[C@H]1C[C@H](NC(=O)NCc2nccn2C)CC[N@H+]1Cc1ccccc1 ZINC000080114161 463283615 /nfs/dbraw/zinc/28/36/15/463283615.db2.gz MSWFHTKQORVWDB-DOTOQJQBSA-N 1 1 341.459 2.272 40 0 EEABMO Cc1ccc(N2CCC(NC(=O)N[C@H](CCO)C(C)(C)C)CC2)[nH+]c1 ZINC000097100747 463324152 /nfs/dbraw/zinc/32/41/52/463324152.db2.gz LTCZBOJAFCTSBG-MRXNPFEDSA-N 1 1 348.491 2.455 40 0 EEABMO C[NH+]1CCN(C(=S)N(C(=O)c2ccco2)c2ccccc2)CC1 ZINC000031852194 463356945 /nfs/dbraw/zinc/35/69/45/463356945.db2.gz CEHLJIIQIJKHFN-UHFFFAOYSA-N 1 1 329.425 2.459 40 0 EEABMO COc1cccc(/C(C)=C/C(=O)N2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC000081571315 463463525 /nfs/dbraw/zinc/46/35/25/463463525.db2.gz YOVPOCYTCLUAAQ-NRMGUKERSA-N 1 1 344.455 2.422 40 0 EEABMO COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)cc1OC ZINC000072228195 463483726 /nfs/dbraw/zinc/48/37/26/463483726.db2.gz BRDHYEAURDXBIC-IRXDYDNUSA-N 1 1 330.359 2.254 40 0 EEABMO COc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc(OC)c(OC)c2)c1 ZINC000072227731 463484333 /nfs/dbraw/zinc/48/43/33/463484333.db2.gz OJUTVOBEXONIMX-IRXDYDNUSA-N 1 1 328.368 2.128 40 0 EEABMO COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2Cc2ccc(OC)c(OC)c2)cc1 ZINC000072227043 463484461 /nfs/dbraw/zinc/48/44/61/463484461.db2.gz XIHXRPLNNYKDAJ-MSOLQXFVSA-N 1 1 342.395 2.123 40 0 EEABMO CN(C)C(=O)C[N@@H+]1CCCC[C@@H]1c1nc(N)ncc1-c1ccccc1 ZINC000072377009 463509461 /nfs/dbraw/zinc/50/94/61/463509461.db2.gz FXKJTUPDLGAFLQ-MRXNPFEDSA-N 1 1 339.443 2.341 40 0 EEABMO CN(C)C(=O)C[N@H+]1CCCC[C@@H]1c1nc(N)ncc1-c1ccccc1 ZINC000072377009 463509463 /nfs/dbraw/zinc/50/94/63/463509463.db2.gz FXKJTUPDLGAFLQ-MRXNPFEDSA-N 1 1 339.443 2.341 40 0 EEABMO Cc1ccc(CN2CC[N@H+]3C[C@@H](OCc4ccccn4)C[C@@H]3C2)o1 ZINC000107746842 463581425 /nfs/dbraw/zinc/58/14/25/463581425.db2.gz DAQCBLTXJHHDTH-MJGOQNOKSA-N 1 1 327.428 2.458 40 0 EEABMO Cc1cccc(N2CCC[C@@H](NC(=O)CCCn3ccnc3)C2)[nH+]1 ZINC000257298955 463767856 /nfs/dbraw/zinc/76/78/56/463767856.db2.gz ROBABPICEWUOFS-MRXNPFEDSA-N 1 1 327.432 2.152 40 0 EEABMO O[C@H]1CN(Cc2c[nH]cn2)CC[C@@]12CCC[N@H+]2Cc1ccccc1 ZINC000257301155 463768859 /nfs/dbraw/zinc/76/88/59/463768859.db2.gz RXFDSGGTAMFLET-OALUTQOASA-N 1 1 326.444 2.011 40 0 EEABMO O[C@H]1CN(Cc2cnc[nH]2)CC[C@@]12CCC[N@@H+]2Cc1ccccc1 ZINC000257301155 463768862 /nfs/dbraw/zinc/76/88/62/463768862.db2.gz RXFDSGGTAMFLET-OALUTQOASA-N 1 1 326.444 2.011 40 0 EEABMO O[C@H]1CN(Cc2cnc[nH]2)CC[C@@]12CCC[N@H+]2Cc1ccccc1 ZINC000257301155 463768869 /nfs/dbraw/zinc/76/88/69/463768869.db2.gz RXFDSGGTAMFLET-OALUTQOASA-N 1 1 326.444 2.011 40 0 EEABMO COc1cc(C[N@H+]2CC[C@H](c3nc(CNC(C)=O)c[nH]3)C2)ccc1F ZINC000257322448 463777641 /nfs/dbraw/zinc/77/76/41/463777641.db2.gz WGAXDIIVKGHROI-AWEZNQCLSA-N 1 1 346.406 2.183 40 0 EEABMO COc1cc(C[N@@H+]2CC[C@H](c3ncc(CNC(C)=O)[nH]3)C2)ccc1F ZINC000257322448 463777647 /nfs/dbraw/zinc/77/76/47/463777647.db2.gz WGAXDIIVKGHROI-AWEZNQCLSA-N 1 1 346.406 2.183 40 0 EEABMO COc1cc(C[N@H+]2CC[C@H](c3ncc(CNC(C)=O)[nH]3)C2)ccc1F ZINC000257322448 463777655 /nfs/dbraw/zinc/77/76/55/463777655.db2.gz WGAXDIIVKGHROI-AWEZNQCLSA-N 1 1 346.406 2.183 40 0 EEABMO CN(C)c1ncc(C[N@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)cn1 ZINC000257343537 463787798 /nfs/dbraw/zinc/78/77/98/463787798.db2.gz ZTKOLXCYPJOADG-HNNXBMFYSA-N 1 1 337.431 2.194 40 0 EEABMO COc1cc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)ncn1 ZINC000276989892 463832961 /nfs/dbraw/zinc/83/29/61/463832961.db2.gz GPNMSGQEPVZZEE-INIZCTEOSA-N 1 1 328.416 2.188 40 0 EEABMO CCc1nn(C)c(OC)c1C[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000195556668 464076066 /nfs/dbraw/zinc/07/60/66/464076066.db2.gz OJLYAFMJZZDFTD-AWEZNQCLSA-N 1 1 331.464 2.179 40 0 EEABMO C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)NCCC[NH+]1CCOCC1 ZINC000223344570 464140149 /nfs/dbraw/zinc/14/01/49/464140149.db2.gz KSRVKVDODPYTDR-MRXNPFEDSA-N 1 1 346.471 2.171 40 0 EEABMO Cc1cccc(COC[C@H]2C[N@@H+](C3CCOCC3)Cc3ccnn32)n1 ZINC000247850374 464709543 /nfs/dbraw/zinc/70/95/43/464709543.db2.gz AEYREUQENOSJIN-LJQANCHMSA-N 1 1 342.443 2.339 40 0 EEABMO Cc1cccc(COC[C@H]2C[N@H+](C3CCOCC3)Cc3ccnn32)n1 ZINC000247850374 464709546 /nfs/dbraw/zinc/70/95/46/464709546.db2.gz AEYREUQENOSJIN-LJQANCHMSA-N 1 1 342.443 2.339 40 0 EEABMO Cn1cnc2c1[C@@H](C(=O)NCCc1cccs1)C[N@@H+](CC1CC1)C2 ZINC000248005774 464722305 /nfs/dbraw/zinc/72/23/05/464722305.db2.gz BWNCFNRACQFFKD-HNNXBMFYSA-N 1 1 344.484 2.150 40 0 EEABMO C[N@H+](Cc1ccccn1)[C@@H]1CO[C@]2(C1)CCCN(C(=O)C1CC1)C2 ZINC000248136032 464731995 /nfs/dbraw/zinc/73/19/95/464731995.db2.gz RSJSNVHSDVMUCB-HKUYNNGSSA-N 1 1 329.444 2.074 40 0 EEABMO C[N@@H+](Cc1ccccn1)[C@@H]1CO[C@]2(C1)CCCN(C(=O)C1CC1)C2 ZINC000248136032 464732002 /nfs/dbraw/zinc/73/20/02/464732002.db2.gz RSJSNVHSDVMUCB-HKUYNNGSSA-N 1 1 329.444 2.074 40 0 EEABMO CC[C@H](C)[C@H](NC(=O)N1CC[N@@H+](C[C@H](C)O)C[C@@H]1C)C(F)(F)F ZINC000252501474 464972924 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C[NH+](C)Cc1c[nH]c([C@@H]2CC[N@H+](Cc3cccc(C(=O)[O-])c3)C2)n1 ZINC000257319887 463777047 /nfs/dbraw/zinc/77/70/47/463777047.db2.gz VULHEQROPOYIIP-OAHLLOKOSA-N 1 1 328.416 2.159 40 0 EEABMO C[NH+](C)Cc1c[nH]c([C@@H]2CC[N@@H+](Cc3cccc(C(=O)[O-])c3)C2)n1 ZINC000257319887 463777050 /nfs/dbraw/zinc/77/70/50/463777050.db2.gz VULHEQROPOYIIP-OAHLLOKOSA-N 1 1 328.416 2.159 40 0 EEABMO C[NH+](C)Cc1cnc([C@@H]2CC[N@H+](Cc3cccc(C(=O)[O-])c3)C2)[nH]1 ZINC000257319887 463777052 /nfs/dbraw/zinc/77/70/52/463777052.db2.gz VULHEQROPOYIIP-OAHLLOKOSA-N 1 1 328.416 2.159 40 0 EEABMO C[NH+](C)Cc1cnc([C@@H]2CC[N@@H+](Cc3cccc(C(=O)[O-])c3)C2)[nH]1 ZINC000257319887 463777056 /nfs/dbraw/zinc/77/70/56/463777056.db2.gz VULHEQROPOYIIP-OAHLLOKOSA-N 1 1 328.416 2.159 40 0 EEABMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)C(=O)Nc2ccccc2Cl)C1 ZINC000195574251 464080077 /nfs/dbraw/zinc/08/00/77/464080077.db2.gz ZMMCFJZANGHAPP-SWLSCSKDSA-N 1 1 335.835 2.221 40 0 EEABMO COc1cccc(C[N@H+]2CC[C@@H](CO)N(C)c3ncccc3C2)c1 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/nfs/dbraw/zinc/16/05/64/463160564.db2.gz ZPNUVRFQSLINHT-NUEKZKHPSA-N 1 1 336.457 2.282 40 0 EEABMO O=C(NCC1CC1)[C@@H]1CCC2(CC[NH+](Cc3nccs3)CC2)O1 ZINC000096061169 463161385 /nfs/dbraw/zinc/16/13/85/463161385.db2.gz NJSLCZJACHUNKC-AWEZNQCLSA-N 1 1 335.473 2.183 40 0 EEABMO CO[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]2C[N@@H+](CC3CC3)C[C@@H]21 ZINC000096109436 463178716 /nfs/dbraw/zinc/17/87/16/463178716.db2.gz PNOLPCSTPDBWPL-KSZLIROESA-N 1 1 332.419 2.397 40 0 EEABMO COC(=O)c1ccc2[nH]c(CO[C@H]3C[N@@H+](CC4CC4)C[C@H]3F)nc2c1 ZINC000096112386 463179241 /nfs/dbraw/zinc/17/92/41/463179241.db2.gz SVIYMOSQFPRCCU-CJNGLKHVSA-N 1 1 347.390 2.298 40 0 biogenic,in-vitro EEABMO Cc1cnc(C(=O)N2C[C@@H]3C[N@H+](Cc4cccc(F)c4)C[C@@H]3C2)cn1 ZINC000096161701 463192020 /nfs/dbraw/zinc/19/20/20/463192020.db2.gz ANWUXGGPAFHGHM-IYBDPMFKSA-N 1 1 340.402 2.128 40 0 EEABMO Cc1cccc(CN2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC000096183403 463195584 /nfs/dbraw/zinc/19/55/84/463195584.db2.gz DOYYNSPSUURTCC-VQTJNVASSA-N 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463208219 /nfs/dbraw/zinc/20/82/19/463208219.db2.gz NJPKXUWQJACXFW-WBMJQRKESA-N 1 1 332.429 2.095 40 0 EEABMO c1csc(C[N@H+]2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)n1 ZINC000096206076 463208232 /nfs/dbraw/zinc/20/82/32/463208232.db2.gz NJPKXUWQJACXFW-WBMJQRKESA-N 1 1 332.429 2.095 40 0 EEABMO Cc1noc(C)c1C[N@H+]1CC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 ZINC000096219585 463216721 /nfs/dbraw/zinc/21/67/21/463216721.db2.gz RWJMRDNVWIEKJO-YOEHRIQHSA-N 1 1 347.394 2.066 40 0 EEABMO Cc1nc(C[N@@H+]2CCC[C@@]3(CCN(c4cnn(C)c4)C3=O)C2)cs1 ZINC000096224637 463220923 /nfs/dbraw/zinc/22/09/23/463220923.db2.gz AWNALDAPGQHTBI-QGZVFWFLSA-N 1 1 345.472 2.204 40 0 EEABMO COc1ccc(NC(=O)NC[C@@H](c2cnn(C)c2)[NH+](C)C)cc1C ZINC000096410609 463243668 /nfs/dbraw/zinc/24/36/68/463243668.db2.gz GWOTWFWDWGVOFC-HNNXBMFYSA-N 1 1 331.420 2.162 40 0 EEABMO Cc1csc(CNC(=O)C[C@@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000096435937 463263718 /nfs/dbraw/zinc/26/37/18/463263718.db2.gz RBXCOLBITMMJJQ-MRXNPFEDSA-N 1 1 345.468 2.359 40 0 EEABMO Cc1csc(CNC(=O)C[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000096435937 463263723 /nfs/dbraw/zinc/26/37/23/463263723.db2.gz RBXCOLBITMMJJQ-MRXNPFEDSA-N 1 1 345.468 2.359 40 0 EEABMO NC(=O)c1cccnc1N1CCN(c2cc[nH+]c3ccsc32)CC1 ZINC000096453642 463274430 /nfs/dbraw/zinc/27/44/30/463274430.db2.gz JYBQKICOLPXZPU-UHFFFAOYSA-N 1 1 339.424 2.117 40 0 EEABMO O=C1C[C@@H]2OCC[C@H]3C[N@H+]4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 ZINC000169417630 463671632 /nfs/dbraw/zinc/67/16/32/463671632.db2.gz LUMNFZCZEDAQNJ-UYQZPRTCSA-N 1 1 336.435 2.172 40 0 EEABMO C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cncc(O)c3)CC[C@H]21 ZINC000257324797 463778064 /nfs/dbraw/zinc/77/80/64/463778064.db2.gz WQGBBHPLKQVUMR-GUDVDZBRSA-N 1 1 337.423 2.347 40 0 EEABMO Cc1noc(C)c1-c1cc([C@H]2CCC[N@H+]2CCC(N)=O)nc(C)n1 ZINC000257323752 463778504 /nfs/dbraw/zinc/77/85/04/463778504.db2.gz WLRRGHNPTGRUKG-OAHLLOKOSA-N 1 1 329.404 2.069 40 0 EEABMO CCc1ccc(O[C@@H](CC)C(=O)NCCC[NH+]2CCOCC2)cc1 ZINC000222889737 464134940 /nfs/dbraw/zinc/13/49/40/464134940.db2.gz XUTXTWUNYNWZRD-SFHVURJKSA-N 1 1 334.460 2.245 40 0 EEABMO Brc1cccnc1N1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000252480262 464960052 /nfs/dbraw/zinc/96/00/52/464960052.db2.gz BZCVYYIXYQGITQ-LBPRGKRZSA-N 1 1 326.238 2.003 40 0 EEABMO Fc1ccc2c(c1F)CN(c1nc(N[C@@H]3CCCOC3)cc[nH+]1)CC2 ZINC000333272661 466613531 /nfs/dbraw/zinc/61/35/31/466613531.db2.gz NYZPQBOGZNGTBL-CYBMUJFWSA-N 1 1 346.381 2.908 40 0 EEABMO CNC(=O)CC[C@]1(OC)CCC[N@@H+](Cc2c(F)cccc2OC)C1 ZINC000585278634 469005339 /nfs/dbraw/zinc/00/53/39/469005339.db2.gz PLJZCGZWMZBSSQ-GOSISDBHSA-N 1 1 338.423 2.342 40 0 EEABMO COCc1cc(CC2([NH2+]Cc3cnc4ccccc4c3)COC2)no1 ZINC000067897952 215245726 /nfs/dbraw/zinc/24/57/26/215245726.db2.gz KJUVAMNQHHGHQI-UHFFFAOYSA-N 1 1 339.395 2.471 40 0 biogenic,in-vitro EEABMO CS(=O)(=O)N1CCC[C@@H]1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000181009112 234061250 /nfs/dbraw/zinc/06/12/50/234061250.db2.gz HFBHVFXHWLPUCB-SJLPKXTDSA-N 1 1 345.468 2.185 40 0 EEABMO O=C(NCCC[NH+]1CCOCC1)c1ccc2sc(Cl)nc2c1 ZINC000225975421 242083066 /nfs/dbraw/zinc/08/30/66/242083066.db2.gz JDNGHUXMXVYQSW-UHFFFAOYSA-N 1 1 339.848 2.402 40 0 EEABMO Cc1nccc(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)n1 ZINC000257211713 244152650 /nfs/dbraw/zinc/15/26/50/244152650.db2.gz CABGVHPQZZNZBD-ROUUACIJSA-N 1 1 331.391 2.328 40 0 EEABMO Cc1nccc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)n1 ZINC000257211713 244152662 /nfs/dbraw/zinc/15/26/62/244152662.db2.gz CABGVHPQZZNZBD-ROUUACIJSA-N 1 1 331.391 2.328 40 0 EEABMO COCc1cccc(C(=O)N[C@@H]2CCC[C@@H](n3cc[nH+]c3C)[C@@H]2O)c1 ZINC000257246982 244257876 /nfs/dbraw/zinc/25/78/76/244257876.db2.gz IWUXKBJBBXSENC-KZNAEPCWSA-N 1 1 343.427 2.222 40 0 EEABMO CNc1cc(CC[C@@H]2CN(C(=O)c3c(C)noc3C)CCO2)cc[nH+]1 ZINC000257253537 244276573 /nfs/dbraw/zinc/27/65/73/244276573.db2.gz JZIBBTCXOHCHKF-OAHLLOKOSA-N 1 1 344.415 2.202 40 0 EEABMO CNc1cc(C)[nH+]c([C@@H]2CCN(C(=O)c3ccc4[nH]nnc4c3)C2)c1 ZINC000257274148 244386629 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CCC[N@H+]1CC[C@H](CNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)C1 ZINC000095437671 218380069 /nfs/dbraw/zinc/38/00/69/218380069.db2.gz QKIRMNZUAOMEMI-TWMKSMIVSA-N 1 1 335.492 2.365 40 0 EEABMO COC[C@H]1C[N@@H+](C)C[C@@]12CCN(C(=O)CC1Cc3ccccc3C1)C2 ZINC000096219860 218695321 /nfs/dbraw/zinc/69/53/21/218695321.db2.gz QTIZAMMIMYRUHO-TZIWHRDSSA-N 1 1 342.483 2.218 40 0 EEABMO C[NH+](C)Cc1cncc([C@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 ZINC000257278276 289226786 /nfs/dbraw/zinc/22/67/86/289226786.db2.gz OBOGJYQRJMMVSH-QGZVFWFLSA-N 1 1 346.475 2.287 40 0 EEABMO CCOC(=O)C1=C(C[N@@H+]2CCC[C@@H]2c2ccccc2)NC(=O)N[C@H]1C ZINC000095947103 463111190 /nfs/dbraw/zinc/11/11/90/463111190.db2.gz VCQJLYGZFMTEHX-XJKSGUPXSA-N 1 1 343.427 2.342 40 0 EEABMO CCOC(=O)C1=C(C[N@H+]2CCC[C@@H]2c2ccccc2)NC(=O)N[C@H]1C ZINC000095947103 463111194 /nfs/dbraw/zinc/11/11/94/463111194.db2.gz VCQJLYGZFMTEHX-XJKSGUPXSA-N 1 1 343.427 2.342 40 0 EEABMO O=C(Nc1cnccn1)[C@@H]1C[C@H]2OCC[C@H]2[N@@H+](Cc2ccsc2)C1 ZINC000096038956 463144046 /nfs/dbraw/zinc/14/40/46/463144046.db2.gz IBZQCHPQWQESDO-RBSFLKMASA-N 1 1 344.440 2.156 40 0 EEABMO O=C(C[C@@H]1COC[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]21)NCC1CC1 ZINC000096040817 463145155 /nfs/dbraw/zinc/14/51/55/463145155.db2.gz OPHGOLJBSQKDPR-ZACQAIPSSA-N 1 1 334.485 2.359 40 0 EEABMO c1cc(C[N@H+]2CCC[C@@]3(C2)COCCN(c2cnccn2)C3)co1 ZINC000096049626 463153680 /nfs/dbraw/zinc/15/36/80/463153680.db2.gz IZLVHFPVKOCKJR-SFHVURJKSA-N 1 1 328.416 2.189 40 0 EEABMO Cn1cc(C[N@H+]2CC[C@H]3O[C@@H](COCc4cccnc4)CC[C@H]32)cn1 ZINC000096056432 463158762 /nfs/dbraw/zinc/15/87/62/463158762.db2.gz GNWZNYCINTUPCR-GUDVDZBRSA-N 1 1 342.443 2.154 40 0 EEABMO Cc1cccc(C[N@H+]2CC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)n1 ZINC000096072741 463167494 /nfs/dbraw/zinc/16/74/94/463167494.db2.gz UTAPSYLGSZWIEN-FUHWJXTLSA-N 1 1 325.416 2.026 40 0 EEABMO c1ccc(CO[C@H]2CO[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC000096107814 463175736 /nfs/dbraw/zinc/17/57/36/463175736.db2.gz GCCILUSHCCVNLT-MOPGFXCFSA-N 1 1 325.412 2.427 40 0 EEABMO c1cc(C[N@H+]2CCO[C@@H]3CN(Cc4ccccn4)C[C@@H]3C2)cs1 ZINC000096108211 463176848 /nfs/dbraw/zinc/17/68/48/463176848.db2.gz RKTFVMOBVZLPBG-FUHWJXTLSA-N 1 1 329.469 2.476 40 0 EEABMO c1cc(CN2CCO[C@@H]3C[N@H+](Cc4ccccn4)C[C@@H]3C2)cs1 ZINC000096108211 463176854 /nfs/dbraw/zinc/17/68/54/463176854.db2.gz RKTFVMOBVZLPBG-FUHWJXTLSA-N 1 1 329.469 2.476 40 0 EEABMO c1cc(CN2CCO[C@@H]3C[N@@H+](Cc4ccccn4)C[C@@H]3C2)cs1 ZINC000096108211 463176861 /nfs/dbraw/zinc/17/68/61/463176861.db2.gz RKTFVMOBVZLPBG-FUHWJXTLSA-N 1 1 329.469 2.476 40 0 EEABMO Cn1cc(C[N@H+]2CC[C@@]3(C2)CCCN(Cc2ccccn2)C3)cn1 ZINC000096158030 463189686 /nfs/dbraw/zinc/18/96/86/463189686.db2.gz LBJQSVBVNZUTFD-IBGZPJMESA-N 1 1 325.460 2.303 40 0 EEABMO Cn1cc(CN2CC[C@@]3(C2)CCC[N@H+](Cc2ccccn2)C3)cn1 ZINC000096158030 463189696 /nfs/dbraw/zinc/18/96/96/463189696.db2.gz LBJQSVBVNZUTFD-IBGZPJMESA-N 1 1 325.460 2.303 40 0 EEABMO Cn1cc(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccn2)C3)cn1 ZINC000096158030 463189703 /nfs/dbraw/zinc/18/97/03/463189703.db2.gz LBJQSVBVNZUTFD-IBGZPJMESA-N 1 1 325.460 2.303 40 0 EEABMO Fc1cnc(N2CCC3(CC2)C[N@H+](Cc2ccoc2)CCO3)nc1 ZINC000096158818 463190206 /nfs/dbraw/zinc/19/02/06/463190206.db2.gz VWCLMWXKIULJNM-UHFFFAOYSA-N 1 1 332.379 2.080 40 0 EEABMO Fc1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccoc2)CCO3)nc1 ZINC000096158818 463190209 /nfs/dbraw/zinc/19/02/09/463190209.db2.gz VWCLMWXKIULJNM-UHFFFAOYSA-N 1 1 332.379 2.080 40 0 EEABMO COc1ncccc1C[N@H+]1CC[C@@]2(C1)C(=O)NC[C@H]2c1ccccc1 ZINC000096161392 463192038 /nfs/dbraw/zinc/19/20/38/463192038.db2.gz OKYVADWXIMDEJQ-PXNSSMCTSA-N 1 1 337.423 2.196 40 0 EEABMO Cc1ccc(C[N@@H+]2CC[C@H]3[C@H](CN4CCN(C)CC4)OC[C@H]3C2)cc1 ZINC000096185269 463196307 /nfs/dbraw/zinc/19/63/07/463196307.db2.gz HCUJCUYEAPRJCU-NJYVYQBISA-N 1 1 343.515 2.079 40 0 EEABMO Cc1ccc(C[N@H+]2CC[C@H]3[C@H](CN4CCN(C)CC4)OC[C@H]3C2)cc1 ZINC000096185269 463196311 /nfs/dbraw/zinc/19/63/11/463196311.db2.gz HCUJCUYEAPRJCU-NJYVYQBISA-N 1 1 343.515 2.079 40 0 EEABMO Cn1ccnc1C[N@@H+]1CC[C@@H]2O[C@@H](COCc3ccncc3)CC[C@@H]21 ZINC000096186780 463199419 /nfs/dbraw/zinc/19/94/19/463199419.db2.gz FMNQSSDQFVLFKJ-SQNIBIBYSA-N 1 1 342.443 2.154 40 0 EEABMO Cn1ccnc1C[N@H+]1CC[C@@H]2O[C@@H](COCc3ccncc3)CC[C@@H]21 ZINC000096186780 463199421 /nfs/dbraw/zinc/19/94/21/463199421.db2.gz FMNQSSDQFVLFKJ-SQNIBIBYSA-N 1 1 342.443 2.154 40 0 EEABMO Fc1cnc(N2CCOC[C@]3(CC[N@@H+](Cc4cccs4)C3)C2)nc1 ZINC000096202180 463207462 /nfs/dbraw/zinc/20/74/62/463207462.db2.gz NCKZMSXNRWXAER-KRWDZBQOSA-N 1 1 348.447 2.406 40 0 EEABMO Cc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CO[C@H]3CC(=O)N3CCCC3)C2)o1 ZINC000096207785 463210310 /nfs/dbraw/zinc/21/03/10/463210310.db2.gz OMAKNBNFHPUYBZ-NXHRZFHOSA-N 1 1 332.444 2.437 40 0 EEABMO c1cncc(C[N@H+]2CC[C@H]3[C@@H](Cc4nnc(C5CC5)o4)OC[C@H]3C2)c1 ZINC000096207404 463211017 /nfs/dbraw/zinc/21/10/17/463211017.db2.gz CPPVLRRTSWOHIL-BRWVUGGUSA-N 1 1 340.427 2.422 40 0 EEABMO COc1ccccc1C[N@H+]1C[C@@H]2COC[C@]2(CC(=O)N2CCCC2)C1 ZINC000096209610 463214303 /nfs/dbraw/zinc/21/43/03/463214303.db2.gz VLISTRKJHGPCFN-XLIONFOSSA-N 1 1 344.455 2.156 40 0 EEABMO Fc1cccnc1N[C@H]1CO[C@]2(C1)CCC[N@H+](C1CCOCC1)C2 ZINC000096223033 463219314 /nfs/dbraw/zinc/21/93/14/463219314.db2.gz BIZDPFUQCLMJMI-KDOFPFPSSA-N 1 1 335.423 2.435 40 0 EEABMO O=C(Cc1cccs1)N1C[C@@H]2[C@H](C1)OCC[N@H+]2CC1CCCC1 ZINC000096248709 463226660 /nfs/dbraw/zinc/22/66/60/463226660.db2.gz LQYWCXGWFBCXBN-SJORKVTESA-N 1 1 334.485 2.392 40 0 EEABMO O=C(c1ccncc1)N1C[C@@H]2C[N@@H+](Cc3ccccc3F)C[C@@H]2C1 ZINC000096245577 463227470 /nfs/dbraw/zinc/22/74/70/463227470.db2.gz XCDPGGZJOVAQKP-CALCHBBNSA-N 1 1 325.387 2.425 40 0 EEABMO Cc1noc(C)c1C(=O)N1CC[C@H]2OCC[N@@H+](CC3CC3)[C@H]2CC1 ZINC000096249337 463227503 /nfs/dbraw/zinc/22/75/03/463227503.db2.gz SQNBGLVBRHOGHU-JKSUJKDBSA-N 1 1 333.432 2.007 40 0 EEABMO CCOc1cc(C(=O)NCc2cccnc2-n2cc[nH+]c2C)ccn1 ZINC000096410053 463242641 /nfs/dbraw/zinc/24/26/41/463242641.db2.gz DUSZDPVPOZVSNK-UHFFFAOYSA-N 1 1 337.383 2.299 40 0 EEABMO CC[N@H+]1CCCC[C@@H]1C(=O)NC[C@H](O)c1ccc(OC(F)F)cc1 ZINC000096409686 463243008 /nfs/dbraw/zinc/24/30/08/463243008.db2.gz BFEFUEKAYLPFJN-CABCVRRESA-N 1 1 342.386 2.312 40 0 EEABMO COc1ccc(C(=O)N2CC[NH+](CCc3scnc3C)CC2)cc1 ZINC000096414820 463247066 /nfs/dbraw/zinc/24/70/66/463247066.db2.gz YVYQLQSNEAKJCV-UHFFFAOYSA-N 1 1 345.468 2.461 40 0 EEABMO CCOc1c(F)cccc1C(=O)N1CCN([C@H]2CCC[N@@H+](C)C2)CC1 ZINC000096431079 463260176 /nfs/dbraw/zinc/26/01/76/463260176.db2.gz MFMHQOSCDSFUQY-HNNXBMFYSA-N 1 1 349.450 2.076 40 0 EEABMO COc1ccc(N[C@H]2CO[C@@]3(CC[N@@H+](Cc4cnn(C)c4)C3)C2)cc1 ZINC000107728453 463579819 /nfs/dbraw/zinc/57/98/19/463579819.db2.gz IJCIPJDSQVDPQS-MJGOQNOKSA-N 1 1 342.443 2.274 40 0 EEABMO O=C(c1cccnc1)N1CCO[C@H]2CC[N@@H+](C[C@@H]3CC=CCC3)C[C@@H]21 ZINC000108527377 463609479 /nfs/dbraw/zinc/60/94/79/463609479.db2.gz XTDMCMFHGJWWFK-NEWSRXKRSA-N 1 1 341.455 2.353 40 0 EEABMO CNc1cncc([C@@H]2CCC[N@H+]2Cc2cccc(OCCO)c2)n1 ZINC000257282503 463760577 /nfs/dbraw/zinc/76/05/77/463760577.db2.gz OTYYOGLSWYTBME-KRWDZBQOSA-N 1 1 328.416 2.227 40 0 EEABMO CCN(C(=O)C[N@@H+]1C[C@@H](OC)[C@@]2(CCCO2)C1)c1cccc(C)c1 ZINC000257325219 463778290 /nfs/dbraw/zinc/77/82/90/463778290.db2.gz WRZMPIQPJKRGAG-IEBWSBKVSA-N 1 1 332.444 2.228 40 0 EEABMO CCN(C(=O)C[N@H+]1C[C@@H](OC)[C@@]2(CCCO2)C1)c1cccc(C)c1 ZINC000257325219 463778295 /nfs/dbraw/zinc/77/82/95/463778295.db2.gz WRZMPIQPJKRGAG-IEBWSBKVSA-N 1 1 332.444 2.228 40 0 EEABMO C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cccc(=O)[nH]3)CC[C@H]21 ZINC000257339206 463783985 /nfs/dbraw/zinc/78/39/85/463783985.db2.gz ZARSHHMTQFGIGY-JFIYKMOQSA-N 1 1 337.423 2.347 40 0 EEABMO COCC1=CC[N@H+](CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000185893376 463899997 /nfs/dbraw/zinc/89/99/97/463899997.db2.gz BPCKSRXZVXOQKR-SFHVURJKSA-N 1 1 348.418 2.004 40 0 EEABMO COCC1=CC[N@@H+](CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000185893376 463900005 /nfs/dbraw/zinc/90/00/05/463900005.db2.gz BPCKSRXZVXOQKR-SFHVURJKSA-N 1 1 348.418 2.004 40 0 EEABMO COc1ccccc1C(=O)N1CC[NH2+]C[C@@H]1c1ccccc1OC ZINC000261949263 463908439 /nfs/dbraw/zinc/90/84/39/463908439.db2.gz LKZHBFVGVVNIJB-MRXNPFEDSA-N 1 1 326.396 2.491 40 0 EEABMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Nc1cnn(Cc2ccccn2)c1 ZINC000195540364 464073361 /nfs/dbraw/zinc/07/33/61/464073361.db2.gz HVTNJQMUGPUVKW-PBHICJAKSA-N 1 1 342.447 2.130 40 0 EEABMO C[C@@](O)(C[N@@H+]1CCCN(C(=O)c2ccsc2)CC1)C(F)(F)F ZINC000239366963 464442885 /nfs/dbraw/zinc/44/28/85/464442885.db2.gz AGYZMQUUBUPOGR-CYBMUJFWSA-N 1 1 336.379 2.209 40 0 EEABMO C[C@@](O)(C[N@H+]1CCCN(C(=O)c2ccsc2)CC1)C(F)(F)F ZINC000239366963 464442888 /nfs/dbraw/zinc/44/28/88/464442888.db2.gz AGYZMQUUBUPOGR-CYBMUJFWSA-N 1 1 336.379 2.209 40 0 EEABMO COc1ccc(Cn2cc(NC(=O)N3CCC[N@@H+](C)CC3)cn2)cc1 ZINC000241338561 464452399 /nfs/dbraw/zinc/45/23/99/464452399.db2.gz MBTMRLASTNAMQQ-UHFFFAOYSA-N 1 1 343.431 2.109 40 0 EEABMO COCC(=O)NCC[C@H]1CCOC12C[NH+](Cc1cc(C)ccc1C)C2 ZINC000247851103 464711155 /nfs/dbraw/zinc/71/11/55/464711155.db2.gz RMIAXDZPPRHELC-SFHVURJKSA-N 1 1 346.471 2.047 40 0 EEABMO Cc1cc(CN2CC3(C2)C[C@H](COCC2CC2)CC[N@H+]3C)n(C)n1 ZINC000247919951 464715225 /nfs/dbraw/zinc/71/52/25/464715225.db2.gz NQJQOUYCSLYXCV-QGZVFWFLSA-N 1 1 332.492 2.051 40 0 EEABMO CC[C@@H](C)[N@@H+]1C[C@H]2c3ccccc3[C@@H](NC(=O)C3CC(O)C3)[C@H]2C1 ZINC000585109813 468973870 /nfs/dbraw/zinc/97/38/70/468973870.db2.gz WSDRDSWYHXBKOO-UESKCEEKSA-N 1 1 328.456 2.442 40 0 EEABMO CN(C)c1nc([C@H]2CCC[N@H+]2CC2(O)CCOCC2)cn2cccc12 ZINC000585178758 468994038 /nfs/dbraw/zinc/99/40/38/468994038.db2.gz HTEIOWMDRWQVSW-MRXNPFEDSA-N 1 1 344.459 2.079 40 0 EEABMO CNC(=O)C[C@]1(COC)C[N@@H+](Cc2ccc3ccccc3c2)CCO1 ZINC000585278572 469004749 /nfs/dbraw/zinc/00/47/49/469004749.db2.gz PEROTQHSGJLGDF-HXUWFJFHSA-N 1 1 342.439 2.193 40 0 EEABMO Cc1ccc(Cl)c(OC[C@@]2(O)C[N@H+](C3CCC3)CC[C@@H]2O)c1 ZINC000585281820 469007493 /nfs/dbraw/zinc/00/74/93/469007493.db2.gz BMKBLLKWWLFCDD-IRXDYDNUSA-N 1 1 325.836 2.377 40 0 EEABMO C[N@@H+](C[C@@]1(O)CC[C@H](C(C)(C)C)CC1)[C@]1(C)CCS(=O)(=O)C1 ZINC000585283830 469007507 /nfs/dbraw/zinc/00/75/07/469007507.db2.gz OZSAKEUHLPYQGM-OIISXLGYSA-N 1 1 331.522 2.463 40 0 EEABMO C[NH+](C)Cc1ccnc([C@H]2CN(Cc3c(F)cccc3F)CCO2)n1 ZINC000257225507 536051558 /nfs/dbraw/zinc/05/15/58/536051558.db2.gz FGNKDZXGQCUZHX-QGZVFWFLSA-N 1 1 348.397 2.390 40 0 EEABMO CC(C)CC[N@H+]1CCc2c(nc(N3C[C@@H](C)O[C@@H](C)C3)[nH]c2=O)C1 ZINC000072335561 216157635 /nfs/dbraw/zinc/15/76/35/216157635.db2.gz WWMSGKVGZSKMEB-OKILXGFUSA-N 1 1 334.464 2.200 40 0 EEABMO COCCNc1ccc(C[C@@H]2CCC[N@@H+](Cc3ccncc3)C2)nn1 ZINC000072387309 216186553 /nfs/dbraw/zinc/18/65/53/216186553.db2.gz XKUOTWVTNBINHK-KRWDZBQOSA-N 1 1 341.459 2.385 40 0 EEABMO CC[N@H+]1CCC[C@H]1CNCc1cc2cc(OC)c(OC)cc2[nH]c1=O ZINC000023247899 212362904 /nfs/dbraw/zinc/36/29/04/212362904.db2.gz KJAPVNPSTKAHPB-HNNXBMFYSA-N 1 1 345.443 2.119 40 0 EEABMO CCN1CCC[C@H]1C[NH2+]Cc1cc2cc(OC)c(OC)cc2[nH]c1=O ZINC000023247899 212362906 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O=C(c1ccnc(O[C@@H]2CCSC2)c1)N1CC[NH+](C2CCC2)CC1 ZINC000225723656 242004568 /nfs/dbraw/zinc/00/45/68/242004568.db2.gz IIGHDCBVROXJGJ-MRXNPFEDSA-N 1 1 347.484 2.276 40 0 EEABMO O=C(N[C@@H]1CCO[C@]2(CC[N@@H+](CC3CCOCC3)C2)C1)c1ccco1 ZINC000096207610 284074872 /nfs/dbraw/zinc/07/48/72/284074872.db2.gz NZXXEENZYKVEFO-VQIMIIECSA-N 1 1 348.443 2.060 40 0 EEABMO Cc1noc(C)c1-c1cc(C)nc([C@H]2CCCC[N@@H+]2CCC(N)=O)n1 ZINC000257226097 244201024 /nfs/dbraw/zinc/20/10/24/244201024.db2.gz FJDOYVVSJKXQAR-OAHLLOKOSA-N 1 1 343.431 2.459 40 0 EEABMO Cc1noc(C)c1-c1cc(C)nc([C@H]2CCCC[N@H+]2CCC(N)=O)n1 ZINC000257226097 244201030 /nfs/dbraw/zinc/20/10/30/244201030.db2.gz FJDOYVVSJKXQAR-OAHLLOKOSA-N 1 1 343.431 2.459 40 0 EEABMO CNc1cc(CC[C@@H]2CN(Cc3cnc(C)cn3)CCO2)cc[nH+]1 ZINC000257229201 244207951 /nfs/dbraw/zinc/20/79/51/244207951.db2.gz FXDDJCAJJMVXSW-QGZVFWFLSA-N 1 1 327.432 2.055 40 0 EEABMO OCC[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc2c(cc1Cl)OCO2 ZINC000019291867 212011543 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COC[C@]1([NH3+])[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000218606792 277269576 /nfs/dbraw/zinc/26/95/76/277269576.db2.gz QMDVDWUIDPCAPX-SQNIBIBYSA-N 1 1 349.427 2.418 40 0 EEABMO CC(C)CCn1ccc(NC(=O)N2CC[C@H](C[NH+]3CCOCC3)C2)n1 ZINC000097104116 323321279 /nfs/dbraw/zinc/32/12/79/323321279.db2.gz VWAHOKDCBYKSSM-MRXNPFEDSA-N 1 1 349.479 2.115 40 0 EEABMO C[N@@H+](CCO[C@@H]1CCCCO1)[C@@H]1CCN(Cc2ccccc2)C1=O ZINC000193129742 465027492 /nfs/dbraw/zinc/02/74/92/465027492.db2.gz AATQJBJBPWWMCZ-QZTJIDSGSA-N 1 1 332.444 2.263 40 0 EEABMO COc1ccc(C(=O)N2CCC(C[N@H+]3CCN(C)C[C@H]3C)CC2)cc1 ZINC000085468173 462549250 /nfs/dbraw/zinc/54/92/50/462549250.db2.gz RINMFIRKQKMJBQ-MRXNPFEDSA-N 1 1 345.487 2.183 40 0 EEABMO COc1ccc(-c2noc([C@@H]3C[C@@H](O)C[N@H+]3C3CCOCC3)n2)cc1 ZINC000015674704 462959771 /nfs/dbraw/zinc/95/97/71/462959771.db2.gz AMSVLXXSUGWGGG-ZBFHGGJFSA-N 1 1 345.399 2.032 40 0 biogenic,in-vitro EEABMO CCc1nc(C)cc(N2CC[NH+](C[C@@H](O)c3cccs3)CC2)n1 ZINC000019523159 463017880 /nfs/dbraw/zinc/01/78/80/463017880.db2.gz QHMLRMNJSOXFQW-CQSZACIVSA-N 1 1 332.473 2.265 40 0 EEABMO C[NH+](C)Cc1cc([C@@H]2CCCN2C(=O)COc2ccccc2)n[nH]1 ZINC000019709027 463021324 /nfs/dbraw/zinc/02/13/24/463021324.db2.gz BXQXFRFUCXTFFI-KRWDZBQOSA-N 1 1 328.416 2.214 40 0 EEABMO CCS(=O)(=O)N1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC000096051603 463154914 /nfs/dbraw/zinc/15/49/14/463154914.db2.gz CSRAQTDCMAIDGB-OAHLLOKOSA-N 1 1 326.462 2.306 40 0 EEABMO Cc1ccc(C[N@@H+]2CCOC[C@]3(CCN(c4ncccn4)C3)C2)o1 ZINC000096062502 463162743 /nfs/dbraw/zinc/16/27/43/463162743.db2.gz UIUGEGWDBKBVHO-GOSISDBHSA-N 1 1 328.416 2.107 40 0 EEABMO Cc1ccc(C[N@H+]2CCOC[C@]3(CCN(c4ncccn4)C3)C2)o1 ZINC000096062502 463162746 /nfs/dbraw/zinc/16/27/46/463162746.db2.gz UIUGEGWDBKBVHO-GOSISDBHSA-N 1 1 328.416 2.107 40 0 EEABMO CCS(=O)(=O)N1CC[C@]2(CC[N@@H+](Cc3ccccc3F)C2)C1 ZINC000096071100 463165373 /nfs/dbraw/zinc/16/53/73/463165373.db2.gz CJXXARPCFYRHSM-INIZCTEOSA-N 1 1 326.437 2.073 40 0 EEABMO Cc1noc(C)c1C[N@@H+]1C[C@H](OCc2ccccn2)[C@H]2COC[C@H]21 ZINC000096185105 463196472 /nfs/dbraw/zinc/19/64/72/463196472.db2.gz NMRXAXYMSHIEQU-KSZLIROESA-N 1 1 329.400 2.102 40 0 EEABMO Cc1noc(C)c1C[N@H+]1C[C@H](OCc2ccccn2)[C@H]2COC[C@H]21 ZINC000096185105 463196476 /nfs/dbraw/zinc/19/64/76/463196476.db2.gz NMRXAXYMSHIEQU-KSZLIROESA-N 1 1 329.400 2.102 40 0 EEABMO Cn1ccnc1C[NH+]1CCC2(CC1)[C@@H](c1ccccc1)CC(=O)N2C ZINC000096199640 463204163 /nfs/dbraw/zinc/20/41/63/463204163.db2.gz UEFKZRBKISIRJY-QGZVFWFLSA-N 1 1 338.455 2.401 40 0 EEABMO c1cc(C[N@@H+]2CC[C@@H](N3CCOCC3)[C@@H]2Cc2ccncc2)co1 ZINC000096201018 463206089 /nfs/dbraw/zinc/20/60/89/463206089.db2.gz SMUCDFHPSLRETG-MOPGFXCFSA-N 1 1 327.428 2.192 40 0 EEABMO O=C(C[C@H]1C[C@H]2C[N@H+](C3CCCC3)C[C@H]2O1)NCc1ccccn1 ZINC000096208375 463211772 /nfs/dbraw/zinc/21/17/72/463211772.db2.gz SGLWXMWLCOTNFZ-BMGDILEWSA-N 1 1 329.444 2.120 40 0 EEABMO COC[C@H]1CCC2(CCN(C(=O)Cc3ccccc3F)CC2)[N@H+]1C ZINC000096209333 463211863 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C[C@H](NCc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cnn(C)c1 ZINC000096477213 463280301 /nfs/dbraw/zinc/28/03/01/463280301.db2.gz FBLOCCIYHYOSFY-HNNXBMFYSA-N 1 1 328.460 2.228 40 0 EEABMO Cc1cccnc1NC(=O)[C@@H]1CCC[N@@H+](CCCn2ccnc2)C1 ZINC000096493105 463287929 /nfs/dbraw/zinc/28/79/29/463287929.db2.gz AAQHNMBXVXDIQU-MRXNPFEDSA-N 1 1 327.432 2.327 40 0 EEABMO C[C@H](O)[C@@H]1CCN(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000096502514 463292626 /nfs/dbraw/zinc/29/26/26/463292626.db2.gz DZQBIFHECHWATN-YTQUADARSA-N 1 1 345.487 2.311 40 0 EEABMO c1ccc(C[NH+]2CCN(Cc3nnnn3C3CCCC3)CC2)cc1 ZINC000035310875 463430778 /nfs/dbraw/zinc/43/07/78/463430778.db2.gz QRAZCCHZGWAXBQ-UHFFFAOYSA-N 1 1 326.448 2.106 40 0 EEABMO COc1cccc(/C(C)=C/C(=O)N2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC000081571308 463462452 /nfs/dbraw/zinc/46/24/52/463462452.db2.gz YOVPOCYTCLUAAQ-XAVZPLJISA-N 1 1 344.455 2.422 40 0 EEABMO NC(=O)[C@H]([NH2+][C@H]1CCN(C(=O)C2CCCCC2)C1)c1ccc(F)cc1 ZINC000151061765 463471661 /nfs/dbraw/zinc/47/16/61/463471661.db2.gz CJONNTZRDVZULP-DLBZAZTESA-N 1 1 347.434 2.123 40 0 EEABMO CN(c1ncccn1)[C@H]1CO[C@@]2(CC[N@@H+](Cc3ccc(F)cc3)C2)C1 ZINC000107226795 463562957 /nfs/dbraw/zinc/56/29/57/463562957.db2.gz INVIMSHVIRPIMG-MJGOQNOKSA-N 1 1 342.418 2.486 40 0 EEABMO C[C@]12CCCC[N@@H+](Cc3cccc(OCCO)c3)[C@H]1CCC(=O)N2 ZINC000257295250 463766199 /nfs/dbraw/zinc/76/61/99/463766199.db2.gz QXOXFZQSVKWGJX-HKUYNNGSSA-N 1 1 332.444 2.081 40 0 EEABMO Cc1n[nH]c(C)c1CCC(=O)N[C@H]1CCCN(c2cccc(C)[nH+]2)C1 ZINC000257297016 463767368 /nfs/dbraw/zinc/76/73/68/463767368.db2.gz RFKCSCFUPKGQAE-INIZCTEOSA-N 1 1 341.459 2.448 40 0 EEABMO C[NH+](C)Cc1cncc([C@@H]2CCCN2C(=O)CCc2cccnc2)n1 ZINC000257300356 463769045 /nfs/dbraw/zinc/76/90/45/463769045.db2.gz RTYPDWBOOUOGKO-SFHVURJKSA-N 1 1 339.443 2.230 40 0 EEABMO COC[C@]1([NH3+])[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 ZINC000218605399 464108960 /nfs/dbraw/zinc/10/89/60/464108960.db2.gz WPOTWRTXDKCUDH-IKGGRYGDSA-N 1 1 335.400 2.109 40 0 EEABMO O=C(C[C@H]1C[N@@H+](C2CCCC2)Cc2ccnn21)NCC1CCOCC1 ZINC000247807562 464707392 /nfs/dbraw/zinc/70/73/92/464707392.db2.gz CGETWLVLVFXZQS-SFHVURJKSA-N 1 1 346.475 2.115 40 0 EEABMO O=C(C[C@H]1C[N@H+](C2CCCC2)Cc2ccnn21)NCC1CCOCC1 ZINC000247807562 464707398 /nfs/dbraw/zinc/70/73/98/464707398.db2.gz CGETWLVLVFXZQS-SFHVURJKSA-N 1 1 346.475 2.115 40 0 EEABMO O=C(/C=C/c1ccccc1Cl)N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000252571977 464983904 /nfs/dbraw/zinc/98/39/04/464983904.db2.gz YQFULNWQYZWAFQ-JFDDCEBESA-N 1 1 334.847 2.411 40 0 EEABMO COCC[N@@H+]1CC[C@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2 ZINC000585101756 468968232 /nfs/dbraw/zinc/96/82/32/468968232.db2.gz DVQHMVCIIFBNLR-KRWDZBQOSA-N 1 1 338.835 2.373 40 0 EEABMO COCC[N@H+]1CC[C@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2 ZINC000585101756 468968238 /nfs/dbraw/zinc/96/82/38/468968238.db2.gz DVQHMVCIIFBNLR-KRWDZBQOSA-N 1 1 338.835 2.373 40 0 EEABMO O=C(c1ccccc1)N1CCC2(CO[C@@H](C[NH+]3CCOCC3)C2)CC1 ZINC000585104893 468971924 /nfs/dbraw/zinc/97/19/24/468971924.db2.gz WFFDIFKAVQYUMP-GOSISDBHSA-N 1 1 344.455 2.030 40 0 EEABMO COc1ccc(C[N@H+]2CCOC[C@]3(CC(=O)N(CC(C)C)C3)C2)cc1 ZINC000585105045 468972194 /nfs/dbraw/zinc/97/21/94/468972194.db2.gz ZRTXYCTXRXTWSH-HXUWFJFHSA-N 1 1 346.471 2.402 40 0 EEABMO CCCn1cc(C[N@H+]2CC[C@@](O)(COc3ccc(F)cc3)C2)cn1 ZINC000585269370 468998024 /nfs/dbraw/zinc/99/80/24/468998024.db2.gz QMYRYQMCVHNECX-SFHVURJKSA-N 1 1 333.407 2.448 40 0 EEABMO COc1ccc(C[N@@H+]2CC[C@@H](OC)[C@H](CC(=O)N(C)C)C2)cc1F ZINC000585277033 469002042 /nfs/dbraw/zinc/00/20/42/469002042.db2.gz RQAJAUKKCMIEBH-GDBMZVCRSA-N 1 1 338.423 2.150 40 0 EEABMO CCc1[nH]c(CN2CCO[C@](CO)(Cc3cccc(C)c3)C2)c(C)[nH+]1 ZINC000585278930 469004203 /nfs/dbraw/zinc/00/42/03/469004203.db2.gz WWSIIAPZSYLACW-HXUWFJFHSA-N 1 1 343.471 2.395 40 0 EEABMO CO[C@H]1C[N@@H+](CC2(O)CCOCC2)CC[C@@H]1Cc1ccccc1F ZINC000585279867 469006407 /nfs/dbraw/zinc/00/64/07/469006407.db2.gz RRRJGNQOKDHTCY-AEFFLSMTSA-N 1 1 337.435 2.247 40 0 EEABMO COc1cccc(N2CCC(O)(C[N@@H+](C)[C@H]3CCCC[C@H]3O)CC2)c1 ZINC000585282120 469007417 /nfs/dbraw/zinc/00/74/17/469007417.db2.gz ANNOWEURNPCFNR-RBUKOAKNSA-N 1 1 348.487 2.262 40 0 EEABMO CCc1ccccc1NC(=O)C[N@@H+]1CC[C@@]2(CCCO2)[C@@H](OC)C1 ZINC000257236471 535950871 /nfs/dbraw/zinc/95/08/71/535950871.db2.gz HCJCUZUPFRCYAF-HKUYNNGSSA-N 1 1 332.444 2.457 40 0 EEABMO CCc1ccccc1NC(=O)C[N@H+]1CC[C@@]2(CCCO2)[C@@H](OC)C1 ZINC000257236471 535950873 /nfs/dbraw/zinc/95/08/73/535950873.db2.gz HCJCUZUPFRCYAF-HKUYNNGSSA-N 1 1 332.444 2.457 40 0 EEABMO OCc1cn([C@H]2CCC[N@@H+](C[C@@H]3[C@@H](c4ccccc4)C3(F)F)C2)nn1 ZINC000930577726 1206568168 /nfs/dbraw/zinc/56/81/68/1206568168.db2.gz WCGMHYNLFFDCST-GVDBMIGSSA-N 1 1 348.397 2.456 40 0 EEABMO Cc1csc(C[N@H+]2C[C@@H]3COC[C@@H](Cc4nc(C)no4)[C@@H]3C2)n1 ZINC000097953553 219065122 /nfs/dbraw/zinc/06/51/22/219065122.db2.gz SQXLNJHTXCNURT-MCIONIFRSA-N 1 1 334.445 2.080 40 0 EEABMO Cc1cc(C[C@H](C)NC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)[nH]n1 ZINC000178183245 232102628 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Cn1cc(C[N@H+]2CCC[C@H]2c2ccnc(Nc3cnccn3)n2)cn1 ZINC000072378017 216179969 /nfs/dbraw/zinc/17/99/69/216179969.db2.gz GEAWQGQCGPYHSO-HNNXBMFYSA-N 1 1 336.403 2.081 40 0 EEABMO Cc1ccc(N2CCCC2=O)c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000073476737 216389213 /nfs/dbraw/zinc/38/92/13/216389213.db2.gz LTGAWPPBRQHKHS-INIZCTEOSA-N 1 1 341.455 2.336 40 0 EEABMO O=C(c1cccs1)N1CC[C@@](O)(C[N@H+]2CCc3ccccc3C2)C1 ZINC000257267825 244366936 /nfs/dbraw/zinc/36/69/36/244366936.db2.gz MIXJVKHTWBKRPN-LJQANCHMSA-N 1 1 342.464 2.383 40 0 EEABMO COC(=O)Cn1cc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c2ccccc21 ZINC000019575194 212045446 /nfs/dbraw/zinc/04/54/46/212045446.db2.gz HMNQJJGECMMDLX-NVXWUHKLSA-N 1 1 341.455 2.483 40 0 EEABMO CCCNC(=O)c1cc([C@@H]2CCC[N@@H+](Cc3cnn(C)c3C)C2)no1 ZINC000019503735 212034569 /nfs/dbraw/zinc/03/45/69/212034569.db2.gz XIIGPGMSJYURAE-CQSZACIVSA-N 1 1 345.447 2.236 40 0 EEABMO CC(C)[N@@H+](CCNC(=O)NCCC(=O)Nc1ccccc1)C1CC1 ZINC000079098659 217193578 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Cc1ccc(C[N@H+]2C[C@H]3C(=O)Nc4ccccc4C(=O)N[C@@]3(C)C2)o1 ZINC000012231457 211326909 /nfs/dbraw/zinc/32/69/09/211326909.db2.gz TYCVVIBPKUSSEZ-KXBFYZLASA-N 1 1 339.395 2.161 40 0 EEABMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCCc1ccccn1 ZINC000154474321 224258981 /nfs/dbraw/zinc/25/89/81/224258981.db2.gz PYOAAGCICJEATM-APWZRJJASA-N 1 1 338.455 2.444 40 0 EEABMO C[N@H+]1CCO[C@@H]2CN(C(=O)c3ccc4ncccc4c3)CC[C@@H]2C1 ZINC000096249561 277123435 /nfs/dbraw/zinc/12/34/35/277123435.db2.gz ZVBVTOABVBHFTQ-SJLPKXTDSA-N 1 1 325.412 2.028 40 0 EEABMO C[C@@H](CNc1ncccc1C(=O)N1CCCCC1)[N@@H+]1CCOC[C@H]1C ZINC000096429500 278287849 /nfs/dbraw/zinc/28/78/49/278287849.db2.gz BQHBBKWOKBTRSN-JKSUJKDBSA-N 1 1 346.475 2.229 40 0 EEABMO C[C@@H](CNc1ncccc1C(=O)N1CCCCC1)[N@H+]1CCOC[C@H]1C ZINC000096429500 278287850 /nfs/dbraw/zinc/28/78/50/278287850.db2.gz BQHBBKWOKBTRSN-JKSUJKDBSA-N 1 1 346.475 2.229 40 0 EEABMO C[C@H]([NH2+]CCC(=O)N1CCOCC1)c1ncc(-c2ccccc2)o1 ZINC000097374530 323322475 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Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](C(C)C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000068150683 463099261 /nfs/dbraw/zinc/09/92/61/463099261.db2.gz KODLRUIHHICYKS-LOUJCGABSA-N 1 1 336.480 2.040 40 0 EEABMO Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](C(C)C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000068150683 463099263 /nfs/dbraw/zinc/09/92/63/463099263.db2.gz KODLRUIHHICYKS-LOUJCGABSA-N 1 1 336.480 2.040 40 0 EEABMO O=C(c1cccnc1)N1CCC2(CC[N@@H+](CC3CCOCC3)C2)CC1 ZINC000096046668 463150065 /nfs/dbraw/zinc/15/00/65/463150065.db2.gz UFWFLTLMTBNEMZ-UHFFFAOYSA-N 1 1 343.471 2.436 40 0 EEABMO Cc1nc(C[N@@H+]2CC[C@]3(CC(=O)N(c4ccccn4)C3)C2)cs1 ZINC000096050795 463155479 /nfs/dbraw/zinc/15/54/79/463155479.db2.gz CJINWOFRGSBPJX-KRWDZBQOSA-N 1 1 328.441 2.476 40 0 EEABMO Cc1nc(C[N@H+]2CC[C@]3(CC(=O)N(c4ccccn4)C3)C2)cs1 ZINC000096050795 463155483 /nfs/dbraw/zinc/15/54/83/463155483.db2.gz CJINWOFRGSBPJX-KRWDZBQOSA-N 1 1 328.441 2.476 40 0 EEABMO CC(C)[N@@H+](C)C[C@@H]1CC[C@@]2(COCCN(Cc3nccs3)C2)O1 ZINC000096052307 463157237 /nfs/dbraw/zinc/15/72/37/463157237.db2.gz LDYPMYJAQNSMST-DOTOQJQBSA-N 1 1 339.505 2.233 40 0 EEABMO O=C(NCc1cccnc1)[C@@H]1C[C@@H]2[C@@H](CC[N@H+]2Cc2ccsc2)O1 ZINC000096055594 463158403 /nfs/dbraw/zinc/15/84/03/463158403.db2.gz WPMYSCBLSSMVAV-ZACQAIPSSA-N 1 1 343.452 2.191 40 0 EEABMO O=C([C@@H]1CO[C@@H]2CC[N@@H+](Cc3cccs3)C[C@@H]2C1)N1CCCO1 ZINC000096058171 463159743 /nfs/dbraw/zinc/15/97/43/463159743.db2.gz KWARIBHILROMMY-OFQRWUPVSA-N 1 1 336.457 2.139 40 0 EEABMO Cc1ccc(C[N@@H+]2CC[C@@H]3O[C@H](COCC(=O)N(C)C)CC[C@@H]32)cc1 ZINC000096064608 463163408 /nfs/dbraw/zinc/16/34/08/463163408.db2.gz OIJPZFZSSWREOE-FHWLQOOXSA-N 1 1 346.471 2.222 40 0 EEABMO O=C(NC[C@]12COC[C@H]1C[N@@H+](Cc1ccccc1)C2)c1ccco1 ZINC000096108449 463176718 /nfs/dbraw/zinc/17/67/18/463176718.db2.gz RHIFDVVJGRVCCG-APWZRJJASA-N 1 1 326.396 2.158 40 0 EEABMO CNC(=O)C1([N@H+]2CCC[C@H]2C(=O)NCc2ccccc2)CCCCC1 ZINC000096113080 463180373 /nfs/dbraw/zinc/18/03/73/463180373.db2.gz VVNVRLGDKBVYNG-KRWDZBQOSA-N 1 1 343.471 2.216 40 0 biogenic,in-vitro EEABMO O=C(Cc1cccc(F)c1)N1C[C@@H]2C[N@H+](Cc3cccnc3)C[C@@H]2C1 ZINC000096161495 463191968 /nfs/dbraw/zinc/19/19/68/463191968.db2.gz XNQHQUAPERWBMA-HDICACEKSA-N 1 1 339.414 2.354 40 0 EEABMO CC(C)N1[C@@H](C(=O)NCC2CC2)C[C@@H]2C[N@H+](Cc3ccco3)C[C@@H]21 ZINC000096182715 463194387 /nfs/dbraw/zinc/19/43/87/463194387.db2.gz LNXRTXVVPJZLJL-NXHRZFHOSA-N 1 1 331.460 2.089 40 0 EEABMO CC(C)[N@H+]1[C@@H](C(=O)NCC2CC2)C[C@@H]2CN(Cc3ccco3)C[C@@H]21 ZINC000096182715 463194392 /nfs/dbraw/zinc/19/43/92/463194392.db2.gz LNXRTXVVPJZLJL-NXHRZFHOSA-N 1 1 331.460 2.089 40 0 EEABMO CC(C)[N@@H+]1[C@@H](C(=O)NCC2CC2)C[C@@H]2CN(Cc3ccco3)C[C@@H]21 ZINC000096182715 463194395 /nfs/dbraw/zinc/19/43/95/463194395.db2.gz LNXRTXVVPJZLJL-NXHRZFHOSA-N 1 1 331.460 2.089 40 0 EEABMO Cn1ccnc1CN1CC[N@H+]2C[C@H](OCc3ccccc3F)C[C@H]2C1 ZINC000096183562 463195279 /nfs/dbraw/zinc/19/52/79/463195279.db2.gz GSNTYBIFJSYEPM-DLBZAZTESA-N 1 1 344.434 2.035 40 0 EEABMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(=O)Cc1cccs1)C2 ZINC000096201070 463205660 /nfs/dbraw/zinc/20/56/60/463205660.db2.gz CVTYGAHHAQYSAM-UHFFFAOYSA-N 1 1 332.473 2.370 40 0 EEABMO COc1ccc(C[C@H]2C[N@@H+](C)CC[C@H]2OCC(=O)N2CCCC2)cc1 ZINC000096209868 463213706 /nfs/dbraw/zinc/21/37/06/463213706.db2.gz DMTBHLCVROXKLM-PKOBYXMFSA-N 1 1 346.471 2.197 40 0 EEABMO Fc1cccnc1N[C@@H]1CO[C@]2(C1)CCC[N@H+](C1CCOCC1)C2 ZINC000096223036 463219432 /nfs/dbraw/zinc/21/94/32/463219432.db2.gz BIZDPFUQCLMJMI-KSSFIOAISA-N 1 1 335.423 2.435 40 0 EEABMO Cc1ccc(N2C[C@]3(CC[N@H+](Cc4cnn(C)c4)C3)CC2=O)s1 ZINC000096239332 463224577 /nfs/dbraw/zinc/22/45/77/463224577.db2.gz XJOYMHRZRKAUKQ-QGZVFWFLSA-N 1 1 330.457 2.419 40 0 EEABMO COCCC[N@H+](Cc1ccc2c(c1)CCC2)[C@@H]1CCS(=O)(=O)C1 ZINC000096406594 463240514 /nfs/dbraw/zinc/24/05/14/463240514.db2.gz LJQUAJFBIYNSEY-GOSISDBHSA-N 1 1 337.485 2.201 40 0 EEABMO COCCC[N@@H+](Cc1ccc2c(c1)CCC2)[C@@H]1CCS(=O)(=O)C1 ZINC000096406594 463240518 /nfs/dbraw/zinc/24/05/18/463240518.db2.gz LJQUAJFBIYNSEY-GOSISDBHSA-N 1 1 337.485 2.201 40 0 EEABMO C[N@@H+](CC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1)C1CC1 ZINC000096408951 463242977 /nfs/dbraw/zinc/24/29/77/463242977.db2.gz ZKGWYBMVMWRXGM-LBPRGKRZSA-N 1 1 339.386 2.077 40 0 EEABMO CCN(C)c1cccc(NC(=O)NC[C@H](c2cnn(C)c2)[NH+](C)C)c1 ZINC000096410632 463243469 /nfs/dbraw/zinc/24/34/69/463243469.db2.gz OAJQJWMPCROYLB-QGZVFWFLSA-N 1 1 344.463 2.301 40 0 EEABMO O=S(=O)(CC1CCOCC1)N[C@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000096427969 463258276 /nfs/dbraw/zinc/25/82/76/463258276.db2.gz XRILMIJFDMPJMJ-INIZCTEOSA-N 1 1 344.521 2.130 40 0 EEABMO CN(CCC[NH+]1CCOCC1)[C@H](c1ccc(F)cc1)c1ncccn1 ZINC000096443338 463268908 /nfs/dbraw/zinc/26/89/08/463268908.db2.gz TVRRGTAMYRHMMG-GOSISDBHSA-N 1 1 344.434 2.359 40 0 EEABMO Cc1ccc(C[NH2+]CCCN2CCN(C)CC2)c(Br)c1 ZINC000096483920 463282571 /nfs/dbraw/zinc/28/25/71/463282571.db2.gz BJSIXCLTQPCAEO-UHFFFAOYSA-N 1 1 340.309 2.485 40 0 EEABMO C[C@@H]([NH2+][C@H](C(N)=O)c1ccc(F)cc1)c1ccc(-n2cncn2)cc1 ZINC000096490782 463287012 /nfs/dbraw/zinc/28/70/12/463287012.db2.gz BOUGOURLHCHXOR-PXAZEXFGSA-N 1 1 339.374 2.284 40 0 EEABMO CC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2ccc(OC)c(F)c2C)C1 ZINC000096501599 463291636 /nfs/dbraw/zinc/29/16/36/463291636.db2.gz MVPGVTBSHMDMHI-CYBMUJFWSA-N 1 1 344.452 2.105 40 0 EEABMO C[NH+]1CCN(c2ncc(CNCc3cccc(Cl)c3F)cn2)CC1 ZINC000097228141 463351305 /nfs/dbraw/zinc/35/13/05/463351305.db2.gz ISIAVWMQFNIWNQ-UHFFFAOYSA-N 1 1 349.841 2.311 40 0 EEABMO COc1ccc(-c2cnc(CCC(=O)N3CC[NH+](C)CC3)o2)cc1 ZINC000058300656 463574486 /nfs/dbraw/zinc/57/44/86/463574486.db2.gz DGCRNLMHSPNSHY-UHFFFAOYSA-N 1 1 329.400 2.057 40 0 EEABMO COc1ccc(C[N@H+]2CC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 ZINC000107728880 463579785 /nfs/dbraw/zinc/57/97/85/463579785.db2.gz SZNLKCZUEFDLJA-APWZRJJASA-N 1 1 340.427 2.331 40 0 EEABMO CC[N@H+]1CCC[C@H]1CNC(=O)C(=O)Nc1ccccc1C(F)(F)F ZINC000073743172 463651760 /nfs/dbraw/zinc/65/17/60/463651760.db2.gz DVSYYUFOAYGSII-NSHDSACASA-N 1 1 343.349 2.244 40 0 EEABMO C[C@H](O)[C@@H]1CCN(C(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)C1 ZINC000195571336 464078749 /nfs/dbraw/zinc/07/87/49/464078749.db2.gz IKJSCECHGJNROI-ILZDJORESA-N 1 1 345.487 2.453 40 0 EEABMO Cc1occc1C(=O)N(C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188113613 464203636 /nfs/dbraw/zinc/20/36/36/464203636.db2.gz XTXCWAOWTQBQMP-IBGZPJMESA-N 1 1 328.412 2.297 40 0 EEABMO CC(C)OCC[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000245316712 464470052 /nfs/dbraw/zinc/47/00/52/464470052.db2.gz KGDMYHOMLSDIJV-SJORKVTESA-N 1 1 346.537 2.328 40 0 EEABMO O=C(NCCc1cccs1)[C@H]1C[N@@H+](CC2CC2)Cc2cncn21 ZINC000247464185 464682552 /nfs/dbraw/zinc/68/25/52/464682552.db2.gz CAYSBGGGIHNWSP-MRXNPFEDSA-N 1 1 330.457 2.070 40 0 EEABMO C[C@H]1COc2ccccc2CN1C(=O)CCCC[NH+]1CCOCC1 ZINC000272873642 464692475 /nfs/dbraw/zinc/69/24/75/464692475.db2.gz WERQHBNRPXBFPM-INIZCTEOSA-N 1 1 332.444 2.299 40 0 EEABMO CC(C)SCC[NH+]1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1 ZINC000252480303 464960643 /nfs/dbraw/zinc/96/06/43/464960643.db2.gz BZOIXJMQVYGCGZ-IAGOWNOFSA-N 1 1 341.565 2.441 40 0 EEABMO NC(=O)[C@H]1CCC[N@H+]1C1CCN(Cc2ccc(Cl)cc2F)CC1 ZINC000252490745 464966798 /nfs/dbraw/zinc/96/67/98/464966798.db2.gz LAAROIQBGRTVFU-MRXNPFEDSA-N 1 1 339.842 2.393 40 0 EEABMO CCOc1ccccc1C[N@@H+]1CCN(Cc2ncnn2CC)[C@H](C)C1 ZINC000252492925 464968539 /nfs/dbraw/zinc/96/85/39/464968539.db2.gz MXRFIKZVTXVAFR-MRXNPFEDSA-N 1 1 343.475 2.403 40 0 EEABMO CCOc1ccccc1C[N@H+]1CCN(Cc2ncnn2CC)[C@H](C)C1 ZINC000252492925 464968542 /nfs/dbraw/zinc/96/85/42/464968542.db2.gz MXRFIKZVTXVAFR-MRXNPFEDSA-N 1 1 343.475 2.403 40 0 EEABMO Cc1ncsc1C[N@H+]1C[C@H]2OC[C@H](CNc3ccccn3)[C@H]2C1 ZINC000306134505 466491050 /nfs/dbraw/zinc/49/10/50/466491050.db2.gz NPJRKJLXSQLRMA-RRFJBIMHSA-N 1 1 330.457 2.405 40 0 EEABMO CCS(=O)(=O)NCC[C@H]1Cn2cccc2C[N@@H+](CC2CCC2)C1 ZINC000585095316 468964654 /nfs/dbraw/zinc/96/46/54/468964654.db2.gz PGHIQQYMUDPVDG-MRXNPFEDSA-N 1 1 339.505 2.049 40 0 EEABMO C[C@H]1Cc2nnc(COc3ncccc3F)n2CC[N@H+]1CC1CC1 ZINC000585097561 468966011 /nfs/dbraw/zinc/96/60/11/468966011.db2.gz LSRATFQRVTVLBS-LBPRGKRZSA-N 1 1 331.395 2.048 40 0 EEABMO Cn1ccnc1C[N@@H+]1CCC[C@@]2(CN(CC3CCCCC3)C2=O)C1 ZINC000585099410 468966999 /nfs/dbraw/zinc/96/69/99/468966999.db2.gz IOHIXJHZDCSPQW-IBGZPJMESA-N 1 1 330.476 2.425 40 0 EEABMO Cn1ccnc1C[N@H+]1CCC[C@@]2(CN(CC3CCCCC3)C2=O)C1 ZINC000585099410 468967005 /nfs/dbraw/zinc/96/70/05/468967005.db2.gz IOHIXJHZDCSPQW-IBGZPJMESA-N 1 1 330.476 2.425 40 0 EEABMO CCc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](Cc4cccnc4)[C@@H]3C2)cn1 ZINC000585107652 468971787 /nfs/dbraw/zinc/97/17/87/468971787.db2.gz HCRHBTRNLRSPAZ-PKOBYXMFSA-N 1 1 336.439 2.386 40 0 EEABMO CO[C@]1(COc2cccc(C)c2)CC[N@@H+](CC2(O)CCOCC2)C1 ZINC000585277737 469002881 /nfs/dbraw/zinc/00/28/81/469002881.db2.gz OSGXXTJATZATKW-LJQANCHMSA-N 1 1 335.444 2.006 40 0 EEABMO COc1ncc(C[N@@H+]2CC[C@H](Cc3ccccc3F)[C@H](O)C2)cn1 ZINC000585278885 469004552 /nfs/dbraw/zinc/00/45/52/469004552.db2.gz IGNPXGVSSVAOGG-NVXWUHKLSA-N 1 1 331.391 2.050 40 0 EEABMO COc1ncc(C[N@H+]2CC[C@H](Cc3ccccc3F)[C@H](O)C2)cn1 ZINC000585278885 469004560 /nfs/dbraw/zinc/00/45/60/469004560.db2.gz IGNPXGVSSVAOGG-NVXWUHKLSA-N 1 1 331.391 2.050 40 0 EEABMO Cc1nnc(CNC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)n1C1CC1 ZINC000184213284 534868154 /nfs/dbraw/zinc/86/81/54/534868154.db2.gz PXJMOHVDXGURBH-AWEZNQCLSA-N 1 1 331.464 2.192 40 0 EEABMO Cc1ncccc1NC(=O)[C@@H]1COC[C@H]2C[N@@H+](Cc3ccco3)C[C@H]21 ZINC000097953318 219063675 /nfs/dbraw/zinc/06/36/75/219063675.db2.gz JMIAOXNCOKEIOM-DJIMGWMZSA-N 1 1 341.411 2.316 40 0 EEABMO Cc1nn(C)c2ncc(C(=O)N[C@H](C)C[N@H+]3CCC[C@@H](C)C3)cc12 ZINC000195529532 282287671 /nfs/dbraw/zinc/28/76/71/282287671.db2.gz VAIBNDWMNNXTFZ-CHWSQXEVSA-N 1 1 329.448 2.127 40 0 EEABMO Cc1nc(C)n(C[C@@H](C)C(=O)NC(C)(C)C[N@H+]2CCCC[C@@H]2C)n1 ZINC000036719427 213113250 /nfs/dbraw/zinc/11/32/50/213113250.db2.gz MWRVALKELRFNDK-KGLIPLIRSA-N 1 1 335.496 2.300 40 0 EEABMO Cc1nc([C@H]2CCCC[N@H+]2C2CCOCC2)ncc1C(=O)N(C)C ZINC000072345460 216159156 /nfs/dbraw/zinc/15/91/56/216159156.db2.gz FJZSWEMGRDUVBW-MRXNPFEDSA-N 1 1 332.448 2.193 40 0 EEABMO Cc1ccccc1Cc1noc(C[NH2+][C@H]2CCCC[C@@H]2C(N)=O)n1 ZINC000131303421 223220559 /nfs/dbraw/zinc/22/05/59/223220559.db2.gz MUGIZWSRHHALTI-GJZGRUSLSA-N 1 1 328.416 2.103 40 0 EEABMO Cc1cc(C)nc(Nc2cccc(C(=O)N3CC[NH+](C)CC3)c2)n1 ZINC000225915624 242076774 /nfs/dbraw/zinc/07/67/74/242076774.db2.gz BCCRYLPCWQEUQO-UHFFFAOYSA-N 1 1 325.416 2.225 40 0 EEABMO CC(=O)Nc1ccc(N2C(=O)C[C@H]([N@H+]3C[C@H](C)C[C@H](C)C3)C2=O)cc1 ZINC000230462039 242263788 /nfs/dbraw/zinc/26/37/88/242263788.db2.gz IULYOWUGSZCYKF-AHIWAGSCSA-N 1 1 343.427 2.255 40 0 EEABMO c1ccc(OCC[C@H]2CO[C@H]3C[N@@H+](Cc4cccnc4)C[C@@H]23)nc1 ZINC000253602855 244034989 /nfs/dbraw/zinc/03/49/89/244034989.db2.gz SFBKWFXMGQMTQQ-BZSNNMDCSA-N 1 1 325.412 2.393 40 0 EEABMO 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C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)Cc3cnn(C)c3)cc2)C1 ZINC000073303647 216375700 /nfs/dbraw/zinc/37/57/00/216375700.db2.gz GMZMCIIVSLYNGZ-HNNXBMFYSA-N 1 1 342.443 2.322 40 0 EEABMO CCCCCn1c2ccccc2nc1CN1CC[NH+](CCO)CC1 ZINC000022592048 212309159 /nfs/dbraw/zinc/30/91/59/212309159.db2.gz ZWSXCCZOHIBORQ-UHFFFAOYSA-N 1 1 330.476 2.336 40 0 EEABMO Cc1nccc([C@H]2CN(C(=O)CCn3cc[nH+]c3C(C)C)CCO2)n1 ZINC000257254145 244276322 /nfs/dbraw/zinc/27/63/22/244276322.db2.gz KBVWRZXTYKKVGY-MRXNPFEDSA-N 1 1 343.431 2.095 40 0 EEABMO COCc1nnc(NC(=O)c2cc([C@H]3CCC[N@H+]3C)ccn2)s1 ZINC000257343647 244578215 /nfs/dbraw/zinc/57/82/15/244578215.db2.gz ZTWNNOZOCOLZLE-GFCCVEGCSA-N 1 1 333.417 2.099 40 0 EEABMO CCOc1cc(C[N@H+]2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)ccc1OC ZINC000019531900 212039947 /nfs/dbraw/zinc/03/99/47/212039947.db2.gz ARSGXGNHIKBVST-HNNXBMFYSA-N 1 1 343.427 2.475 40 0 EEABMO O=C(Cc1ccccc1Cl)N1CC[NH+](CCCc2cn[nH]c2)CC1 ZINC000078047763 217014029 /nfs/dbraw/zinc/01/40/29/217014029.db2.gz 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C[C@H](C[NH2+]Cc1sccc1Br)CN1CCN(C)CC1 ZINC000097378290 463357087 /nfs/dbraw/zinc/35/70/87/463357087.db2.gz JYPGJDNNCPGLIS-GFCCVEGCSA-N 1 1 346.338 2.484 40 0 EEABMO COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc(OC)c(OC)c2)cc1 ZINC000072227141 463483950 /nfs/dbraw/zinc/48/39/50/463483950.db2.gz GXLCOFDTXAQTAB-SJORKVTESA-N 1 1 328.368 2.128 40 0 EEABMO Cc1cccc(CN2CC[C@]3(CCC[N@@H+](C[C@H]4CCOC4)C3)C2=O)n1 ZINC000107230027 463562182 /nfs/dbraw/zinc/56/21/82/463562182.db2.gz PGHZHVODIPBUCM-XLIONFOSSA-N 1 1 343.471 2.241 40 0 EEABMO Cc1ccc(N[C@@H]2C[N@@H+](CC3CCOCC3)C[C@@H]3CCCO[C@H]23)nn1 ZINC000107713591 463580032 /nfs/dbraw/zinc/58/00/32/463580032.db2.gz AMGUSXLOUBLCLH-SCTDSRPQSA-N 1 1 346.475 2.103 40 0 EEABMO Cc1cc(C[NH2+]CCCN2CCN(C)CC2)ccc1Br ZINC000073852444 463662768 /nfs/dbraw/zinc/66/27/68/463662768.db2.gz DBSDTPKFHMQXRS-UHFFFAOYSA-N 1 1 340.309 2.485 40 0 EEABMO CN(C)c1cc(C[C@@H]2COCC[N@@H+](Cc3ccsc3)C2)ncn1 ZINC000257282397 463760471 /nfs/dbraw/zinc/76/04/71/463760471.db2.gz 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O=C(C[C@@H]1C[N@@H+](C2CCCC2)Cc2ccnn21)NCC1CCOCC1 ZINC000247807560 464707637 /nfs/dbraw/zinc/70/76/37/464707637.db2.gz CGETWLVLVFXZQS-GOSISDBHSA-N 1 1 346.475 2.115 40 0 EEABMO O=C(C[C@@H]1C[N@H+](C2CCCC2)Cc2ccnn21)NCC1CCOCC1 ZINC000247807560 464707638 /nfs/dbraw/zinc/70/76/38/464707638.db2.gz CGETWLVLVFXZQS-GOSISDBHSA-N 1 1 346.475 2.115 40 0 EEABMO C[N@H+](Cc1ccccn1)[C@H]1CO[C@]2(C1)CCCN(C(=O)C1CC1)C2 ZINC000248136039 464732814 /nfs/dbraw/zinc/73/28/14/464732814.db2.gz RSJSNVHSDVMUCB-MJGOQNOKSA-N 1 1 329.444 2.074 40 0 EEABMO C[N@@H+](Cc1ccccn1)[C@H]1CO[C@]2(C1)CCCN(C(=O)C1CC1)C2 ZINC000248136039 464732815 /nfs/dbraw/zinc/73/28/15/464732815.db2.gz RSJSNVHSDVMUCB-MJGOQNOKSA-N 1 1 329.444 2.074 40 0 EEABMO C[C@@H]1C[C@@H](N2C(=O)[C@@H]3CCCN3C2=O)CC[N@H+]1Cc1ccccc1 ZINC000253630279 465019360 /nfs/dbraw/zinc/01/93/60/465019360.db2.gz WKLKSXSJUWMMBS-PVAVHDDUSA-N 1 1 327.428 2.466 40 0 EEABMO Cc1cn(C)c([C@H]2CCN(C(=O)CCn3cc[nH+]c3C(C)C)C2)n1 ZINC000585181436 468995417 /nfs/dbraw/zinc/99/54/17/468995417.db2.gz NUICQVMLAMMXNE-HNNXBMFYSA-N 1 1 329.448 2.455 40 0 EEABMO C[NH+](C)[C@@H]1[C@@H](O)[C@H](Oc2ccccc2)C[C@H]1NCc1ccccc1F ZINC000585262374 468996377 /nfs/dbraw/zinc/99/63/77/468996377.db2.gz CFKUMWAHLJPHAQ-ZRNYENFQSA-N 1 1 344.430 2.426 40 0 EEABMO Oc1ccc(C[N@H+]2CCOC[C@@](O)(COc3ccc(F)cc3)C2)cc1 ZINC000585274941 468999155 /nfs/dbraw/zinc/99/91/55/468999155.db2.gz RZEGBCVGUACKLR-LJQANCHMSA-N 1 1 347.386 2.174 40 0 EEABMO CO[C@]1(COc2ccc(C)cc2)CCC[N@@H+](CC2(O)CCOCC2)C1 ZINC000585277764 469003148 /nfs/dbraw/zinc/00/31/48/469003148.db2.gz OZEITBQGIXOZMB-HXUWFJFHSA-N 1 1 349.471 2.396 40 0 EEABMO CC(=O)N1CCC([N@H+]2CC[C@H](Cc3ccc(C)cc3)[C@@H](O)C2)CC1 ZINC000585280009 469006628 /nfs/dbraw/zinc/00/66/28/469006628.db2.gz VSTXBBVQRFMXEF-QUCCMNQESA-N 1 1 330.472 2.231 40 0 EEABMO O[C@H]1CC[N@H+](C2CCCC2)C[C@]1(O)COc1cc(F)ccc1F ZINC000585282672 469007837 /nfs/dbraw/zinc/00/78/37/469007837.db2.gz MOFXZBWAUODFDQ-IRXDYDNUSA-N 1 1 327.371 2.084 40 0 EEABMO O[C@H]1CC[N@H+](C2CCCC2)C[C@]1(O)COc1cc(F)cc(F)c1 ZINC000585284561 469008546 /nfs/dbraw/zinc/00/85/46/469008546.db2.gz YIAFAMQILMSDLH-IRXDYDNUSA-N 1 1 327.371 2.084 40 0 EEABMO CC(C)(C)CN1CC2(C1)C[N@@H+](Cc1ccccc1)C[C@@H]1COCCN12 ZINC000604381802 469475052 /nfs/dbraw/zinc/47/50/52/469475052.db2.gz PDQUWBKDNJCNAV-LJQANCHMSA-N 1 1 343.515 2.304 40 0 biogenic,in-vitro EEABMO CC(C)(C)C[NH+]1CC2(C1)CN(Cc1ccccc1)C[C@@H]1COCCN12 ZINC000604381802 469475053 /nfs/dbraw/zinc/47/50/53/469475053.db2.gz PDQUWBKDNJCNAV-LJQANCHMSA-N 1 1 343.515 2.304 40 0 biogenic,in-vitro EEABMO C[N@@H+](CCC(=O)N1CCC[C@H](Cc2cc[nH]n2)C1)Cc1ccccn1 ZINC000257251829 536302953 /nfs/dbraw/zinc/30/29/53/536302953.db2.gz JSKXLLUUEOHUHA-MRXNPFEDSA-N 1 1 341.459 2.108 40 0 EEABMO COc1ccc(F)cc1C(=O)N[C@@H]1CCC[C@@H](n2cc[nH+]c2C)[C@@H]1O ZINC000257254888 536616580 /nfs/dbraw/zinc/61/65/80/536616580.db2.gz KFDLTHJBTXGKPY-BFYDXBDKSA-N 1 1 347.390 2.224 40 0 EEABMO O=C1N[C@]2(CC[C@@H]3C[N@@H+](Cc4ccccn4)C[C@@H]32)Nc2ccccc21 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/nfs/dbraw/zinc/15/27/43/463152743.db2.gz TYWPCSMXLKBNHH-KRWDZBQOSA-N 1 1 345.472 2.052 40 0 EEABMO Cc1nc(CN2C[C@@]3(CC[N@@H+](Cc4ccccn4)C3)CC2=O)cs1 ZINC000096050914 463154963 /nfs/dbraw/zinc/15/49/63/463154963.db2.gz WCTUPYQNORVCLD-SFHVURJKSA-N 1 1 342.468 2.471 40 0 EEABMO Cc1ccc(C[N@H+]2C[C@@H]3CCN(Cc4cccnc4)C(=O)[C@H]3C2)o1 ZINC000096054634 463156589 /nfs/dbraw/zinc/15/65/89/463156589.db2.gz ZTUCXGXTKDNTTO-WMZOPIPTSA-N 1 1 325.412 2.464 40 0 EEABMO COc1ccc(C[N@@H+]2C[C@H]3CN(C(=O)c4cscn4)C[C@H]3C2)cc1 ZINC000096053937 463157011 /nfs/dbraw/zinc/15/70/11/463157011.db2.gz DBOWIUPJJSLMGW-GASCZTMLSA-N 1 1 343.452 2.356 40 0 EEABMO Cc1ccc(C[N@@H+]2C[C@H](NC(=O)c3cccnc3)[C@@H]3OCCC[C@@H]32)o1 ZINC000096056360 463158697 /nfs/dbraw/zinc/15/86/97/463158697.db2.gz WHOIEOGWDSVBHG-BZSNNMDCSA-N 1 1 341.411 2.145 40 0 EEABMO Cc1ccc(C[N@H+]2C[C@H](NC(=O)c3cccnc3)[C@@H]3OCCC[C@@H]32)o1 ZINC000096056360 463158704 /nfs/dbraw/zinc/15/87/04/463158704.db2.gz WHOIEOGWDSVBHG-BZSNNMDCSA-N 1 1 341.411 2.145 40 0 EEABMO O=C(NCC1CC1)[C@H]1CCC2(CC[NH+](Cc3nccs3)CC2)O1 ZINC000096061168 463161697 /nfs/dbraw/zinc/16/16/97/463161697.db2.gz NJSLCZJACHUNKC-CQSZACIVSA-N 1 1 335.473 2.183 40 0 EEABMO Cc1noc(C)c1C[N@H+]1CC[C@H]2O[C@@H](C(=O)NC3CCCC3)CC[C@H]21 ZINC000096065520 463162501 /nfs/dbraw/zinc/16/25/01/463162501.db2.gz UFSGWJGVBWPYMB-KZNAEPCWSA-N 1 1 347.459 2.472 40 0 EEABMO Cc1cnc(N2CCO[C@]3(CCC[N@H+](Cc4ccccn4)C3)C2)nc1 ZINC000096074943 463169628 /nfs/dbraw/zinc/16/96/28/463169628.db2.gz HRHYDMCUKBCVGL-IBGZPJMESA-N 1 1 339.443 2.051 40 0 EEABMO Cc1cnc(N2CCO[C@]3(CCC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC000096074943 463169631 /nfs/dbraw/zinc/16/96/31/463169631.db2.gz HRHYDMCUKBCVGL-IBGZPJMESA-N 1 1 339.443 2.051 40 0 EEABMO O=C(c1cccc(F)c1)N1C[C@@H]2CC[N@H+](CCN3CCCC3)C[C@@H]2C1 ZINC000096081479 463171030 /nfs/dbraw/zinc/17/10/30/463171030.db2.gz QKFBYNLEBCIQDQ-ZWKOTPCHSA-N 1 1 345.462 2.315 40 0 EEABMO O=C(c1cccc(F)c1)N1C[C@@H]2CC[N@@H+](CCN3CCCC3)C[C@@H]2C1 ZINC000096081479 463171033 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1 340.471 2.264 40 0 EEABMO c1cnc(NCc2cncc3c2CC[N@@H+](CC2CCOCC2)C3)nc1 ZINC000096189539 463201592 /nfs/dbraw/zinc/20/15/92/463201592.db2.gz RWZKSBFZEHLGTG-UHFFFAOYSA-N 1 1 339.443 2.268 40 0 EEABMO Cn1cc(C[N@H+]2CC[C@]3(CC(=O)N(c4ccc(F)c(F)c4)C3)C2)cn1 ZINC000096239049 463224328 /nfs/dbraw/zinc/22/43/28/463224328.db2.gz YBVAEPKYCRHYMW-SFHVURJKSA-N 1 1 346.381 2.327 40 0 EEABMO O=C(CN1CCC[N@@H+](Cc2ccccc2F)CC1)Nc1ccncc1 ZINC000096403717 463238153 /nfs/dbraw/zinc/23/81/53/463238153.db2.gz KZFVQMYTYCZBRZ-UHFFFAOYSA-N 1 1 342.418 2.367 40 0 EEABMO O=C(CN1CCC[N@H+](Cc2ccccc2F)CC1)Nc1ccncc1 ZINC000096403717 463238155 /nfs/dbraw/zinc/23/81/55/463238155.db2.gz KZFVQMYTYCZBRZ-UHFFFAOYSA-N 1 1 342.418 2.367 40 0 EEABMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)/C=C/c1ccnc2ccccc12 ZINC000096410154 463242281 /nfs/dbraw/zinc/24/22/81/463242281.db2.gz UTPNOXLYDYJCJN-MOEXGYKKSA-N 1 1 339.439 2.475 40 0 EEABMO C[N@@H+](CCc1ccc2c(c1)CCO2)[C@@H](C(N)=O)c1cccc(F)c1 ZINC000096443309 463268755 /nfs/dbraw/zinc/26/87/55/463268755.db2.gz MWTUJVOMLFLZKB-GOSISDBHSA-N 1 1 328.387 2.462 40 0 EEABMO C[C@@H]1C[NH+](CCCCNc2ccccc2S(C)(=O)=O)C[C@@H](C)O1 ZINC000096481008 463281741 /nfs/dbraw/zinc/28/17/41/463281741.db2.gz NKSNKIZREJBFFY-HUUCEWRRSA-N 1 1 340.489 2.391 40 0 EEABMO CCc1noc(C)c1C[NH2+][C@H](C)c1cccc(S(=O)(=O)NC)c1 ZINC000096491458 463286392 /nfs/dbraw/zinc/28/63/92/463286392.db2.gz OCCGUQVSGUMTDA-LLVKDONJSA-N 1 1 337.445 2.304 40 0 EEABMO COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2Cc2ccc(OC)c(OC)c2)c1 ZINC000072227072 463483827 /nfs/dbraw/zinc/48/38/27/463483827.db2.gz VNQBYXOTYICALP-ZWKOTPCHSA-N 1 1 342.395 2.123 40 0 EEABMO COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)cc1OC ZINC000072228194 463484608 /nfs/dbraw/zinc/48/46/08/463484608.db2.gz BRDHYEAURDXBIC-DLBZAZTESA-N 1 1 330.359 2.254 40 0 EEABMO CNC(=O)[C@@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2cn(C)c3ccccc23)O1 ZINC000107207150 463560888 /nfs/dbraw/zinc/56/08/88/463560888.db2.gz DVXOOSHTSWYOKT-KURKYZTESA-N 1 1 327.428 2.046 40 0 EEABMO Cn1cc(C[N@H+]2CCC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)cn1 ZINC000107228993 463562264 /nfs/dbraw/zinc/56/22/64/463562264.db2.gz IZXVLSQSVZBCOG-QZTJIDSGSA-N 1 1 328.416 2.018 40 0 EEABMO Cn1nccc1C[N@H+]1CC[C@]2(CCC[C@H]2C(=O)NCc2ccco2)C1 ZINC000108527079 463610181 /nfs/dbraw/zinc/61/01/81/463610181.db2.gz QAMIPVWGAGJICE-PKOBYXMFSA-N 1 1 342.443 2.322 40 0 EEABMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000257286608 463763688 /nfs/dbraw/zinc/76/36/88/463763688.db2.gz PMFMCLDBYUEWMW-KRWDZBQOSA-N 1 1 336.395 2.358 40 0 EEABMO CCn1cc(C[N@H+]2CC[C@@H]3OCC(=O)N(C)[C@H]3CC2)c2ccccc21 ZINC000257296847 463766605 /nfs/dbraw/zinc/76/66/05/463766605.db2.gz REPJCDZCVCVGPV-OALUTQOASA-N 1 1 341.455 2.483 40 0 EEABMO CN(C)c1cc(C[C@H]2COCC[N@@H+](Cc3cccs3)C2)ncn1 ZINC000257309105 463772558 /nfs/dbraw/zinc/77/25/58/463772558.db2.gz TZNZXIYHUNXESO-CQSZACIVSA-N 1 1 332.473 2.295 40 0 EEABMO Cc1nc(NC(=O)N2CC[N@H+]3CCC[C@H]3C2)ccc1Br ZINC000185578018 463845896 /nfs/dbraw/zinc/84/58/96/463845896.db2.gz GIZPIFSPJQWDTL-NSHDSACASA-N 1 1 339.237 2.464 40 0 EEABMO Cc1nc(NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)ccc1Br ZINC000185578004 463846199 /nfs/dbraw/zinc/84/61/99/463846199.db2.gz GIZPIFSPJQWDTL-LLVKDONJSA-N 1 1 339.237 2.464 40 0 EEABMO C[N@@H+]1CCN(CN2C(=O)CC3(CCCC3)C2=O)[C@@H](c2ccccc2)C1 ZINC000195529137 464072137 /nfs/dbraw/zinc/07/21/37/464072137.db2.gz OSHIFQFTIYFJNC-QGZVFWFLSA-N 1 1 341.455 2.252 40 0 EEABMO C[N@H+]1CCN(CN2C(=O)CC3(CCCC3)C2=O)[C@@H](c2ccccc2)C1 ZINC000195529137 464072142 /nfs/dbraw/zinc/07/21/42/464072142.db2.gz OSHIFQFTIYFJNC-QGZVFWFLSA-N 1 1 341.455 2.252 40 0 EEABMO C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1 ZINC000225425793 464160054 /nfs/dbraw/zinc/16/00/54/464160054.db2.gz CCQRXFNJYCDKLR-CABCVRRESA-N 1 1 327.428 2.209 40 0 EEABMO C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1 ZINC000225425793 464160062 /nfs/dbraw/zinc/16/00/62/464160062.db2.gz CCQRXFNJYCDKLR-CABCVRRESA-N 1 1 327.428 2.209 40 0 EEABMO Cn1cc([C@@H](CNC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)[NH+](C)C)cn1 ZINC000245281224 464470292 /nfs/dbraw/zinc/47/02/92/464470292.db2.gz AJKOEPCQAQEUBS-YESZJQIVSA-N 1 1 345.422 2.017 40 0 EEABMO O=S(=O)(c1ccoc1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000285250599 464500663 /nfs/dbraw/zinc/50/06/63/464500663.db2.gz RWTIJEYIYLZZJN-UHFFFAOYSA-N 1 1 346.452 2.491 40 0 EEABMO CCCc1cnc(NC(=O)NCCN2CC[N@@H+](C)C(C)(C)C2)s1 ZINC000281665923 464540469 /nfs/dbraw/zinc/54/04/69/464540469.db2.gz DJAGZEOBLNNWOY-UHFFFAOYSA-N 1 1 339.509 2.243 40 0 EEABMO Cn1cnc2c1[C@@H](C(=O)NCc1ccco1)C[N@@H+](C1CCCC1)C2 ZINC000248026486 464723588 /nfs/dbraw/zinc/72/35/88/464723588.db2.gz JQIWRYUEZKJCMC-HNNXBMFYSA-N 1 1 328.416 2.171 40 0 EEABMO Cn1cnc2c1[C@@H](C(=O)NCc1ccco1)C[N@H+](C1CCCC1)C2 ZINC000248026486 464723591 /nfs/dbraw/zinc/72/35/91/464723591.db2.gz JQIWRYUEZKJCMC-HNNXBMFYSA-N 1 1 328.416 2.171 40 0 EEABMO COC(=O)Cc1ccnc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000252490550 464967042 /nfs/dbraw/zinc/96/70/42/464967042.db2.gz KWURGENBRXXILN-KRWDZBQOSA-N 1 1 340.427 2.269 40 0 EEABMO CCCOc1ccc(NC(=O)C(=O)NC[C@@H]2CCC[N@H+]2CC)cc1 ZINC000192679897 464976089 /nfs/dbraw/zinc/97/60/89/464976089.db2.gz JPEBDYVOYUPDNS-HNNXBMFYSA-N 1 1 333.432 2.014 40 0 EEABMO Cc1cc(=O)[nH]c([C@H](C)N2CC[NH+]([C@H](C)c3ccccn3)CC2)n1 ZINC000192784978 464996529 /nfs/dbraw/zinc/99/65/29/464996529.db2.gz YDLXUVFUAOCLLB-CABCVRRESA-N 1 1 327.432 2.325 40 0 EEABMO C[C@@H]1C[C@H]1C(=O)N1CC2(C1)C[C@@H](COc1ccccn1)CC[N@H+]2C ZINC000306136590 466491645 /nfs/dbraw/zinc/49/16/45/466491645.db2.gz PXSYAPFXNDSAIF-OWCLPIDISA-N 1 1 329.444 2.039 40 0 EEABMO COCC(=O)N[C@H]1[C@H](c2ccccc2)[N@@H+](CCC(C)C)CC[C@@]1(C)O ZINC000514289188 467941939 /nfs/dbraw/zinc/94/19/39/467941939.db2.gz FWFPSFPTCYWMQB-SLFFLAALSA-N 1 1 348.487 2.362 40 0 biogenic,in-vitro EEABMO O=C(C[N@@H+]1CC[C@H](Cc2ccccc2F)[C@@H](O)C1)NC1CCCC1 ZINC000585278956 469005286 /nfs/dbraw/zinc/00/52/86/469005286.db2.gz JMXLKCHBJWDOOC-QAPCUYQASA-N 1 1 334.435 2.110 40 0 EEABMO O=C(C[N@H+]1CC[C@H](Cc2ccccc2F)[C@@H](O)C1)NC1CCCC1 ZINC000585278956 469005291 /nfs/dbraw/zinc/00/52/91/469005291.db2.gz JMXLKCHBJWDOOC-QAPCUYQASA-N 1 1 334.435 2.110 40 0 EEABMO O[C@]1(COc2ccc(F)c(F)c2)COCC[N@H+](C2CCCC2)C1 ZINC000585281330 469007541 /nfs/dbraw/zinc/00/75/41/469007541.db2.gz IKFDJRGFDLDOAA-KRWDZBQOSA-N 1 1 327.371 2.350 40 0 EEABMO O[C@@]1(COc2cc(F)cc(F)c2)COCC[N@H+](C2CCCC2)C1 ZINC000585283635 469007789 /nfs/dbraw/zinc/00/77/89/469007789.db2.gz SRYFKKBUAVNOJQ-QGZVFWFLSA-N 1 1 327.371 2.350 40 0 EEABMO CCCn1ncc(C[N@H+]2C[C@H](c3ccc(F)cc3)[C@@H](O)[C@H]2CO)c1C ZINC000585292343 469012064 /nfs/dbraw/zinc/01/20/64/469012064.db2.gz HSVKJRHWPHXJOB-GUDVDZBRSA-N 1 1 347.434 2.062 40 0 EEABMO CC(=O)N[C@H]1[C@H](c2ccccc2)[N@H+](Cc2cccnc2)CC[C@@]1(C)O ZINC000604382276 469475221 /nfs/dbraw/zinc/47/52/21/469475221.db2.gz MUPNFNCDYLAJBM-SLFFLAALSA-N 1 1 339.439 2.284 40 0 biogenic,in-vitro EEABMO CC(=O)N[C@H]1[C@H](c2ccccc2)[N@@H+](Cc2cccnc2)CC[C@@]1(C)O ZINC000604382276 469475225 /nfs/dbraw/zinc/47/52/25/469475225.db2.gz MUPNFNCDYLAJBM-SLFFLAALSA-N 1 1 339.439 2.284 40 0 biogenic,in-vitro EEABMO Cc1cccc(OC[C@@H](O)C[NH+]2CCN(c3ccccn3)CC2)c1C ZINC000022573247 524756900 /nfs/dbraw/zinc/75/69/00/524756900.db2.gz JVTUIUBKUWYEBL-SFHVURJKSA-N 1 1 341.455 2.260 40 0 EEABMO O=C([C@@H]1C[N@@H+](CC2CC2)[C@H]2c3cc(F)ccc3OC[C@H]21)N1CCC1 ZINC001772595902 1178866941 /nfs/dbraw/zinc/86/69/41/1178866941.db2.gz RVLJAJVXGILFMY-RYRKJORJSA-N 1 1 330.403 2.450 40 0 EEABMO COc1cccc(C[NH2+]Cc2cccc(NS(C)(=O)=O)c2)c1F ZINC000800218892 1202222160 /nfs/dbraw/zinc/22/21/60/1202222160.db2.gz DGSUVMUGBFDAIP-UHFFFAOYSA-N 1 1 338.404 2.496 40 0 EEABMO