smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]([NH2+]CCCC1CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1 ZINC001576243337 1089038334 /nfs/dbraw/zinc/03/83/34/1089038334.db2.gz AOGUYMPTONEDMB-KRWDZBQOSA-N 2 0 331.504 2.954 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)OCC3CC3)cc2)CC1 ZINC000840960054 1102581515 /nfs/dbraw/zinc/58/15/15/1102581515.db2.gz CSPHDPSDCPJVNJ-UHFFFAOYSA-N 2 0 331.504 2.733 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)[NH+](C)C)cc1 ZINC000898450136 1108944106 /nfs/dbraw/zinc/94/41/06/1108944106.db2.gz OGYWDEGGMCDWRT-IHPCNDPISA-N 2 0 330.520 2.572 20 10 EFCDRP CC[N@@H+](Cc1cc(C)c(Br)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236410178 1112616014 /nfs/dbraw/zinc/61/60/14/1112616014.db2.gz FQYFINHICNRPQO-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP CCOc1ccc(O)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1 ZINC000359872785 201113885 /nfs/dbraw/zinc/11/38/85/201113885.db2.gz KXLVFNSPTHAVEL-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000166322547 239123539 /nfs/dbraw/zinc/12/35/39/239123539.db2.gz GSEDHSWSLQVDNA-VYDXJSESSA-N 2 0 347.478 2.938 20 10 EFCDRP C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000166322903 239124932 /nfs/dbraw/zinc/12/49/32/239124932.db2.gz GSEDHSWSLQVDNA-YQQAZPJKSA-N 2 0 347.478 2.938 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000271175923 240629302 /nfs/dbraw/zinc/62/93/02/240629302.db2.gz BFRKAEOTXMEXLJ-UHFFFAOYSA-N 2 0 331.504 2.691 20 10 EFCDRP Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CC2 ZINC000296490618 241088426 /nfs/dbraw/zinc/08/84/26/241088426.db2.gz POHIGHPVPFTFBH-OALUTQOASA-N 2 0 338.451 2.736 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000154885387 533497800 /nfs/dbraw/zinc/49/78/00/533497800.db2.gz PSRXLAYUXQADLY-RBUKOAKNSA-N 2 0 344.547 2.963 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cc(F)ccc1O ZINC000185042467 473309827 /nfs/dbraw/zinc/30/98/27/473309827.db2.gz GRMIIIRGLCSDRI-CQSZACIVSA-N 2 0 344.434 2.529 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c(O)c1 ZINC000185042339 473309257 /nfs/dbraw/zinc/30/92/57/473309257.db2.gz OGGVVKXRGBQWQH-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cc(Cl)ccc1O ZINC000185414264 473420076 /nfs/dbraw/zinc/42/00/76/473420076.db2.gz XRVGJXHHXROGRG-DZGCQCFKSA-N 2 0 326.868 2.933 20 10 EFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c1 ZINC000185491882 473441384 /nfs/dbraw/zinc/44/13/84/473441384.db2.gz WKWDLRJFTDYQGI-HUUCEWRRSA-N 2 0 334.460 2.552 20 10 EFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000185865034 473533467 /nfs/dbraw/zinc/53/34/67/473533467.db2.gz PXEHPHWGNZGBQK-IBGZPJMESA-N 2 0 344.547 2.793 20 10 EFCDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000152405461 473558938 /nfs/dbraw/zinc/55/89/38/473558938.db2.gz YPFHRAHNIDLRGB-JKSUJKDBSA-N 2 0 347.478 2.797 20 10 EFCDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000152405563 473559017 /nfs/dbraw/zinc/55/90/17/473559017.db2.gz YPFHRAHNIDLRGB-HZPDHXFCSA-N 2 0 347.478 2.797 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000152423402 473561201 /nfs/dbraw/zinc/56/12/01/473561201.db2.gz VROXWKNXEPJONJ-INIZCTEOSA-N 2 0 329.488 2.738 20 10 EFCDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000115628913 473587964 /nfs/dbraw/zinc/58/79/64/473587964.db2.gz MBACJSZXEYGOCQ-XLIONFOSSA-N 2 0 333.520 2.979 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cc1 ZINC000186591638 473696007 /nfs/dbraw/zinc/69/60/07/473696007.db2.gz OMSBEXDPIBWSKV-ZWKOTPCHSA-N 2 0 332.536 2.819 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000179884113 473748484 /nfs/dbraw/zinc/74/84/84/473748484.db2.gz DCYGSLQEOLWNNP-HOTGVXAUSA-N 2 0 348.487 2.722 20 10 EFCDRP Cc1cccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1O ZINC000179909600 473752110 /nfs/dbraw/zinc/75/21/10/473752110.db2.gz VWWQWTHQDYXKNR-QZTJIDSGSA-N 2 0 331.504 2.691 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1O ZINC000183723768 474419908 /nfs/dbraw/zinc/41/99/08/474419908.db2.gz HDFIOQIWOKFXKK-QAPCUYQASA-N 2 0 326.440 2.810 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1C ZINC000273389265 474875296 /nfs/dbraw/zinc/87/52/96/474875296.db2.gz KIZBDRQAWKFXGP-PKOBYXMFSA-N 2 0 333.520 2.932 20 10 EFCDRP CCOc1cccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CCOC)c1O ZINC000293978470 475060205 /nfs/dbraw/zinc/06/02/05/475060205.db2.gz KTBRJRZOKSGFKY-JWTNVVGKSA-N 2 0 348.487 2.865 20 10 EFCDRP COc1ccc(N2CC[NH+](CCCNc3ccccn3)CC2)cc1 ZINC000301075034 476158201 /nfs/dbraw/zinc/15/82/01/476158201.db2.gz OYVDLYKUAASSSW-UHFFFAOYSA-N 2 0 326.444 2.714 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)cc1C ZINC000362447068 476257270 /nfs/dbraw/zinc/25/72/70/476257270.db2.gz GCVXCZWHJXUSAM-UHFFFAOYSA-N 2 0 345.531 2.999 20 10 EFCDRP CC[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000370637900 476908931 /nfs/dbraw/zinc/90/89/31/476908931.db2.gz VULIJEISYKUYAJ-WIYYLYMNSA-N 2 0 344.547 2.962 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1cc(Cl)ccc1O ZINC000368328340 477798164 /nfs/dbraw/zinc/79/81/64/477798164.db2.gz OXXABPXTZANBPC-UKRRQHHQSA-N 2 0 337.895 2.865 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@@H](C)C[NH+]3CCCC3)CC2)cc1 ZINC000165300105 533999681 /nfs/dbraw/zinc/99/96/81/533999681.db2.gz CRYMHJFOIPDMTR-QGZVFWFLSA-N 2 0 331.504 2.986 20 10 EFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000165991114 528037019 /nfs/dbraw/zinc/03/70/19/528037019.db2.gz MIHOECMJMMVJIS-HXUWFJFHSA-N 2 0 349.519 2.610 20 10 EFCDRP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756399124 575730677 /nfs/dbraw/zinc/73/06/77/575730677.db2.gz MLTKFNFJRXPTPL-INIZCTEOSA-N 2 0 345.531 2.948 20 10 EFCDRP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000756399121 575730876 /nfs/dbraw/zinc/73/08/76/575730876.db2.gz MLIDQUBFNXSABH-ZDUSSCGKSA-N 2 0 325.884 2.722 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2c1c(F)ccc2O ZINC000756408420 575732621 /nfs/dbraw/zinc/73/26/21/575732621.db2.gz MHKZUIMKYIQGDV-ZBFHGGJFSA-N 2 0 335.467 2.697 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756412931 575733848 /nfs/dbraw/zinc/73/38/48/575733848.db2.gz WKQAPNILJMEGFB-IIAWOOMASA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2c1c(F)ccc2O ZINC000756533532 575756057 /nfs/dbraw/zinc/75/60/57/575756057.db2.gz IOLMWLIGAJZRRC-WMLDXEAASA-N 2 0 349.494 2.943 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2c1c(F)ccc2O ZINC000756533530 575756073 /nfs/dbraw/zinc/75/60/73/575756073.db2.gz IOLMWLIGAJZRRC-RHSMWYFYSA-N 2 0 349.494 2.943 20 10 EFCDRP CC[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000764841943 576510587 /nfs/dbraw/zinc/51/05/87/576510587.db2.gz VSVIPVAOHQWKQA-LJQANCHMSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000765039235 576539751 /nfs/dbraw/zinc/53/97/51/576539751.db2.gz SFYCCFAEDQBVQQ-QRFRQXIXSA-N 2 0 329.488 2.801 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCCN3C3CC3)cc2)CC1 ZINC000766226676 577123908 /nfs/dbraw/zinc/12/39/08/577123908.db2.gz TZAVCEHETRVJSZ-OAQYLSRUSA-N 2 0 342.531 2.545 20 10 EFCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3c(cc2O)OC[C@H]3O)CC1 ZINC000768449735 577275091 /nfs/dbraw/zinc/27/50/91/577275091.db2.gz ZSWIFMCHZDWCIL-LJQANCHMSA-N 2 0 348.487 2.762 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1cc2c(cc1O)CCCC2 ZINC000768461425 577275588 /nfs/dbraw/zinc/27/55/88/577275588.db2.gz CWNRPXBBYYEAGG-DYXWJJEUSA-N 2 0 344.499 2.955 20 10 EFCDRP COC[C@@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768539887 577282019 /nfs/dbraw/zinc/28/20/19/577282019.db2.gz DDPHLUZXLOHZIW-LJQANCHMSA-N 2 0 331.504 2.687 20 10 EFCDRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769513592 577368871 /nfs/dbraw/zinc/36/88/71/577368871.db2.gz CGKVJVWGRARBSJ-HXUWFJFHSA-N 2 0 343.515 2.687 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@@H](OCC[NH+](CC)CC)C2)c1O ZINC000769515461 577369285 /nfs/dbraw/zinc/36/92/85/577369285.db2.gz QTVRWFDYFSNIFO-QGZVFWFLSA-N 2 0 336.476 2.724 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)cc2)CC1 ZINC000771844308 581249831 /nfs/dbraw/zinc/24/98/31/581249831.db2.gz YMIHVHKILHODHJ-AQNXPRMDSA-N 2 0 343.515 2.732 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@H]4CCCO[C@H]4C3(C)C)cc2)CC1 ZINC000771844312 581249968 /nfs/dbraw/zinc/24/99/68/581249968.db2.gz YMIHVHKILHODHJ-VAMGGRTRSA-N 2 0 343.515 2.732 20 10 EFCDRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000771888370 581255202 /nfs/dbraw/zinc/25/52/02/581255202.db2.gz OLQHXRCCKZCPBX-ICSRJNTNSA-N 2 0 331.504 2.732 20 10 EFCDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000850567753 1250540375 /nfs/dbraw/zinc/54/03/75/1250540375.db2.gz IMBNJMGUCXDENY-UHFFFAOYSA-N 2 0 331.504 2.610 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850584682 1250548540 /nfs/dbraw/zinc/54/85/40/1250548540.db2.gz TVDZISIJGQADTG-CQSZACIVSA-N 2 0 346.471 2.951 20 10 EFCDRP COc1cccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1O ZINC000180795106 1252489761 /nfs/dbraw/zinc/48/97/61/1252489761.db2.gz QYVLZAJMOZRIHY-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc3c(c2)CCCO3)ccn1 ZINC000921941715 1263649101 /nfs/dbraw/zinc/64/91/01/1263649101.db2.gz KMBGJOUDDIYHMD-UHFFFAOYSA-N 2 0 341.455 2.637 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CO)c1ccccc1 ZINC000824696835 1278230524 /nfs/dbraw/zinc/23/05/24/1278230524.db2.gz UWKNCQOUXRRIGI-NRFANRHFSA-N 2 0 339.483 2.604 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000824750247 1278281969 /nfs/dbraw/zinc/28/19/69/1278281969.db2.gz FRUCBIYNRAYQFX-IBGZPJMESA-N 2 0 343.515 2.877 20 10 EFCDRP CCN1CC[NH+](CCCC[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825108278 1278411364 /nfs/dbraw/zinc/41/13/64/1278411364.db2.gz SPKYSVGQFSSWRW-UHFFFAOYSA-N 2 0 339.911 2.861 20 10 EFCDRP CCN(C)c1ccc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1 ZINC000741754868 1269690258 /nfs/dbraw/zinc/69/02/58/1269690258.db2.gz ZCDWQKFEZPHDJA-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1ccc(Br)cc1O ZINC000825436535 1278564165 /nfs/dbraw/zinc/56/41/65/1278564165.db2.gz VTHVRYASQBVSDG-CQSZACIVSA-N 2 0 345.281 2.601 20 10 EFCDRP C[NH+]1CCC(CC[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000691489379 1274723082 /nfs/dbraw/zinc/72/30/82/1274723082.db2.gz QRTCRPWJRIBPJY-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(O)ccc2ccncc21 ZINC000746644220 1275682712 /nfs/dbraw/zinc/68/27/12/1275682712.db2.gz ASNXLNRPJWASJD-XFQXTVEOSA-N 2 0 341.455 2.624 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)C(C)(C)OC)cc2F)CC1 ZINC000788592092 1276234830 /nfs/dbraw/zinc/23/48/30/1276234830.db2.gz AEACETVUBKXSAT-OAHLLOKOSA-N 2 0 337.483 2.871 20 10 EFCDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893107 1276363043 /nfs/dbraw/zinc/36/30/43/1276363043.db2.gz DRBPIJRAJIBCHD-UYAOXDASSA-N 2 0 331.504 2.502 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000817894917 1276364259 /nfs/dbraw/zinc/36/42/59/1276364259.db2.gz OXGCZCRYQAYMGA-HSALFYBXSA-N 2 0 329.488 2.534 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC[C@H]3C[NH3+])cc2F)CC1 ZINC000817902641 1276366880 /nfs/dbraw/zinc/36/68/80/1276366880.db2.gz VVKUIMFIBWJEAN-HKUYNNGSSA-N 3 0 348.510 2.575 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1F ZINC000817903262 1276366914 /nfs/dbraw/zinc/36/69/14/1276366914.db2.gz LOJLNNLZJGNQBV-QXAKKESOSA-N 2 0 349.494 2.919 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903886 1276368760 /nfs/dbraw/zinc/36/87/60/1276368760.db2.gz WNNFNAVLDFAWJK-SUMWQHHRSA-N 2 0 339.430 2.974 20 10 EFCDRP COc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000817940329 1276386223 /nfs/dbraw/zinc/38/62/23/1276386223.db2.gz GBBQOKSYEXIJOD-GUYCJALGSA-N 2 0 329.444 2.817 20 10 EFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000817942762 1276387971 /nfs/dbraw/zinc/38/79/71/1276387971.db2.gz QVLHLRIVLZOQDM-ZGXWSNOMSA-N 2 0 330.520 2.653 20 10 EFCDRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000817978021 1276416793 /nfs/dbraw/zinc/41/67/93/1276416793.db2.gz UCENUZGCLMCJAE-KBPBESRZSA-N 2 0 325.884 2.955 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000817976629 1276417063 /nfs/dbraw/zinc/41/70/63/1276417063.db2.gz PWOQKPHMLFRWQM-HZMBPMFUSA-N 2 0 325.250 2.947 20 10 EFCDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817981626 1276420088 /nfs/dbraw/zinc/42/00/88/1276420088.db2.gz UCEYDTUUYFEPEK-DOTOQJQBSA-N 2 0 335.467 2.845 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817985485 1276423568 /nfs/dbraw/zinc/42/35/68/1276423568.db2.gz KPPMAHZSMSDNKW-DZOHQFGASA-N 2 0 347.478 2.701 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c(O)c1 ZINC000844902541 1279324149 /nfs/dbraw/zinc/32/41/49/1279324149.db2.gz OWKBGZLTGCPXIB-FCEWJHQRSA-N 2 0 334.460 2.509 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000844902454 1279324945 /nfs/dbraw/zinc/32/49/45/1279324945.db2.gz MYINEGWICGNXKF-BJLQDIEVSA-N 2 0 331.504 2.779 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902463 1279325335 /nfs/dbraw/zinc/32/53/35/1279325335.db2.gz NCZLMNPZUXLALN-LESCRADOSA-N 2 0 334.460 2.509 20 10 EFCDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000844925635 1279344463 /nfs/dbraw/zinc/34/44/63/1279344463.db2.gz DMMGAFFGIPKDDF-OAHLLOKOSA-N 2 0 335.467 2.703 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000793609688 1279772667 /nfs/dbraw/zinc/77/26/67/1279772667.db2.gz REFUQLMYSPVKKI-UXHICEINSA-N 2 0 329.488 2.582 20 10 EFCDRP CC[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CO1 ZINC000846026759 1279986230 /nfs/dbraw/zinc/98/62/30/1279986230.db2.gz HFOZHTYOMCBDHH-ICSRJNTNSA-N 2 0 331.504 2.828 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c1O ZINC000846155536 1280040725 /nfs/dbraw/zinc/04/07/25/1280040725.db2.gz HACBROKJOJPOSD-WBAXXEDZSA-N 2 0 348.487 2.819 20 10 EFCDRP COc1ccc(C[NH2+][C@@H](C)C[C@@H](C)NC(=O)C[N@H+](C)C(C)C)cc1C ZINC001146600031 1280947931 /nfs/dbraw/zinc/94/79/31/1280947931.db2.gz DSUSHHMOUBVLAQ-DLBZAZTESA-N 2 0 349.519 2.717 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](O)c1ccccc1 ZINC000808446914 1281715131 /nfs/dbraw/zinc/71/51/31/1281715131.db2.gz XLSUJIRPEMJJDE-UTKZUKDTSA-N 2 0 339.483 2.650 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3COc4ccccc43)cc2)CC1 ZINC000808451817 1281716242 /nfs/dbraw/zinc/71/62/42/1281716242.db2.gz YINLAFVHSWYHLY-GOSISDBHSA-N 2 0 337.467 2.704 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693295 1281846895 /nfs/dbraw/zinc/84/68/95/1281846895.db2.gz YOBCQLBAFBGGBQ-DZGCQCFKSA-N 2 0 339.911 2.888 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c1O ZINC000808690920 1281847340 /nfs/dbraw/zinc/84/73/40/1281847340.db2.gz GZHMBLUDVLXDHT-KGLIPLIRSA-N 2 0 325.884 2.641 20 10 EFCDRP COc1cc(Cl)cc(C[NH2+]CC2(SC)CC[NH+](C)CC2)c1O ZINC000811512950 1284391022 /nfs/dbraw/zinc/39/10/22/1284391022.db2.gz BKIAJHDFHYPFJC-UHFFFAOYSA-N 2 0 344.908 2.971 20 10 EFCDRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816551125 1288199942 /nfs/dbraw/zinc/19/99/42/1288199942.db2.gz PVESJCPEUYYSBJ-GOSISDBHSA-N 2 0 328.456 2.872 20 10 EFCDRP CC[C@@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](CC)O1 ZINC000817412073 1288590492 /nfs/dbraw/zinc/59/04/92/1288590492.db2.gz CLFLZYCRIVFEBC-WOJBJXKFSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)nc1)Cc1ccccc1O ZINC001232361980 1312687792 /nfs/dbraw/zinc/68/77/92/1312687792.db2.gz HORFXSVJIJHTSY-UHFFFAOYSA-N 2 0 340.471 2.561 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C)C1CC[NH+](C)CC1 ZINC000903448363 1312694472 /nfs/dbraw/zinc/69/44/72/1312694472.db2.gz NSVKSCGUYQCJDN-OXQOHEQNSA-N 2 0 332.536 2.675 20 10 EFCDRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1Cn1cccn1 ZINC000873069464 1289551546 /nfs/dbraw/zinc/55/15/46/1289551546.db2.gz GCEWZUAATGRAEC-RBUKOAKNSA-N 2 0 342.487 2.902 20 10 EFCDRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1Cn1cccn1 ZINC000873069460 1289551583 /nfs/dbraw/zinc/55/15/83/1289551583.db2.gz GCEWZUAATGRAEC-MOPGFXCFSA-N 2 0 342.487 2.902 20 10 EFCDRP CC[C@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc(F)cc1O ZINC000873244096 1289676392 /nfs/dbraw/zinc/67/63/92/1289676392.db2.gz FEBUKJXEYNXGCV-INIZCTEOSA-N 2 0 330.407 2.899 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3cccc4O)cc2)CC1 ZINC000824565435 1289702266 /nfs/dbraw/zinc/70/22/66/1289702266.db2.gz UYXWKMYYHKPPJE-HXUWFJFHSA-N 2 0 337.467 2.921 20 10 EFCDRP COc1ccc(C[NH2+]CCCNC(=O)C[N@H+](C)CC(C)(C)C)cc1C ZINC001166744145 1312833260 /nfs/dbraw/zinc/83/32/60/1312833260.db2.gz JQWOQVNLVUWNRM-UHFFFAOYSA-N 2 0 349.519 2.577 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c(O)c1 ZINC000877191469 1291161144 /nfs/dbraw/zinc/16/11/44/1291161144.db2.gz WIJMFOKNFPXXJJ-LJQANCHMSA-N 2 0 326.440 2.557 20 10 EFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877528294 1291262283 /nfs/dbraw/zinc/26/22/83/1291262283.db2.gz XSEJYYGZHHCGLF-UHFFFAOYSA-N 2 0 345.531 2.956 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3c(C)cccc3O)CC2)CC1 ZINC000877596483 1291286258 /nfs/dbraw/zinc/28/62/58/1291286258.db2.gz SQNVZLSVYHJCLD-UHFFFAOYSA-N 2 0 331.504 2.693 20 10 EFCDRP CC[N@H+]1C[C@H]2CN(Cc3cc(Br)cc(C)c3O)C[C@H]2C1 ZINC001233111531 1312856590 /nfs/dbraw/zinc/85/65/90/1312856590.db2.gz SGAAHFLUOXVTMU-OKILXGFUSA-N 2 0 339.277 2.847 20 10 EFCDRP CC[C@@H]([NH2+]CCCN1CCC(O)CC1)c1cc(Cl)ccc1O ZINC000775490337 1292706941 /nfs/dbraw/zinc/70/69/41/1292706941.db2.gz WDGLMRYCHCCPGN-MRXNPFEDSA-N 2 0 326.868 2.933 20 10 EFCDRP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775500909 1292783219 /nfs/dbraw/zinc/78/32/19/1292783219.db2.gz AUMQZYBLTOLXNL-BBRMVZONSA-N 2 0 325.884 2.722 20 10 EFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccccc1O)C2 ZINC001203552944 1312955051 /nfs/dbraw/zinc/95/50/51/1312955051.db2.gz WFABVZBLMMIZLN-QUCCMNQESA-N 2 0 330.472 2.573 20 10 EFCDRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883290014 1293532789 /nfs/dbraw/zinc/53/27/89/1293532789.db2.gz IHBMGLMGCXCTKY-AZUAARDMSA-N 2 0 331.504 2.733 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cn1 ZINC000883290022 1293533080 /nfs/dbraw/zinc/53/30/80/1293533080.db2.gz ILAFRDAIDKJYBV-OAHLLOKOSA-N 2 0 328.435 2.823 20 10 EFCDRP C[NH+](C)CC1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000132798818 1293708018 /nfs/dbraw/zinc/70/80/18/1293708018.db2.gz FKLCKGKCHQATHW-UHFFFAOYSA-N 2 0 327.266 2.928 20 10 EFCDRP COCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000775656608 1293919580 /nfs/dbraw/zinc/91/95/80/1293919580.db2.gz KWCUOCNUKVWOMJ-UHFFFAOYSA-N 2 0 331.504 2.829 20 10 EFCDRP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775716691 1294232919 /nfs/dbraw/zinc/23/29/19/1294232919.db2.gz LBXJJCTXSKXGEN-HXUWFJFHSA-N 3 0 344.547 2.745 20 10 EFCDRP CC[NH+](CC)CCN1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204319874 1313122002 /nfs/dbraw/zinc/12/20/02/1313122002.db2.gz HUZYLLZQAOVRTF-UHFFFAOYSA-N 2 0 344.547 2.746 20 10 EFCDRP C[N@@H+]1CCCN(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000105477003 1296111854 /nfs/dbraw/zinc/11/18/54/1296111854.db2.gz LHENPHOIEQKBMC-UHFFFAOYSA-N 2 0 344.547 2.794 20 10 EFCDRP Cc1c(CN2CCOC[C@]3(CCC[NH2+]C3)C2)c2ccccc2n1C ZINC001235008754 1313222963 /nfs/dbraw/zinc/22/29/63/1313222963.db2.gz QPZQTSXMXOZFDR-FQEVSTJZSA-N 2 0 327.472 2.689 20 10 EFCDRP Oc1ccccc1C[N@@H+]1CCC[C@]2(CC[NH+](CCn3ccnc3)C2)C1 ZINC001275267350 1296245938 /nfs/dbraw/zinc/24/59/38/1296245938.db2.gz MAPIHVYZMIMIOS-HXUWFJFHSA-N 2 0 340.471 2.577 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001275802925 1296413553 /nfs/dbraw/zinc/41/35/53/1296413553.db2.gz PHWKGJYGDSIJRT-HDICACEKSA-N 2 0 345.531 2.900 20 10 EFCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC1 ZINC001205266420 1313262318 /nfs/dbraw/zinc/26/23/18/1313262318.db2.gz UIGPMOSAIXYKEC-HXUWFJFHSA-N 2 0 329.488 2.794 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(OC)c1 ZINC001235228334 1313269780 /nfs/dbraw/zinc/26/97/80/1313269780.db2.gz LVESVXKCBREMDV-QGZVFWFLSA-N 2 0 334.460 2.764 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235408521 1313314788 /nfs/dbraw/zinc/31/47/88/1313314788.db2.gz UJVVMIJHNYBBCW-GJZGRUSLSA-N 2 0 332.341 2.935 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)ccc21 ZINC001235424343 1313317979 /nfs/dbraw/zinc/31/79/79/1313317979.db2.gz HBSLPTUWVQGGAF-MSOLQXFVSA-N 2 0 329.488 2.727 20 10 EFCDRP Cc1cc(C[N@H+](C)CC2CC[NH2+]CC2)c(O)cc1Br ZINC001235431874 1313319820 /nfs/dbraw/zinc/31/98/20/1313319820.db2.gz DSBUASQIMXJCCH-UHFFFAOYSA-N 2 0 327.266 2.895 20 10 EFCDRP Cc1cc(Br)cc(C[N@H+](C)CC2CC[NH2+]CC2)c1O ZINC001235433738 1313320724 /nfs/dbraw/zinc/32/07/24/1313320724.db2.gz NWLOWOWMFTVYDU-UHFFFAOYSA-N 2 0 327.266 2.895 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc(O)c(Br)cc2O)CC[C@H]1C[NH3+] ZINC001205651126 1313331061 /nfs/dbraw/zinc/33/10/61/1313331061.db2.gz AIWFVKOZDFLMHE-MNOVXSKESA-N 2 0 343.265 2.667 20 10 EFCDRP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001205904888 1313373788 /nfs/dbraw/zinc/37/37/88/1313373788.db2.gz XXZVFCOVAAKJHZ-GOEBONIOSA-N 2 0 329.488 2.650 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC[C@@H]1C[NH3+] ZINC001205991403 1313387591 /nfs/dbraw/zinc/38/75/91/1313387591.db2.gz AOJALUVMGXOSMN-DOTOQJQBSA-N 2 0 343.515 2.898 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c2ccccc2n1C ZINC001206012259 1313391276 /nfs/dbraw/zinc/39/12/76/1313391276.db2.gz JIKFFQJTGRBZML-HUUCEWRRSA-N 2 0 343.471 2.772 20 10 EFCDRP C[N@H+](CCc1ccc(F)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235839251 1313406882 /nfs/dbraw/zinc/40/68/82/1313406882.db2.gz PKKVUGIMOAKRLJ-UHFFFAOYSA-N 2 0 327.447 2.910 20 10 EFCDRP COCC[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CC[NH2+]CC1 ZINC001235942481 1313421286 /nfs/dbraw/zinc/42/12/86/1313421286.db2.gz DNEXRGIVPSGQKC-UHFFFAOYSA-N 2 0 343.515 2.586 20 10 EFCDRP CCOc1ccc(C[N@@H+]2C[C@H]3C[NH2+]C[C@@]3(c3ccccc3)C2)c(O)c1 ZINC001236009215 1313430912 /nfs/dbraw/zinc/43/09/12/1313430912.db2.gz AZIDDDHSQHGZSR-NQIIRXRSSA-N 2 0 338.451 2.764 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(C[NH3+])CC3)cc2)CC1 ZINC001206311394 1313434552 /nfs/dbraw/zinc/43/45/52/1313434552.db2.gz NMCLJFURWNLFBE-NRFANRHFSA-N 3 0 344.547 2.779 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@H](N3CC([NH3+])C3)C2)cc1 ZINC001236073427 1313437868 /nfs/dbraw/zinc/43/78/68/1313437868.db2.gz MZBDLBMHMHYKQM-OAQYLSRUSA-N 2 0 338.499 2.701 20 10 EFCDRP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C1 ZINC001206344680 1313439040 /nfs/dbraw/zinc/43/90/40/1313439040.db2.gz WOMSKMGQHXINJF-HXUWFJFHSA-N 2 0 347.478 2.744 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CCSc3ccccc3C1)C[NH2+]CCO2 ZINC001236241176 1313460098 /nfs/dbraw/zinc/46/00/98/1313460098.db2.gz QPHZSAVLXFJGIY-UHFFFAOYSA-N 2 0 342.464 2.982 20 10 EFCDRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC001206554032 1313474799 /nfs/dbraw/zinc/47/47/99/1313474799.db2.gz AKMVCNOJCBOLFJ-FQEVSTJZSA-N 2 0 331.504 2.599 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)cc(C)c1O)C[C@@H]1CC[NH2+]C1 ZINC001236409164 1313476913 /nfs/dbraw/zinc/47/69/13/1313476913.db2.gz SJURGPZNUMZFRH-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP O=C(c1ccccc1)[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236434831 1313481173 /nfs/dbraw/zinc/48/11/73/1313481173.db2.gz WVPKVSCEWHITIE-HXUWFJFHSA-N 2 0 349.478 2.801 20 10 EFCDRP CC[NH+]1C[C@@H]2CN(Cc3cc(C)cc(Br)c3O)C[C@H]2C1 ZINC001236670975 1313506593 /nfs/dbraw/zinc/50/65/93/1313506593.db2.gz QYUHCZHQVDHDHW-ZIAGYGMSSA-N 2 0 339.277 2.847 20 10 EFCDRP CCOC(=O)c1c(CN2C[C@@H](C[NH3+])CC[C@H]2C)c2ccccc2n1C ZINC001206811153 1313514666 /nfs/dbraw/zinc/51/46/66/1313514666.db2.gz QYXDJNTVEZVKLV-HUUCEWRRSA-N 2 0 343.471 2.914 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@H](Oc3ccncc3C)C2)cc1OC ZINC001236753131 1313522327 /nfs/dbraw/zinc/52/23/27/1313522327.db2.gz HDYZFHPGBWQTIU-HNNXBMFYSA-N 2 0 344.411 2.766 20 10 EFCDRP C[N@H+]1C[C@@H]2C[NH+](Cc3cc(OCc4ccccc4)ccc3O)C[C@@H]2C1 ZINC001236787643 1313529435 /nfs/dbraw/zinc/52/94/35/1313529435.db2.gz BNFKEWXZJFFAFZ-KDURUIRLSA-N 2 0 338.451 2.965 20 10 EFCDRP CCC[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C[C@H]1CC[NH2+]C1 ZINC001236835676 1313538342 /nfs/dbraw/zinc/53/83/42/1313538342.db2.gz OQHIKFKBSMMLHG-INIZCTEOSA-N 2 0 343.515 2.913 20 10 EFCDRP CN(C)c1ccc(CN(CC[NH+](C)C)C2CC[NH2+]CC2)c(Cl)c1 ZINC001236912502 1313551178 /nfs/dbraw/zinc/55/11/78/1313551178.db2.gz SLCYIPLIVQXOKI-UHFFFAOYSA-N 2 0 338.927 2.522 20 10 EFCDRP C[NH+](C)CCN(Cc1cccc(C(C)(C)C)c1O)[C@@H]1CCC[NH2+]C1 ZINC001236930425 1313555367 /nfs/dbraw/zinc/55/53/67/1313555367.db2.gz AMKMIBGHNPJQHL-QGZVFWFLSA-N 2 0 333.520 2.805 20 10 EFCDRP CN(C)c1ccc(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c(Cl)c1 ZINC001236930474 1313555644 /nfs/dbraw/zinc/55/56/44/1313555644.db2.gz AYYCKJIFUZHXFO-QGZVFWFLSA-N 2 0 338.927 2.522 20 10 EFCDRP COC1(C)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236932600 1313556526 /nfs/dbraw/zinc/55/65/26/1313556526.db2.gz SMPAKUPXEYGQAW-UHFFFAOYSA-N 2 0 335.467 2.578 20 10 EFCDRP COCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236940436 1313557209 /nfs/dbraw/zinc/55/72/09/1313557209.db2.gz QZXFGJCURZEHIO-SFHVURJKSA-N 2 0 349.494 2.969 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4CCCO[C@@H]4C3)c(F)c2)CC1 ZINC001236935215 1313557402 /nfs/dbraw/zinc/55/74/02/1313557402.db2.gz GMOAOLGFVSNSRE-OXQOHEQNSA-N 2 0 347.478 2.578 20 10 EFCDRP C[NH+](C)CCN(Cc1cccc(C(F)(F)F)c1O)[C@H]1CCC[NH2+]C1 ZINC001236934942 1313557606 /nfs/dbraw/zinc/55/76/06/1313557606.db2.gz ZWZSKPHROFVDFE-AWEZNQCLSA-N 2 0 345.409 2.527 20 10 EFCDRP CC[NH+](CC)CCN1CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237044794 1313574479 /nfs/dbraw/zinc/57/44/79/1313574479.db2.gz DNXUBCQKMDETIK-UHFFFAOYSA-N 2 0 333.520 2.975 20 10 EFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C[C@@H]2C1 ZINC001237062032 1313579117 /nfs/dbraw/zinc/57/91/17/1313579117.db2.gz JAVPKSKPWYENKX-KBPBESRZSA-N 2 0 344.377 2.717 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN(C3CCC3)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237157151 1313594722 /nfs/dbraw/zinc/59/47/22/1313594722.db2.gz ZHALDIYQUVHCLY-OAQYLSRUSA-N 2 0 342.531 2.545 20 10 EFCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C[C@@H]1Cc2ccccc2O1 ZINC001237266740 1313614597 /nfs/dbraw/zinc/61/45/97/1313614597.db2.gz ZJGKGLSPJXWLCK-FQEVSTJZSA-N 2 0 337.467 2.532 20 10 EFCDRP Cc1cc(O)c(C[N@@H+](C)C2CCN(C)CC2)cc1Br ZINC001237677821 1313689772 /nfs/dbraw/zinc/68/97/72/1313689772.db2.gz PLWGBTFBAFNRIW-UHFFFAOYSA-N 2 0 327.266 2.989 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000854230190 1300478809 /nfs/dbraw/zinc/47/88/09/1300478809.db2.gz JHRLSCBCHAPMEF-QHAWAJNXSA-N 2 0 343.515 2.658 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)cc2)CC1 ZINC000854230188 1300479528 /nfs/dbraw/zinc/47/95/28/1300479528.db2.gz JHRLSCBCHAPMEF-PCCBWWKXSA-N 2 0 343.515 2.658 20 10 EFCDRP COc1ccc(N2CC[NH+](CCC3CC[NH+](C)CC3)CC2)c(C)c1 ZINC001207487953 1313698840 /nfs/dbraw/zinc/69/88/40/1313698840.db2.gz ZQTOICZBTOXVPM-UHFFFAOYSA-N 2 0 331.504 2.858 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645889 1302668338 /nfs/dbraw/zinc/66/83/38/1302668338.db2.gz DQKGBCIBOOSDBZ-CHWSQXEVSA-N 2 0 332.366 2.750 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)COC(C)C)cc2F)CC1 ZINC000800233526 1307597574 /nfs/dbraw/zinc/59/75/74/1307597574.db2.gz AMPLYTIXGHVPLQ-MRXNPFEDSA-N 2 0 337.483 2.871 20 10 EFCDRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000800374688 1307767341 /nfs/dbraw/zinc/76/73/41/1307767341.db2.gz OCGNPTYLMTYOOU-SFHVURJKSA-N 2 0 332.536 2.819 20 10 EFCDRP Oc1c(C[N@@H+]2CCNC3(CC[NH2+]CC3)C2)cccc1-c1ccccc1 ZINC001222099552 1311085239 /nfs/dbraw/zinc/08/52/39/1311085239.db2.gz HLCQYSSUVANIJN-UHFFFAOYSA-N 2 0 337.467 2.587 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@@]4(C3)CCCC[NH2+]4)cc2)CC1 ZINC001222426659 1311129711 /nfs/dbraw/zinc/12/97/11/1311129711.db2.gz HLDDGNOGQARCCH-OAQYLSRUSA-N 2 0 342.531 2.547 20 10 EFCDRP [NH3+]CC1(F)CC[NH+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001222548500 1311151065 /nfs/dbraw/zinc/15/10/65/1311151065.db2.gz OIDSRIPFHKBKSQ-UHFFFAOYSA-N 2 0 336.329 2.596 20 10 EFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1Br ZINC001222629141 1311163644 /nfs/dbraw/zinc/16/36/44/1311163644.db2.gz BDJBYSHAAAQXPG-BETUJISGSA-N 2 0 339.277 2.895 20 10 EFCDRP Nc1cc[nH+]c(N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)c1 ZINC001160616887 1311747079 /nfs/dbraw/zinc/74/70/79/1311747079.db2.gz WTMAJEBLINTGTL-RTBURBONSA-N 2 0 336.395 2.928 20 10 EFCDRP Cc1cc(F)cc(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001277519884 1312499943 /nfs/dbraw/zinc/49/99/43/1312499943.db2.gz PNIQNTZAKMSTEK-FQEVSTJZSA-N 2 0 349.494 2.689 20 10 EFCDRP C[NH+](C)CCCN1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231590105 1312528483 /nfs/dbraw/zinc/52/84/83/1312528483.db2.gz JQOZUTTZKHCPEP-UHFFFAOYSA-N 2 0 327.472 2.615 20 10 EFCDRP Cc1cc(C)c(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c(O)c1 ZINC001231845105 1312573303 /nfs/dbraw/zinc/57/33/03/1312573303.db2.gz VLINMDMIFJEROD-HDICACEKSA-N 2 0 337.467 2.968 20 10 EFCDRP COC(=O)CCN(CCC[NH+](C)C)Cc1cc(Cl)c(C)cc1O ZINC001231868518 1312578572 /nfs/dbraw/zinc/57/85/72/1312578572.db2.gz CXBDDLIVRWTXSO-UHFFFAOYSA-N 2 0 342.867 2.671 20 10 EFCDRP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1ccc2ccccc2c1O ZINC001231882255 1312579740 /nfs/dbraw/zinc/57/97/40/1312579740.db2.gz OJLSEQLMTCAJPZ-UHFFFAOYSA-N 2 0 344.455 2.862 20 10 EFCDRP CCCC[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[NH2+]1 ZINC001246184727 1314594774 /nfs/dbraw/zinc/59/47/74/1314594774.db2.gz OOXLKLXQHRVXFZ-WOJBJXKFSA-N 3 0 344.547 2.839 20 10 EFCDRP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3ccc4ccccc4c3O)[C@@H]2C1 ZINC001276374568 1314622404 /nfs/dbraw/zinc/62/24/04/1314622404.db2.gz YVKMOIRWCUSWOH-FXAWDEMLSA-N 2 0 339.483 2.613 20 10 EFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc4c(c3O)C=CC(C)(C)O4)C[C@@H]2C1 ZINC001249230643 1315036478 /nfs/dbraw/zinc/03/64/78/1315036478.db2.gz OJUGMXBIMZHTOV-ZBFHGGJFSA-N 2 0 328.456 2.960 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3CCC34CC[NH2+]CC4)cc2)CC1 ZINC001218080220 1315145738 /nfs/dbraw/zinc/14/57/38/1315145738.db2.gz KLPNMLHQJNRNRE-LJQANCHMSA-N 2 0 329.488 2.740 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CCC[C@]34CC[NH2+]C4)cc2)CC1 ZINC001218095180 1315147669 /nfs/dbraw/zinc/14/76/69/1315147669.db2.gz GVFUUHAIQCJAAS-VQTJNVASSA-N 2 0 329.488 2.740 20 10 EFCDRP CC[NH+]1CCN(c2ccc(OC3CC4(C3)CC[NH2+]CC4)cc2)CC1 ZINC001218106955 1315149440 /nfs/dbraw/zinc/14/94/40/1315149440.db2.gz ZRHIMKYDVFIAHQ-UHFFFAOYSA-N 2 0 329.488 2.740 20 10 EFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)c(O)c1 ZINC001276815227 1315438295 /nfs/dbraw/zinc/43/82/95/1315438295.db2.gz QENPOURNOZUABZ-OALUTQOASA-N 2 0 331.504 2.726 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)c2ccc(F)cc2)CC1 ZINC001252865515 1315518365 /nfs/dbraw/zinc/51/83/65/1315518365.db2.gz IWEFXKMSZLBYCJ-HXUWFJFHSA-N 2 0 344.430 2.819 20 10 EFCDRP COc1cc(O)c(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1OC ZINC000827948649 1316175944 /nfs/dbraw/zinc/17/59/44/1316175944.db2.gz ILOJWCSLQBBWCC-OAHLLOKOSA-N 2 0 334.460 2.621 20 10 EFCDRP CN1CCN(c2ccc(C[N@H+](C[C@@H]3CCOC3)C3CC3)cc2F)CC1 ZINC001319798862 1328993243 /nfs/dbraw/zinc/99/32/43/1328993243.db2.gz OVKZRBHYSMLACX-KRWDZBQOSA-N 2 0 347.478 2.578 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC001320245947 1329105623 /nfs/dbraw/zinc/10/56/23/1329105623.db2.gz KNUHNWLWMPXBMX-SJORKVTESA-N 2 0 331.504 2.866 20 10 EFCDRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2ccc(N3CCCC3)cc2)CCCO1 ZINC001320785218 1329301945 /nfs/dbraw/zinc/30/19/45/1329301945.db2.gz BDKXPROORIGYEV-GOSISDBHSA-N 2 0 331.504 2.877 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001325338985 1329681098 /nfs/dbraw/zinc/68/10/98/1329681098.db2.gz FTHTXUNJNNYSPB-IAGOWNOFSA-N 2 0 331.504 2.866 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001341604224 1332270579 /nfs/dbraw/zinc/27/05/79/1332270579.db2.gz GMLCXCFLKJIDTI-NJDAHSKKSA-N 2 0 343.515 2.970 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001341604226 1332270722 /nfs/dbraw/zinc/27/07/22/1332270722.db2.gz GMLCXCFLKJIDTI-QHAWAJNXSA-N 2 0 343.515 2.970 20 10 EFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1c(O)cccc1Br ZINC001348089193 1332798986 /nfs/dbraw/zinc/79/89/86/1332798986.db2.gz FZHZZSZYMHONGB-LBPRGKRZSA-N 2 0 345.281 2.601 20 10 EFCDRP Fc1cc(C[NH2+][C@@H]2CCCN3CCCC[C@H]23)ccc1N1CCOCC1 ZINC000848575657 1334803421 /nfs/dbraw/zinc/80/34/21/1334803421.db2.gz URHNGCNDMAYWOF-UYAOXDASSA-N 2 0 347.478 2.769 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849350199 1335596656 /nfs/dbraw/zinc/59/66/56/1335596656.db2.gz LWLCBHLYYMSEGS-HXUWFJFHSA-N 2 0 343.515 2.735 20 10 EFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Br)ccc3O)C[C@H]21 ZINC000300416823 713399458 /nfs/dbraw/zinc/39/94/58/713399458.db2.gz DSRUDECEUIWUIX-LERXQTSPSA-N 2 0 325.250 2.714 20 10 EFCDRP COc1cc(Br)cc(C[NH2+]CC[C@@H](C)[NH+](C)C)c1O ZINC000895300034 724007146 /nfs/dbraw/zinc/00/71/46/724007146.db2.gz RIDYDCFABVYCDK-SNVBAGLBSA-N 2 0 331.254 2.593 20 10 EFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2cccc(Br)c2[O-])CC1 ZINC000227327215 728326820 /nfs/dbraw/zinc/32/68/20/728326820.db2.gz BUUZSMYKKYDFCU-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[C@@H]([NH3+])[C@H]4C3)cc2)CC1 ZINC001578940865 1090483787 /nfs/dbraw/zinc/48/37/87/1090483787.db2.gz LJWJMCMVJNMGRN-DZFGPLHGSA-N 2 0 343.515 2.861 20 10 EFCDRP COC1CCN(c2ccc(C[NH2+][C@@H](C)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001578941237 1090484262 /nfs/dbraw/zinc/48/42/62/1090484262.db2.gz QCUVKELLPAEDBO-WMZOPIPTSA-N 2 0 331.504 2.780 20 10 EFCDRP Cc1cc(C[NH+]2CCC(OC3C[NH2+]C3)CC2)ccc1N1CCCCC1 ZINC001579598305 1090640593 /nfs/dbraw/zinc/64/05/93/1090640593.db2.gz OTOVMCFQSCKSKI-UHFFFAOYSA-N 2 0 343.515 2.938 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)cc2)CC1 ZINC001580879772 1091031768 /nfs/dbraw/zinc/03/17/68/1091031768.db2.gz FIOYJTATWOFGFA-OPYAIIAOSA-N 2 0 343.515 2.658 20 10 EFCDRP C[NH+]1CCN(c2ccc(CNc3cccc4c3C[NH2+]CC4)cc2)CC1 ZINC001167434677 1101663514 /nfs/dbraw/zinc/66/35/14/1101663514.db2.gz RNKIIPIJEASUFA-UHFFFAOYSA-N 2 0 336.483 2.696 20 10 EFCDRP Cn1ccc2c1[nH+]ccc2NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167436898 1101708896 /nfs/dbraw/zinc/70/88/96/1101708896.db2.gz FOAWWPNWNFWHSU-UHFFFAOYSA-N 2 0 335.455 2.937 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1OC ZINC000160459022 239050354 /nfs/dbraw/zinc/05/03/54/239050354.db2.gz VZUDEJVNIXEDLJ-RHSMWYFYSA-N 2 0 346.471 2.858 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccnn3C)cc2F)CC1 ZINC000192843124 240067656 /nfs/dbraw/zinc/06/76/56/240067656.db2.gz VBEFJVVLMUMEHN-HNNXBMFYSA-N 2 0 345.466 2.552 20 10 EFCDRP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000269076051 240564412 /nfs/dbraw/zinc/56/44/12/240564412.db2.gz YNFQLZMMPFGXFJ-QGZVFWFLSA-N 2 0 331.504 2.784 20 10 EFCDRP CCOc1ccc(O)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CCOC)c1 ZINC000294120179 241034182 /nfs/dbraw/zinc/03/41/82/241034182.db2.gz TWAPWQUTKSYORM-JWTNVVGKSA-N 2 0 348.487 2.865 20 10 EFCDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(N2CCOCC2)c(F)c1 ZINC000295908687 241067526 /nfs/dbraw/zinc/06/75/26/241067526.db2.gz JBDZSUCYZHQNTC-CCNLRDMRSA-N 2 0 347.478 2.938 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc2ccccc2c1O ZINC000192923914 277619472 /nfs/dbraw/zinc/61/94/72/277619472.db2.gz HCOPOFWLEHOABR-MRXNPFEDSA-N 2 0 327.472 2.834 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)N1CC[NH+](C)CC1 ZINC000184976980 473288601 /nfs/dbraw/zinc/28/86/01/473288601.db2.gz MSDMICLADWHTOF-RHSMWYFYSA-N 2 0 339.911 2.968 20 10 EFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)c1 ZINC000185165773 473349158 /nfs/dbraw/zinc/34/91/58/473349158.db2.gz GZKMVULGHKMXRV-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000185206613 473363076 /nfs/dbraw/zinc/36/30/76/473363076.db2.gz VVBVJGSWWMHANQ-JYJNAYRXSA-N 2 0 336.476 2.941 20 10 EFCDRP CC[C@@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(N(C)C)cc1 ZINC000154274373 472410359 /nfs/dbraw/zinc/41/03/59/472410359.db2.gz DZXYSCFQMJFJEV-HXUWFJFHSA-N 2 0 332.536 2.821 20 10 EFCDRP C[NH+]1CCC(O)(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000077450395 472528895 /nfs/dbraw/zinc/52/88/95/472528895.db2.gz YCCQEFBBTHNDRL-UHFFFAOYSA-N 2 0 326.440 2.606 20 10 EFCDRP CC[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000156976634 472773173 /nfs/dbraw/zinc/77/31/73/472773173.db2.gz PQGRRSBBUKRBOU-KRWDZBQOSA-N 2 0 329.444 2.969 20 10 EFCDRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3c(O)ccc4ccccc43)C2)CC1 ZINC000106854742 472898932 /nfs/dbraw/zinc/89/89/32/472898932.db2.gz MGQCUCITKHUFBN-GOSISDBHSA-N 2 0 339.483 2.757 20 10 EFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](CC)CC3)C2)cc1 ZINC000093133347 473049189 /nfs/dbraw/zinc/04/91/89/473049189.db2.gz PFUVQAIZYLHKKJ-NRFANRHFSA-N 2 0 344.547 2.745 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c1 ZINC000186127082 473596846 /nfs/dbraw/zinc/59/68/46/473596846.db2.gz QOYZJNRQEULAAP-DCPHZVHLSA-N 2 0 348.487 2.819 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000127307874 473598588 /nfs/dbraw/zinc/59/85/88/473598588.db2.gz SZJRDBMGJNQJHA-RBUKOAKNSA-N 2 0 344.547 2.963 20 10 EFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000186197252 473614073 /nfs/dbraw/zinc/61/40/73/473614073.db2.gz LXFPSCKEKYXROP-HNNXBMFYSA-N 2 0 329.444 2.887 20 10 EFCDRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)ccc1O ZINC000186197625 473614119 /nfs/dbraw/zinc/61/41/19/473614119.db2.gz GVUCYLOYYIFGPL-ZDUSSCGKSA-N 2 0 333.407 2.718 20 10 EFCDRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)ccc1O ZINC000186520406 473685373 /nfs/dbraw/zinc/68/53/73/473685373.db2.gz DZUXFRXUWQJUKF-KSSFIOAISA-N 2 0 344.430 2.949 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1F ZINC000271179115 474423588 /nfs/dbraw/zinc/42/35/88/474423588.db2.gz JFRJQGIZZFEAQW-UHFFFAOYSA-N 2 0 349.494 2.969 20 10 EFCDRP Cc1ccc(O)c(C[N@@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000190322409 474579417 /nfs/dbraw/zinc/57/94/17/474579417.db2.gz MUVUNEQVAFZASK-NRFANRHFSA-N 2 0 340.467 2.769 20 10 EFCDRP Cc1cc(C[N@@H+](C)CCN(C)C2CC[NH+](C)CC2)ccc1N(C)C ZINC000293792163 475053063 /nfs/dbraw/zinc/05/30/63/475053063.db2.gz MQJJCNCGEBSGLK-UHFFFAOYSA-N 2 0 332.536 2.519 20 10 EFCDRP CC[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(C)cc1O ZINC000375649208 476935024 /nfs/dbraw/zinc/93/50/24/476935024.db2.gz PPLATRLCANSRND-LPHOPBHVSA-N 2 0 331.504 2.910 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+]Cc1cnc2n1CCCC2 ZINC000376730843 477478531 /nfs/dbraw/zinc/47/85/31/477478531.db2.gz ZVXDBWILYKPZCM-UHFFFAOYSA-N 2 0 336.233 2.977 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1C ZINC000371869206 477534263 /nfs/dbraw/zinc/53/42/63/477534263.db2.gz FAAQPMUUPSIXKG-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP C[C@H]1C[NH+](CC2CC[NH+](Cc3cc(F)ccc3O)CC2)C[C@H](C)O1 ZINC000180001228 533922021 /nfs/dbraw/zinc/92/20/21/533922021.db2.gz CJEJQXKNHWWJML-GJZGRUSLSA-N 2 0 336.451 2.853 20 10 EFCDRP CC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccccc1O ZINC000155181434 529187046 /nfs/dbraw/zinc/18/70/46/529187046.db2.gz AKBDEFGRLAKOOP-GOSISDBHSA-N 2 0 340.471 2.780 20 10 EFCDRP CC[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccccc1O ZINC000156976780 529187087 /nfs/dbraw/zinc/18/70/87/529187087.db2.gz PQGRRSBBUKRBOU-QGZVFWFLSA-N 2 0 329.444 2.969 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756548146 575759155 /nfs/dbraw/zinc/75/91/55/575759155.db2.gz IYMJZLBFUSCJMS-GOEBONIOSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c2c1c(F)ccc2O ZINC000756578895 575765018 /nfs/dbraw/zinc/76/50/18/575765018.db2.gz XQJOJYJJEPXOOE-CKEIUWERSA-N 2 0 347.478 2.838 20 10 EFCDRP CCCN(CC[NH+](CC)CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000764677992 576488280 /nfs/dbraw/zinc/48/82/80/576488280.db2.gz NBHFCGAUWVMXAV-UHFFFAOYSA-N 2 0 346.563 2.992 20 10 EFCDRP COC[C@H]1CCCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000768539886 577282034 /nfs/dbraw/zinc/28/20/34/577282034.db2.gz DDPHLUZXLOHZIW-IBGZPJMESA-N 2 0 331.504 2.687 20 10 EFCDRP CCOc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(O)c1 ZINC000769506759 577368270 /nfs/dbraw/zinc/36/82/70/577368270.db2.gz WEBHFJOJDBNVNB-UHFFFAOYSA-N 2 0 348.487 2.868 20 10 EFCDRP Cc1cc(Br)cc([C@H](C)[NH2+]CCOCC[NH+](C)C)c1O ZINC000774377119 581490471 /nfs/dbraw/zinc/49/04/71/581490471.db2.gz QOAVURKESJJTNR-LBPRGKRZSA-N 2 0 345.281 2.692 20 10 EFCDRP COCc1csc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000850377409 1250454867 /nfs/dbraw/zinc/45/48/67/1250454867.db2.gz GJTAMDLOPVGDIN-UHFFFAOYSA-N 2 0 345.512 2.936 20 10 EFCDRP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000850566203 1250539362 /nfs/dbraw/zinc/53/93/62/1250539362.db2.gz LSLVCVAXJOBRQE-UHFFFAOYSA-N 2 0 345.531 2.858 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c3OCC4)cc2)CC1 ZINC000922333673 1265598020 /nfs/dbraw/zinc/59/80/20/1265598020.db2.gz VTKMVKKTDOEUDG-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1 ZINC000180796360 1252489997 /nfs/dbraw/zinc/48/99/97/1252489997.db2.gz VSHVQZYARRNCFC-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP Oc1ccc(Br)cc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843120215 1260406070 /nfs/dbraw/zinc/40/60/70/1260406070.db2.gz ZQASEYBQNJXSEM-UHFFFAOYSA-N 2 0 325.250 2.730 20 10 EFCDRP COc1cc(Br)cc(C[NH2+]CCCCCC[NH3+])c1O ZINC000843126454 1260613332 /nfs/dbraw/zinc/61/33/32/1260613332.db2.gz FQCBHTQUVCOJHS-UHFFFAOYSA-N 2 0 331.254 2.772 20 10 EFCDRP CN(C)c1ccc(CN2CC[C@@H]3[NH2+]CC[C@H]3C2)c(C(F)(F)F)c1 ZINC000843126338 1260705946 /nfs/dbraw/zinc/70/59/46/1260705946.db2.gz JMNBBPBKGSZXBU-BBRMVZONSA-N 2 0 327.394 2.955 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)ccc1N(C)C ZINC000923374912 1261574831 /nfs/dbraw/zinc/57/48/31/1261574831.db2.gz FKPWFLLGGKVHLW-QUCCMNQESA-N 2 0 331.504 2.779 20 10 EFCDRP CO[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1(C)C ZINC000824821149 1278305401 /nfs/dbraw/zinc/30/54/01/1278305401.db2.gz VJCUUFGKRZJLJC-LJQANCHMSA-N 2 0 331.504 2.685 20 10 EFCDRP Cc1cc(O)c(C[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)cc1Cl ZINC000825097731 1278409831 /nfs/dbraw/zinc/40/98/31/1278409831.db2.gz XZXXRDSTWSHIOU-KRWDZBQOSA-N 2 0 339.911 2.716 20 10 EFCDRP C[C@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000702603451 1271554513 /nfs/dbraw/zinc/55/45/13/1271554513.db2.gz NDVGXCUEBIAPDZ-JXFKEZNVSA-N 2 0 326.440 2.680 20 10 EFCDRP C[C@H](C[NH2+]Cc1ccc(Br)cc1O)C[NH+]1CCCC1 ZINC000691487364 1274711847 /nfs/dbraw/zinc/71/18/47/1274711847.db2.gz FCILTXBKDVURIG-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817887758 1276345844 /nfs/dbraw/zinc/34/58/44/1276345844.db2.gz DMGOHFWSUIVMIA-QWHCGFSZSA-N 2 0 345.409 2.757 20 10 EFCDRP C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCC[NH2+]1 ZINC000817903924 1276369406 /nfs/dbraw/zinc/36/94/06/1276369406.db2.gz XBZQHLAIADPFGZ-GUYCJALGSA-N 2 0 339.430 2.987 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCOCC2)cc1Cl ZINC000817976839 1276416915 /nfs/dbraw/zinc/41/69/15/1276416915.db2.gz VKQWKJBQJXLLRN-KSSFIOAISA-N 2 0 349.906 2.969 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)CC2)cc1 ZINC000817986900 1276423883 /nfs/dbraw/zinc/42/38/83/1276423883.db2.gz VPQJFESMMJSJQV-SOLBZPMBSA-N 2 0 329.488 2.642 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@H](C)C3CC[NH+](C)CC3)C2)cc1 ZINC000818345277 1276511141 /nfs/dbraw/zinc/51/11/41/1276511141.db2.gz SWBVKJAOFVSCND-IAGOWNOFSA-N 2 0 331.504 2.841 20 10 EFCDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(N3CCOCC3)c(F)c2)CC1 ZINC000789558884 1276841895 /nfs/dbraw/zinc/84/18/95/1276841895.db2.gz DHENMKLOAWCDIQ-UHFFFAOYSA-N 2 0 347.478 2.723 20 10 EFCDRP COc1ccc(C[NH2+]CCCC[C@@H](C)NC(=O)CC[NH+](C)C)cc1C ZINC001175048325 1287306965 /nfs/dbraw/zinc/30/69/65/1287306965.db2.gz GPJYSALUQGQFRZ-QGZVFWFLSA-N 2 0 349.519 2.720 20 10 EFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1CC[NH3+] ZINC000844900649 1279323032 /nfs/dbraw/zinc/32/30/32/1279323032.db2.gz CAOWEBXQLYLTQZ-YJBOKZPZSA-N 2 0 335.467 2.612 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000793609686 1279772236 /nfs/dbraw/zinc/77/22/36/1279772236.db2.gz REFUQLMYSPVKKI-PMACEKPBSA-N 2 0 329.488 2.582 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c1O ZINC000846148418 1280037030 /nfs/dbraw/zinc/03/70/30/1280037030.db2.gz ZEEVXESFBITPAG-GJZGRUSLSA-N 2 0 334.460 2.552 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c1O ZINC000808690924 1281847275 /nfs/dbraw/zinc/84/72/75/1281847275.db2.gz GZHMBLUDVLXDHT-ZIAGYGMSSA-N 2 0 325.884 2.641 20 10 EFCDRP C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809700357 1282385775 /nfs/dbraw/zinc/38/57/75/1282385775.db2.gz FBCIMHLYMZATRW-NQIIRXRSSA-N 2 0 345.531 2.954 20 10 EFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(Cl)ccc1O ZINC000809737005 1282437200 /nfs/dbraw/zinc/43/72/00/1282437200.db2.gz BCVXCHNRUILWNM-KRWDZBQOSA-N 2 0 339.911 2.894 20 10 EFCDRP CCOc1ccc(O)c(CN(CC[NH+](C)C)C[C@@H]2CCC[N@@H+]2CC)c1 ZINC000809738337 1282437377 /nfs/dbraw/zinc/43/73/77/1282437377.db2.gz UWDGYALJDBEAPS-SFHVURJKSA-N 2 0 349.519 2.639 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@@H](O)c3ccccc3)cc2)CC1 ZINC000809748185 1282446732 /nfs/dbraw/zinc/44/67/32/1282446732.db2.gz KUFVIKKWJCZECU-OAQYLSRUSA-N 2 0 339.483 2.652 20 10 EFCDRP C[N@H+](Cc1ccc(O)cc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809754002 1282457330 /nfs/dbraw/zinc/45/73/30/1282457330.db2.gz ZHAIOJZZRYYGOG-UHFFFAOYSA-N 2 0 325.456 2.776 20 10 EFCDRP Cc1cc(C)c([C@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)c(O)c1 ZINC000815575932 1287608929 /nfs/dbraw/zinc/60/89/29/1287608929.db2.gz FGRYVOUVXDORJV-KRWDZBQOSA-N 2 0 333.520 2.933 20 10 EFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000815578981 1287610600 /nfs/dbraw/zinc/61/06/00/1287610600.db2.gz BRAUZMALVVUSPL-IRXDYDNUSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810219986 1283048434 /nfs/dbraw/zinc/04/84/34/1283048434.db2.gz NXMAGYRTSOJWDI-AWEZNQCLSA-N 2 0 346.393 2.908 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811510672 1284390329 /nfs/dbraw/zinc/39/03/29/1284390329.db2.gz MSICSDFXBBWEJZ-UXHICEINSA-N 2 0 343.515 2.828 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC001172107950 1286022508 /nfs/dbraw/zinc/02/25/08/1286022508.db2.gz MGARBNNKXZKRDM-ZKTXZKFHSA-N 3 0 342.531 2.543 20 10 EFCDRP CC(C)OC(=O)CC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172755565 1286261120 /nfs/dbraw/zinc/26/11/20/1286261120.db2.gz IRQHSAKGWPLYNV-QGZVFWFLSA-N 2 0 347.503 2.648 20 10 EFCDRP CC(C)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(CO)CCC1 ZINC000814169504 1286373018 /nfs/dbraw/zinc/37/30/18/1286373018.db2.gz IZPQLKXOKXUIHH-FQEVSTJZSA-N 2 0 345.531 2.715 20 10 EFCDRP CC[N@@H+]1CC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C1 ZINC001173356520 1286545077 /nfs/dbraw/zinc/54/50/77/1286545077.db2.gz DTRUOAOPADMJIR-JSNMRZPZSA-N 2 0 341.455 2.523 20 10 EFCDRP COc1ccc(C[NH2+][C@@H](C)C[C@H](C)NC(=O)CCC[NH+](C)C)cc1C ZINC001135314541 1287943047 /nfs/dbraw/zinc/94/30/47/1287943047.db2.gz CINRJHWQXNWRAA-IRXDYDNUSA-N 2 0 349.519 2.718 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816548128 1288198331 /nfs/dbraw/zinc/19/83/31/1288198331.db2.gz WBFGBQGCORUARW-KRWDZBQOSA-N 2 0 341.499 2.909 20 10 EFCDRP C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)CN1CC[NH+](C)CC1 ZINC000816547552 1288198465 /nfs/dbraw/zinc/19/84/65/1288198465.db2.gz AAYCYHMCEQMQQP-MRXNPFEDSA-N 2 0 327.472 2.519 20 10 EFCDRP CN(CCC[N@H+](C)Cc1ccc2ccccc2c1O)CC[NH+](C)C ZINC000816613451 1288226014 /nfs/dbraw/zinc/22/60/14/1288226014.db2.gz UZFZOGIEJYCOML-UHFFFAOYSA-N 2 0 329.488 2.861 20 10 EFCDRP CCOc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CCOC)c(O)c1 ZINC000816659220 1288231802 /nfs/dbraw/zinc/23/18/02/1288231802.db2.gz FMDXZEVHSNIQAK-JWTNVVGKSA-N 2 0 348.487 2.865 20 10 EFCDRP CCCOc1ccc(C[NH2+]CC(C)(C)N2CC[NH+](C)CC2)cc1C ZINC000873010344 1289516852 /nfs/dbraw/zinc/51/68/52/1289516852.db2.gz JPPZXJZLLYOZAJ-UHFFFAOYSA-N 2 0 333.520 2.899 20 10 EFCDRP COc1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1Cn1cccn1 ZINC000873014277 1289518735 /nfs/dbraw/zinc/51/87/35/1289518735.db2.gz NKPQWBLZZADTFN-RTBURBONSA-N 2 0 340.471 2.656 20 10 EFCDRP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1Cn1cccn1 ZINC000873029346 1289529574 /nfs/dbraw/zinc/52/95/74/1289529574.db2.gz DCHWSSMQBNAYDV-GOSISDBHSA-N 2 0 342.487 2.760 20 10 EFCDRP Cc1cc(C)c([C@@H](C)Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c(O)c1 ZINC000873240572 1289673841 /nfs/dbraw/zinc/67/38/41/1289673841.db2.gz AKAGMTDJBZAQQD-OAHLLOKOSA-N 2 0 326.444 2.987 20 10 EFCDRP C[C@H]1C[C@@H](Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c2c1c(F)ccc2O ZINC000873243954 1289676904 /nfs/dbraw/zinc/67/69/04/1289676904.db2.gz DUUUQZYDRCIDBA-SWLSCSKDSA-N 2 0 342.418 2.996 20 10 EFCDRP C[C@@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1cc(F)cc(F)c1O ZINC000873244748 1289677924 /nfs/dbraw/zinc/67/79/24/1289677924.db2.gz JUNUXLZNTQLOSD-LLVKDONJSA-N 2 0 334.370 2.648 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CC3(CO2)CC[NH2+]CC3)cc1 ZINC000873290156 1289704605 /nfs/dbraw/zinc/70/46/05/1289704605.db2.gz BIUFLPDIBNJDCP-LPHOPBHVSA-N 2 0 331.504 2.952 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1C ZINC000092665090 1290801595 /nfs/dbraw/zinc/80/15/95/1290801595.db2.gz RHHOMXJOULZJCT-RTBURBONSA-N 2 0 345.531 2.999 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c(O)c1 ZINC000876874764 1291055111 /nfs/dbraw/zinc/05/51/11/1291055111.db2.gz KKHMXQHYVXRERN-UHFFFAOYSA-N 2 0 340.467 2.947 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000877191481 1291160902 /nfs/dbraw/zinc/16/09/02/1291160902.db2.gz WRQFJSBVANBGIP-SFHVURJKSA-N 2 0 326.440 2.557 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccncc1OCCC[NH+](C)C ZINC000877534466 1291263315 /nfs/dbraw/zinc/26/33/15/1291263315.db2.gz ABSDUSGHRGEQFV-UHFFFAOYSA-N 2 0 329.444 2.716 20 10 EFCDRP COC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCCC1 ZINC000775321113 1291853177 /nfs/dbraw/zinc/85/31/77/1291853177.db2.gz NJDNISYHIXTVDF-UHFFFAOYSA-N 2 0 331.504 2.877 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775498097 1292752688 /nfs/dbraw/zinc/75/26/88/1292752688.db2.gz HDMNJNUIWLACTE-PBHICJAKSA-N 2 0 339.911 2.970 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775498098 1292752851 /nfs/dbraw/zinc/75/28/51/1292752851.db2.gz HDMNJNUIWLACTE-RHSMWYFYSA-N 2 0 339.911 2.970 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(COCC[NH+]3CCCC3)CC2)c1 ZINC001203670449 1312986047 /nfs/dbraw/zinc/98/60/47/1312986047.db2.gz RIXVZICSHAVWSM-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP C[N@H+](CCOc1ccccc1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775634794 1293794478 /nfs/dbraw/zinc/79/44/78/1293794478.db2.gz YDXAVCIRAFRLPO-UHFFFAOYSA-N 2 0 339.483 2.949 20 10 EFCDRP COCC[N@H+](Cc1ccco1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775657220 1293929269 /nfs/dbraw/zinc/92/92/69/1293929269.db2.gz YTDFRLCLIXTCKA-UHFFFAOYSA-N 2 0 343.471 2.680 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4cc[nH]n4)C3)cc2)CC1 ZINC000775657871 1293933555 /nfs/dbraw/zinc/93/35/55/1293933555.db2.gz ANYHSDIAFFDAPE-SFHVURJKSA-N 2 0 339.487 2.541 20 10 EFCDRP CC(C)OC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775663178 1293948385 /nfs/dbraw/zinc/94/83/85/1293948385.db2.gz KMOVIMJDWSAYPS-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1ccc(O)c(O)c1 ZINC001203878524 1313039741 /nfs/dbraw/zinc/03/97/41/1313039741.db2.gz AZIGGRPZSUGUEL-UHFFFAOYSA-N 2 0 337.508 2.583 20 10 EFCDRP C[C@H]([NH2+]C[C@H](O)CN(C)Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000775830928 1294921480 /nfs/dbraw/zinc/92/14/80/1294921480.db2.gz NKJRLJWYUHPATJ-UWJYYQICSA-N 2 0 341.499 2.896 20 10 EFCDRP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4ccc(O)cc4O)C[C@@H]3C2)cc1 ZINC001204272638 1313113642 /nfs/dbraw/zinc/11/36/42/1313113642.db2.gz FGMKEXOUQIJDNL-KDURUIRLSA-N 2 0 338.451 2.970 20 10 EFCDRP CC(C)(C)c1ccc(CN2CCOC[C@]3(CCC[NH2+]C3)C2)c(O)c1 ZINC001235019484 1313225133 /nfs/dbraw/zinc/22/51/33/1313225133.db2.gz BJJWGCJBKPBEMS-FQEVSTJZSA-N 2 0 332.488 2.892 20 10 EFCDRP c1c(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc2c3c1CCCN3CCC2 ZINC001235093128 1313241269 /nfs/dbraw/zinc/24/12/69/1313241269.db2.gz PGTZOXDMMKANKU-UHFFFAOYSA-N 2 0 325.500 2.961 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CCC2(CCCC2)CC1 ZINC001235155702 1313253618 /nfs/dbraw/zinc/25/36/18/1313253618.db2.gz MHTZJMBAKKBLTG-UHFFFAOYSA-N 2 0 329.488 2.958 20 10 EFCDRP COc1cc(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c(O)c(OC)c1 ZINC001235237457 1313271623 /nfs/dbraw/zinc/27/16/23/1313271623.db2.gz LLWCYBSJPWENNB-QGZVFWFLSA-N 2 0 334.460 2.764 20 10 EFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3cccc(C)c3O)(C1)CCC2 ZINC001276080174 1296594250 /nfs/dbraw/zinc/59/42/50/1296594250.db2.gz KCNQSIAKDDGNDM-UXHICEINSA-N 2 0 348.487 2.846 20 10 EFCDRP c1c(C[NH+]2CCC(C3C[NH2+]C3)CC2)cc2c3c1CCCN3CCC2 ZINC001235334280 1313294238 /nfs/dbraw/zinc/29/42/38/1313294238.db2.gz BRMPGPTWXMEWBZ-UHFFFAOYSA-N 2 0 325.500 2.817 20 10 EFCDRP F[C@H]1CC[NH2+]C[C@@]12CC[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235401877 1313312543 /nfs/dbraw/zinc/31/25/43/1313312543.db2.gz HKZBCNKDGRONIQ-PZJWPPBQSA-N 2 0 343.490 2.909 20 10 EFCDRP COc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235402012 1313313482 /nfs/dbraw/zinc/31/34/82/1313313482.db2.gz GTEMOWUHYYNKQK-UHFFFAOYSA-N 2 0 325.456 2.737 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC[C@H]1C[NH3+] ZINC001205617350 1313324057 /nfs/dbraw/zinc/32/40/57/1313324057.db2.gz JCRFOLFKHNSZAT-RDJZCZTQSA-N 2 0 343.515 2.898 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@@H]1C[NH3+] ZINC001205626714 1313325615 /nfs/dbraw/zinc/32/56/15/1313325615.db2.gz IJOGNDCUEKQBAN-NWDGAFQWSA-N 2 0 327.266 2.962 20 10 EFCDRP Cc1cc(C)c(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001276364633 1297338969 /nfs/dbraw/zinc/33/89/69/1297338969.db2.gz ALYSMJLURXZBPL-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP CCOC(=O)c1c(C[NH+]2CCC(C[NH2+]C)CC2)c2ccccc2n1C ZINC001235678969 1313373198 /nfs/dbraw/zinc/37/31/98/1313373198.db2.gz JNYUGJMCXWMKQV-UHFFFAOYSA-N 2 0 343.471 2.786 20 10 EFCDRP COC(=O)c1c(C[N@H+](C)CCC2CC[NH2+]CC2)c2ccccc2n1C ZINC001235716429 1313382800 /nfs/dbraw/zinc/38/28/00/1313382800.db2.gz BFIZQJFAJAHQKC-UHFFFAOYSA-N 2 0 343.471 2.786 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC[C@H]1C[NH3+] ZINC001205991405 1313387431 /nfs/dbraw/zinc/38/74/31/1313387431.db2.gz AOJALUVMGXOSMN-RDJZCZTQSA-N 2 0 343.515 2.898 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C[NH3+])[C@@H](C)C3)cc2)CC1 ZINC001206005514 1313389922 /nfs/dbraw/zinc/38/99/22/1313389922.db2.gz YJUPBSJYWJIDIX-AZUAARDMSA-N 3 0 344.547 2.635 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc(O)c(Br)cc2O)CCC[C@H]1C[NH3+] ZINC001206024571 1313393515 /nfs/dbraw/zinc/39/35/15/1313393515.db2.gz KIEMZKPDMNCMIX-QWRGUYRKSA-N 2 0 343.265 2.667 20 10 EFCDRP COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CCC2CC[NH2+]CC2)C1 ZINC001235839713 1313407161 /nfs/dbraw/zinc/40/71/61/1313407161.db2.gz VNVYNMMXGUTHEZ-UHFFFAOYSA-N 2 0 327.472 2.935 20 10 EFCDRP CCC[N@H+](CCc1ccccn1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235962746 1313423768 /nfs/dbraw/zinc/42/37/68/1313423768.db2.gz OOEVUFUNVLBOAP-UHFFFAOYSA-N 2 0 338.499 2.946 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C)[C@H]3CCCC[C@H]3[NH3+])cc2)CC1 ZINC001236214337 1313456834 /nfs/dbraw/zinc/45/68/34/1313456834.db2.gz DHDRWSIWOQOAHW-UXHICEINSA-N 2 0 330.520 2.530 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@H]([NH2+]C4CC4)C3)cc2)CC1 ZINC001236218295 1313457352 /nfs/dbraw/zinc/45/73/52/1313457352.db2.gz OYJNFGDYJQGIOQ-FQEVSTJZSA-N 2 0 342.531 2.545 20 10 EFCDRP Cc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc1Br ZINC001236320387 1313469200 /nfs/dbraw/zinc/46/92/00/1313469200.db2.gz GFMNOKRJVXJPAZ-BETUJISGSA-N 2 0 339.277 2.895 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)C[NH2+]C4)CC2)c(C)c1 ZINC001236366373 1313473979 /nfs/dbraw/zinc/47/39/79/1313473979.db2.gz BEUVLIUMKWNLAI-UHFFFAOYSA-N 2 0 337.467 2.929 20 10 EFCDRP COCC1(C)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000779605426 1298372983 /nfs/dbraw/zinc/37/29/83/1298372983.db2.gz DHSYTTGTHSNYDW-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP COc1cc(C)c(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c(O)c1 ZINC001236815259 1313536055 /nfs/dbraw/zinc/53/60/55/1313536055.db2.gz IHPIWTYPDYXROK-UHFFFAOYSA-N 2 0 327.428 2.735 20 10 EFCDRP CCC[N@@H+](Cc1c2ccccc2n(C)c1C(=O)OC)C[C@H]1CC[NH2+]C1 ZINC001236844667 1313541436 /nfs/dbraw/zinc/54/14/36/1313541436.db2.gz XOUODTNJAQKJLP-HNNXBMFYSA-N 2 0 343.471 2.786 20 10 EFCDRP COCC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236940435 1313557254 /nfs/dbraw/zinc/55/72/54/1313557254.db2.gz QZXFGJCURZEHIO-GOSISDBHSA-N 2 0 349.494 2.969 20 10 EFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CCC[C@]1(C)O ZINC001236937009 1313557338 /nfs/dbraw/zinc/55/73/38/1313557338.db2.gz XJUBZLGNNPBBQL-JXFKEZNVSA-N 2 0 349.494 2.560 20 10 EFCDRP C[NH+](C)CCN(Cc1cccc(C(F)(F)F)c1O)[C@@H]1CCC[NH2+]C1 ZINC001236934943 1313557419 /nfs/dbraw/zinc/55/74/19/1313557419.db2.gz ZWZSKPHROFVDFE-CQSZACIVSA-N 2 0 345.409 2.527 20 10 EFCDRP COC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236935248 1313557546 /nfs/dbraw/zinc/55/75/46/1313557546.db2.gz FRVQLJSFIKVEPM-LJQANCHMSA-N 2 0 349.494 2.967 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]4(CCOC4)C3)c(F)c2)CC1 ZINC001236935619 1313557611 /nfs/dbraw/zinc/55/76/11/1313557611.db2.gz IRTNFCOWIQOPPU-FQEVSTJZSA-N 2 0 347.478 2.580 20 10 EFCDRP CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCOCC1 ZINC001236940453 1313557666 /nfs/dbraw/zinc/55/76/66/1313557666.db2.gz RRFIJYRORLCESL-UHFFFAOYSA-N 2 0 335.467 2.578 20 10 EFCDRP CC(C)O[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236941592 1313557997 /nfs/dbraw/zinc/55/79/97/1313557997.db2.gz CXURQOUSIWICMS-GOSISDBHSA-N 2 0 335.467 2.577 20 10 EFCDRP CCOc1ccc(CN2CCC([N@H+](CC)[C@H]3CCOC3)CC2)c(O)c1 ZINC001237043437 1313573872 /nfs/dbraw/zinc/57/38/72/1313573872.db2.gz OCUAJMLTRUZXEN-SFHVURJKSA-N 2 0 348.487 2.866 20 10 EFCDRP C[C@@H]1C(=O)CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C12CCCC2 ZINC001237190184 1313602153 /nfs/dbraw/zinc/60/21/53/1313602153.db2.gz DEHWAMOOXLMFOP-QGZVFWFLSA-N 2 0 341.499 2.820 20 10 EFCDRP Cc1c(C[N@@H+]2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)c2ccccc2n1C ZINC001276557082 1313851816 /nfs/dbraw/zinc/85/18/16/1313851816.db2.gz UMCJJDJAMWHZRM-SFTDATJTSA-N 2 0 340.515 2.697 20 10 EFCDRP CCOc1ccc(CNc2cc(N3CC[NH+](C)CC3)cc[nH+]2)c(O)c1 ZINC000865296325 1303211014 /nfs/dbraw/zinc/21/10/14/1303211014.db2.gz WBEGKAFWWNCGGH-UHFFFAOYSA-N 2 0 342.443 2.550 20 10 EFCDRP COc1ccc(N2CC[NH+](CCCCCCC[NH3+])CC2)c(OC)c1 ZINC000866696906 1303753214 /nfs/dbraw/zinc/75/32/14/1303753214.db2.gz BLWICPOOYKRFBJ-UHFFFAOYSA-N 2 0 335.492 2.735 20 10 EFCDRP COc1ccc(N2CC[NH+](CCCC3CC[NH2+]CC3)CC2)c(OC)c1 ZINC000866696912 1303753302 /nfs/dbraw/zinc/75/33/02/1303753302.db2.gz BVYBDTIICJGQMG-UHFFFAOYSA-N 2 0 347.503 2.606 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@]34CCC[NH2+]C4)cc2)CC1 ZINC001222242161 1311103897 /nfs/dbraw/zinc/10/38/97/1311103897.db2.gz BZXRXUBPAGSYHW-NRFANRHFSA-N 2 0 342.531 2.547 20 10 EFCDRP COc1cc(C)c(C[N@@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222609964 1311160712 /nfs/dbraw/zinc/16/07/12/1311160712.db2.gz TZVBYKPQFUGDSZ-LJQANCHMSA-N 2 0 338.451 2.898 20 10 EFCDRP CCOc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222615968 1311161478 /nfs/dbraw/zinc/16/14/78/1311161478.db2.gz UOAXNEXRKRLMBR-IBGZPJMESA-N 2 0 338.451 2.980 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)[NH+](C)C)cc1 ZINC000902518334 1311827501 /nfs/dbraw/zinc/82/75/01/1311827501.db2.gz PDQKPDULGHVMBV-MHTWAQMVSA-N 2 0 344.547 2.866 20 10 EFCDRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000903087431 1312341473 /nfs/dbraw/zinc/34/14/73/1312341473.db2.gz GPXMFCQZOMDWJF-AZUAARDMSA-N 2 0 331.504 2.876 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(N3CCOCC3)c(Cl)c1)CC2 ZINC001232200764 1312647317 /nfs/dbraw/zinc/64/73/17/1312647317.db2.gz ZQIBPMHRHJZWLA-UHFFFAOYSA-N 2 0 349.906 2.704 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246173002 1314593412 /nfs/dbraw/zinc/59/34/12/1314593412.db2.gz JFWXJIMFRQQPBP-IBGZPJMESA-N 3 0 342.531 2.641 20 10 EFCDRP C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246177162 1314593893 /nfs/dbraw/zinc/59/38/93/1314593893.db2.gz ZNOOVERHUSPSGN-MRXNPFEDSA-N 2 0 327.447 2.956 20 10 EFCDRP CCCC[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[NH2+]1 ZINC001246184721 1314594638 /nfs/dbraw/zinc/59/46/38/1314594638.db2.gz OOXLKLXQHRVXFZ-PMACEKPBSA-N 3 0 344.547 2.839 20 10 EFCDRP CC[C@H]1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC)[NH2+]1 ZINC001246186062 1314595054 /nfs/dbraw/zinc/59/50/54/1314595054.db2.gz WQYQPCBQYDCMOU-OALUTQOASA-N 3 0 344.547 2.837 20 10 EFCDRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC)[NH2+]1 ZINC001246186057 1314595188 /nfs/dbraw/zinc/59/51/88/1314595188.db2.gz WQYQPCBQYDCMOU-ACDBMABISA-N 3 0 344.547 2.837 20 10 EFCDRP FC(F)(F)Oc1ccc(N2CCN([C@H]3CCC[NH2+]CC3)CC2)cc1 ZINC001246993659 1314726827 /nfs/dbraw/zinc/72/68/27/1314726827.db2.gz IJJPYYLCERZKFV-AWEZNQCLSA-N 2 0 343.393 2.849 20 10 EFCDRP CC[NH+]1CCN(c2ccc(OC3CC4(C3)CCC[NH2+]C4)cc2)CC1 ZINC001218255995 1315171114 /nfs/dbraw/zinc/17/11/14/1315171114.db2.gz QOZWTUPTWVVKTD-UHFFFAOYSA-N 2 0 329.488 2.740 20 10 EFCDRP CCc1ccc(C[N@@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001276805409 1315317966 /nfs/dbraw/zinc/31/79/66/1315317966.db2.gz WJSANUWXJVYSRL-OAQYLSRUSA-N 2 0 345.531 2.804 20 10 EFCDRP C[NH+](C)CCN1CCC2(C[NH+](Cc3cc4ccccc4cc3O)C2)C1 ZINC001276814484 1315426688 /nfs/dbraw/zinc/42/66/88/1315426688.db2.gz ZZUYRKVOZFREJR-UHFFFAOYSA-N 2 0 339.483 2.615 20 10 EFCDRP C[C@@](O)(C[NH2+]C1CC[NH+](Cc2ccccc2O)CC1)c1ccccc1 ZINC001253122128 1315572343 /nfs/dbraw/zinc/57/23/43/1315572343.db2.gz JPYAKOIUARKBRC-OAQYLSRUSA-N 2 0 340.467 2.854 20 10 EFCDRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001255942208 1315883042 /nfs/dbraw/zinc/88/30/42/1315883042.db2.gz CRLUZPRSDYTMGG-SFHVURJKSA-N 3 0 332.536 2.648 20 10 EFCDRP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC001258002917 1316108247 /nfs/dbraw/zinc/10/82/47/1316108247.db2.gz NVJNFRIPQHIEID-UHFFFAOYSA-N 3 0 344.547 2.648 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001321024259 1329332412 /nfs/dbraw/zinc/33/24/12/1329332412.db2.gz QIYGDOCVMFWTAJ-BRWVUGGUSA-N 2 0 331.504 2.865 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001321024258 1329332438 /nfs/dbraw/zinc/33/24/38/1329332438.db2.gz QIYGDOCVMFWTAJ-BBWFWOEESA-N 2 0 331.504 2.865 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001325338988 1329681197 /nfs/dbraw/zinc/68/11/97/1329681197.db2.gz FTHTXUNJNNYSPB-IRXDYDNUSA-N 2 0 331.504 2.866 20 10 EFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@H]1CC[NH3+] ZINC001328644442 1330611384 /nfs/dbraw/zinc/61/13/84/1330611384.db2.gz ZDRKVGHUTNWBHN-APWZRJJASA-N 2 0 348.510 2.527 20 10 EFCDRP Cc1nc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)sc1C ZINC001336254557 1331451720 /nfs/dbraw/zinc/45/17/20/1331451720.db2.gz VGVMMWVEKOVFIA-UHFFFAOYSA-N 2 0 330.501 2.802 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC001337785109 1331598810 /nfs/dbraw/zinc/59/88/10/1331598810.db2.gz JQGWZEWRBQKJPF-IAGOWNOFSA-N 2 0 331.504 2.866 20 10 EFCDRP C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C[C@H](C2CC2)O1 ZINC001339602688 1331910106 /nfs/dbraw/zinc/91/01/06/1331910106.db2.gz AFLCCZRAUMEWHS-FOIQADDNSA-N 2 0 347.478 2.577 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001341604225 1332270321 /nfs/dbraw/zinc/27/03/21/1332270321.db2.gz GMLCXCFLKJIDTI-NJYVYQBISA-N 2 0 343.515 2.970 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC001344578236 1332464376 /nfs/dbraw/zinc/46/43/76/1332464376.db2.gz CSNFFZYQPOBLDD-CVEARBPZSA-N 2 0 331.504 2.865 20 10 EFCDRP Cc1cnc(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000848562202 1334795912 /nfs/dbraw/zinc/79/59/12/1334795912.db2.gz BDUSRVUAKKOLOT-UHFFFAOYSA-N 2 0 338.499 2.783 20 10 EFCDRP Fc1cc(C[NH2+][C@H]2CCCN3CCCC[C@@H]23)ccc1N1CCOCC1 ZINC000848575655 1334803381 /nfs/dbraw/zinc/80/33/81/1334803381.db2.gz URHNGCNDMAYWOF-ICSRJNTNSA-N 2 0 347.478 2.769 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849350197 1335596633 /nfs/dbraw/zinc/59/66/33/1335596633.db2.gz LWLCBHLYYMSEGS-FQEVSTJZSA-N 2 0 343.515 2.735 20 10 EFCDRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891247445 714135324 /nfs/dbraw/zinc/13/53/24/714135324.db2.gz HJLKKNUBVIONQT-CRAIPNDOSA-N 2 0 348.535 2.638 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c(O)c1OC ZINC000892237471 715400615 /nfs/dbraw/zinc/40/06/15/715400615.db2.gz ZQLSSKNMMMUEEF-WMLDXEAASA-N 2 0 346.471 2.858 20 10 EFCDRP C[C@H]1CN(c2ccc(C[NH2+]CC3CC[NH+](C)CC3)cc2F)C[C@H](C)O1 ZINC000892624050 718352238 /nfs/dbraw/zinc/35/22/38/718352238.db2.gz YRPOCVPOFPAWRR-HOTGVXAUSA-N 2 0 349.494 2.871 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2[O-])C1 ZINC000894070551 720266330 /nfs/dbraw/zinc/26/63/30/720266330.db2.gz CPUCHKUSUFOMON-HNNXBMFYSA-N 2 0 328.403 2.603 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000157379817 728137958 /nfs/dbraw/zinc/13/79/58/728137958.db2.gz QHIJVYLSJVDIJA-UZLBHIALSA-N 2 0 331.504 2.984 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3cccc(C[NH3+])c3)CC2)cc1F ZINC001579225857 1090551091 /nfs/dbraw/zinc/55/10/91/1090551091.db2.gz XDCSVKFZKOCFDL-UHFFFAOYSA-N 2 0 329.419 2.615 20 10 EFCDRP [NH3+][C@@H](CC[NH2+]Cc1ccc(N2CCOCC2)cc1)Cc1ccccc1 ZINC001580127596 1090782665 /nfs/dbraw/zinc/78/26/65/1090782665.db2.gz MWKMGKMLTUTBSV-FQEVSTJZSA-N 2 0 339.483 2.573 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c1 ZINC000904458857 1107953944 /nfs/dbraw/zinc/95/39/44/1107953944.db2.gz HORYARKWFGLICY-UHFFFAOYSA-N 2 0 326.440 2.893 20 10 EFCDRP CCC[NH+]1CCC(NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC000898449415 1108943151 /nfs/dbraw/zinc/94/31/51/1108943151.db2.gz DYVSJLCFZKBJPX-HXUWFJFHSA-N 2 0 332.536 2.819 20 10 EFCDRP CCC[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1CC[NH2+]C1 ZINC001236834342 1118164535 /nfs/dbraw/zinc/16/45/35/1118164535.db2.gz HRZNFHZMDQRQIW-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1O ZINC000183486135 239555284 /nfs/dbraw/zinc/55/52/84/239555284.db2.gz ASFYKAUHSHXIBC-HNNXBMFYSA-N 2 0 341.455 2.534 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCC=CO3)cc2F)CC1 ZINC000194399470 240153723 /nfs/dbraw/zinc/15/37/23/240153723.db2.gz VVKVDDSUNWVMQQ-QGZVFWFLSA-N 2 0 333.451 2.750 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@@H]3O)CC1)CC2 ZINC000296245754 241078361 /nfs/dbraw/zinc/07/83/61/241078361.db2.gz AYYQGYWWJRBPLI-SQNIBIBYSA-N 2 0 330.472 2.737 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000364452034 242299189 /nfs/dbraw/zinc/29/91/89/242299189.db2.gz WBCRJDMCGQRUEN-RYQLBKOJSA-N 2 0 347.478 2.940 20 10 EFCDRP CN1CC[NH+](CC2CC[NH+](Cc3cc(Cl)ccc3O)CC2)CC1 ZINC000367672326 242388591 /nfs/dbraw/zinc/38/85/91/242388591.db2.gz RJKKLGUNPVBVBD-UHFFFAOYSA-N 2 0 337.895 2.505 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185392655 296146560 /nfs/dbraw/zinc/14/65/60/296146560.db2.gz FFIXQNQELFHQOX-JKSUJKDBSA-N 2 0 331.504 2.558 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000370625635 279046713 /nfs/dbraw/zinc/04/67/13/279046713.db2.gz ZHWJDQHHALYBOK-MJGOQNOKSA-N 2 0 344.547 2.962 20 10 EFCDRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cc(F)ccc1O ZINC000185042447 473310326 /nfs/dbraw/zinc/31/03/26/473310326.db2.gz GRMIIIRGLCSDRI-AWEZNQCLSA-N 2 0 344.434 2.529 20 10 EFCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccccc1O ZINC000185207519 473362189 /nfs/dbraw/zinc/36/21/89/473362189.db2.gz HNKUPORFZMENNH-SFHVURJKSA-N 2 0 340.471 2.780 20 10 EFCDRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3c(O)ccc4ccccc43)C2)CC1 ZINC000106854743 472898491 /nfs/dbraw/zinc/89/84/91/472898491.db2.gz MGQCUCITKHUFBN-SFHVURJKSA-N 2 0 339.483 2.757 20 10 EFCDRP C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CC[NH+](C)CC1 ZINC000185364504 473407087 /nfs/dbraw/zinc/40/70/87/473407087.db2.gz AIVOLFJFRGBWGR-HOTGVXAUSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185367148 473407368 /nfs/dbraw/zinc/40/73/68/473407368.db2.gz FUNMBUURXNJYPE-KRWDZBQOSA-N 2 0 345.531 2.949 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)C1 ZINC000151526524 473469643 /nfs/dbraw/zinc/46/96/43/473469643.db2.gz SYDRMKTWWMPPLN-DNVCBOLYSA-N 2 0 349.494 2.607 20 10 EFCDRP C[NH+](CCOCC[N@@H+](C)Cc1ccccc1O)Cc1ccccc1O ZINC000178693885 473544891 /nfs/dbraw/zinc/54/48/91/473544891.db2.gz ZUFLSNLAGHZCHP-UHFFFAOYSA-N 2 0 344.455 2.678 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)ccc1O ZINC000186520422 473685426 /nfs/dbraw/zinc/68/54/26/473685426.db2.gz DZUXFRXUWQJUKF-KDOFPFPSSA-N 2 0 344.430 2.949 20 10 EFCDRP CC[C@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000186580098 473693010 /nfs/dbraw/zinc/69/30/10/473693010.db2.gz BIQHTTMZIILWRG-PXNSSMCTSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cc(F)ccc3O)CC2)C[C@H](C)O1 ZINC000180001210 473773865 /nfs/dbraw/zinc/77/38/65/473773865.db2.gz CJEJQXKNHWWJML-GASCZTMLSA-N 2 0 336.451 2.853 20 10 EFCDRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(Cl)ccc1O ZINC000282507618 474091809 /nfs/dbraw/zinc/09/18/09/474091809.db2.gz YOXMATNNFPABKY-CYBMUJFWSA-N 2 0 325.884 2.722 20 10 EFCDRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1O ZINC000183723755 474419012 /nfs/dbraw/zinc/41/90/12/474419012.db2.gz HDFIOQIWOKFXKK-YJBOKZPZSA-N 2 0 326.440 2.810 20 10 EFCDRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cccc(F)c3[O-])CC2)C[C@H](C)O1 ZINC000272312905 474608635 /nfs/dbraw/zinc/60/86/35/474608635.db2.gz SALGQLYBCVUVOC-GASCZTMLSA-N 2 0 336.451 2.853 20 10 EFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1 ZINC000284279393 474609059 /nfs/dbraw/zinc/60/90/59/474609059.db2.gz XHNXNCSDKMMCCQ-MSOLQXFVSA-N 2 0 333.520 2.932 20 10 EFCDRP COc1ccc(N2CCC([NH2+]CC3(C)CC[NH+](C)CC3)CC2)cc1 ZINC000378552251 476718791 /nfs/dbraw/zinc/71/87/91/476718791.db2.gz QFANLUMYJLMNOT-UHFFFAOYSA-N 2 0 331.504 2.986 20 10 EFCDRP C[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1cc(Cl)ccc1O ZINC000368328341 477798273 /nfs/dbraw/zinc/79/82/73/477798273.db2.gz OXXABPXTZANBPC-ZFWWWQNUSA-N 2 0 337.895 2.865 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756395907 575730440 /nfs/dbraw/zinc/73/04/40/575730440.db2.gz KUKKDQQHQICREU-XJKSGUPXSA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756409078 575732817 /nfs/dbraw/zinc/73/28/17/575732817.db2.gz XHZFGYAXRVFOMF-QGZVFWFLSA-N 2 0 345.531 2.949 20 10 EFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000765473346 577044944 /nfs/dbraw/zinc/04/49/44/577044944.db2.gz XPHSBGHQBWYGOV-QGZVFWFLSA-N 2 0 331.504 2.986 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(C)CCO[C@@H]3C3CC3)cc2)CC1 ZINC000767194205 577199533 /nfs/dbraw/zinc/19/95/33/577199533.db2.gz ASTYSYROZNTKCU-RTWAWAEBSA-N 2 0 343.515 2.733 20 10 EFCDRP Oc1cccc(Cl)c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000769205690 577344241 /nfs/dbraw/zinc/34/42/41/577344241.db2.gz GOHALPNKYDMTMU-UHFFFAOYSA-N 2 0 338.879 2.980 20 10 EFCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000850565437 1250538889 /nfs/dbraw/zinc/53/88/89/1250538889.db2.gz DYIMGEUAZBJIIQ-UHFFFAOYSA-N 2 0 331.504 2.612 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)CC1 ZINC000850567332 1250539536 /nfs/dbraw/zinc/53/95/36/1250539536.db2.gz ZUYOKEIRVYFWOB-UHFFFAOYSA-N 2 0 343.515 2.612 20 10 EFCDRP Cc1nc([C@@H]2CCC[NH2+]C2)cc(N2C[C@H](CC[NH3+])c3ccccc32)n1 ZINC001168545436 1257059266 /nfs/dbraw/zinc/05/92/66/1257059266.db2.gz OUEHFWULECPOGG-CVEARBPZSA-N 2 0 337.471 2.836 20 10 EFCDRP Cc1nc([C@H]2CCC[NH2+]C2)cc(N2C[C@H](CC[NH3+])c3ccccc32)n1 ZINC001168545438 1257059971 /nfs/dbraw/zinc/05/99/71/1257059971.db2.gz OUEHFWULECPOGG-HOTGVXAUSA-N 2 0 337.471 2.836 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@@H]3OCCC[C@@H]3[NH3+])CC2)ccc1N(C)C ZINC000923374910 1261575263 /nfs/dbraw/zinc/57/52/63/1261575263.db2.gz FKPWFLLGGKVHLW-ICSRJNTNSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(OCC[NH+](C)C)CC2)cc1Cl ZINC000824769652 1278273913 /nfs/dbraw/zinc/27/39/13/1278273913.db2.gz XTDFCXVOTLEHMH-UHFFFAOYSA-N 2 0 326.868 2.897 20 10 EFCDRP Cc1cc(O)c(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1Cl ZINC000825297639 1278497658 /nfs/dbraw/zinc/49/76/58/1278497658.db2.gz JKZRAGXJECEYFT-AWEZNQCLSA-N 2 0 338.879 2.945 20 10 EFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000701073964 1269867224 /nfs/dbraw/zinc/86/72/24/1269867224.db2.gz GJALGVRLRQPOIH-LBPRGKRZSA-N 2 0 327.266 2.975 20 10 EFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1ccc(Br)cc1O ZINC000825436534 1278563836 /nfs/dbraw/zinc/56/38/36/1278563836.db2.gz VTHVRYASQBVSDG-AWEZNQCLSA-N 2 0 345.281 2.601 20 10 EFCDRP C[C@@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000702603460 1271555540 /nfs/dbraw/zinc/55/55/40/1271555540.db2.gz NDVGXCUEBIAPDZ-OXQOHEQNSA-N 2 0 326.440 2.680 20 10 EFCDRP C[C@H]1C[N@H+](Cc2c(O)cccc2Br)CCC[C@H]1C[NH3+] ZINC001206003147 1272721433 /nfs/dbraw/zinc/72/14/33/1272721433.db2.gz FKQOXZIDBIKFCC-RYUDHWBXSA-N 2 0 327.266 2.962 20 10 EFCDRP [NH3+]CC1CC[NH+](Cc2ccc(NCc3ccc(O)c(O)c3)cc2)CC1 ZINC001169997357 1274228735 /nfs/dbraw/zinc/22/87/35/1274228735.db2.gz ZZEAZSCBRDZTQC-UHFFFAOYSA-N 2 0 341.455 2.881 20 10 EFCDRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817893516 1276362652 /nfs/dbraw/zinc/36/26/52/1276362652.db2.gz GGRJAVDZMNCSJR-LAUBAEHRSA-N 2 0 339.483 2.571 20 10 EFCDRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817893515 1276363514 /nfs/dbraw/zinc/36/35/14/1276363514.db2.gz GGRJAVDZMNCSJR-DYESRHJHSA-N 2 0 339.483 2.571 20 10 EFCDRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817896152 1276365019 /nfs/dbraw/zinc/36/50/19/1276365019.db2.gz YRJLAHLGTOIIEJ-VQTJNVASSA-N 2 0 331.504 2.645 20 10 EFCDRP C[C@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCC[NH2+]1 ZINC000817903925 1276368751 /nfs/dbraw/zinc/36/87/51/1276368751.db2.gz XBZQHLAIADPFGZ-SUMWQHHRSA-N 2 0 339.430 2.987 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817937559 1276382874 /nfs/dbraw/zinc/38/28/74/1276382874.db2.gz XUFBRUYZXHCQEX-QGZVFWFLSA-N 2 0 348.510 2.762 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817937347 1276383904 /nfs/dbraw/zinc/38/39/04/1276383904.db2.gz WTKHUSCJPZIWMC-GOSISDBHSA-N 2 0 330.520 2.623 20 10 EFCDRP CC[C@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(C)cc1O ZINC000817971556 1276414988 /nfs/dbraw/zinc/41/49/88/1276414988.db2.gz FAYCJWHYLYPECT-HOCLYGCPSA-N 2 0 345.409 2.577 20 10 EFCDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983570 1276421839 /nfs/dbraw/zinc/42/18/39/1276421839.db2.gz GPNYAPHEGKDPKK-HNNXBMFYSA-N 2 0 333.451 2.623 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000817987153 1276429767 /nfs/dbraw/zinc/42/97/67/1276429767.db2.gz WTERELRAOXZWPY-WZGPROSRSA-N 2 0 329.488 2.562 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000818221954 1276493433 /nfs/dbraw/zinc/49/34/33/1276493433.db2.gz PTXNUSGPRXGBQK-ZHALLVOQSA-N 2 0 329.488 2.738 20 10 EFCDRP COc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C(C)C)CC3)C2)cc1 ZINC000818344170 1276511449 /nfs/dbraw/zinc/51/14/49/1276511449.db2.gz KGTPDIOOKWVEEU-KRWDZBQOSA-N 2 0 331.504 2.984 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)[C@@H](C)C1 ZINC000818344142 1276511486 /nfs/dbraw/zinc/51/14/86/1276511486.db2.gz JUARENPNVBUMOD-ZWOKBUDYSA-N 2 0 331.504 2.841 20 10 EFCDRP COc1ccc(N2CC[C@@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)cc1 ZINC000818342723 1276511757 /nfs/dbraw/zinc/51/17/57/1276511757.db2.gz UXEPNQIAFORMKB-WELJNPPOSA-N 2 0 329.488 2.736 20 10 EFCDRP COc1ccc(N2CC[C@@H](C[NH2+][C@@H](C)C3CC[NH+](C)CC3)C2)cc1 ZINC000818345278 1276511830 /nfs/dbraw/zinc/51/18/30/1276511830.db2.gz SWBVKJAOFVSCND-IRXDYDNUSA-N 2 0 331.504 2.841 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](C(C)(C)C)C3)cc2)CC1 ZINC000790930882 1277853355 /nfs/dbraw/zinc/85/33/55/1277853355.db2.gz JXAZTSNVYINCEZ-IBGZPJMESA-N 2 0 331.504 2.685 20 10 EFCDRP COc1ccc(C[NH2+]CCCC[C@H](C)NC(=O)CC[NH+](C)C)cc1C ZINC001175048324 1287306991 /nfs/dbraw/zinc/30/69/91/1287306991.db2.gz GPJYSALUQGQFRZ-KRWDZBQOSA-N 2 0 349.519 2.720 20 10 EFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1CC[NH3+] ZINC000844900645 1279322134 /nfs/dbraw/zinc/32/21/34/1279322134.db2.gz CAOWEBXQLYLTQZ-CRAIPNDOSA-N 2 0 335.467 2.612 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1O ZINC000844902465 1279324882 /nfs/dbraw/zinc/32/48/82/1279324882.db2.gz NCZLMNPZUXLALN-YXJHDRRASA-N 2 0 334.460 2.509 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902464 1279325295 /nfs/dbraw/zinc/32/52/95/1279325295.db2.gz NCZLMNPZUXLALN-QILLFSRXSA-N 2 0 334.460 2.509 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000845991702 1279962161 /nfs/dbraw/zinc/96/21/61/1279962161.db2.gz VUXNLNRKASCMDV-MRXNPFEDSA-N 2 0 325.456 2.995 20 10 EFCDRP COc1ccc(C[NH2+][C@@H](C)C[C@H](C)NC(=O)C[N@H+](C)C(C)C)cc1C ZINC001146600033 1280948073 /nfs/dbraw/zinc/94/80/73/1280948073.db2.gz DSUSHHMOUBVLAQ-IRXDYDNUSA-N 2 0 349.519 2.717 20 10 EFCDRP COCC(C)(C)CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000808428905 1281724615 /nfs/dbraw/zinc/72/46/15/1281724615.db2.gz VAPFOQJYEJDAFA-UHFFFAOYSA-N 2 0 333.520 2.981 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693338 1281847141 /nfs/dbraw/zinc/84/71/41/1281847141.db2.gz GJUKYNSHSBAHES-UONOGXRCSA-N 2 0 325.884 2.641 20 10 EFCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000809767501 1282430472 /nfs/dbraw/zinc/43/04/72/1282430472.db2.gz MZORJKSBCHSRTH-IEBWSBKVSA-N 2 0 347.478 2.578 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]3(C)CCCO)cc2)CC1 ZINC000809756124 1282458441 /nfs/dbraw/zinc/45/84/41/1282458441.db2.gz DGZLEJQRPXGRST-FQEVSTJZSA-N 2 0 331.504 2.565 20 10 EFCDRP Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000815578979 1287610732 /nfs/dbraw/zinc/61/07/32/1287610732.db2.gz BRAUZMALVVUSPL-DLBZAZTESA-N 2 0 331.504 2.828 20 10 EFCDRP CC[C@@H]([NH2+]C[C@]1(O)CCN(C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810238081 1283088849 /nfs/dbraw/zinc/08/88/49/1283088849.db2.gz XXWIKPGSKCWGED-UKRRQHHQSA-N 2 0 332.366 2.518 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811510673 1284391107 /nfs/dbraw/zinc/39/11/07/1284391107.db2.gz MSICSDFXBBWEJZ-VQTJNVASSA-N 2 0 343.515 2.828 20 10 EFCDRP COc1ccc(C[NH2+]CCCCCCNC(=O)CC[NH+](C)C)cc1C ZINC001179464065 1289151975 /nfs/dbraw/zinc/15/19/75/1289151975.db2.gz LJUNSOPSGNGZKA-UHFFFAOYSA-N 2 0 349.519 2.722 20 10 EFCDRP C[NH+](C)CCN1CCC([NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816534435 1288191976 /nfs/dbraw/zinc/19/19/76/1288191976.db2.gz IPZNCZIOGHHOFX-UHFFFAOYSA-N 2 0 327.472 2.661 20 10 EFCDRP C[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)CN1CC[NH+](C)CC1 ZINC000816547551 1288198567 /nfs/dbraw/zinc/19/85/67/1288198567.db2.gz AAYCYHMCEQMQQP-INIZCTEOSA-N 2 0 327.472 2.519 20 10 EFCDRP CC[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC)O1 ZINC000817412071 1288590431 /nfs/dbraw/zinc/59/04/31/1288590431.db2.gz CLFLZYCRIVFEBC-BGYRXZFFSA-N 2 0 331.504 2.828 20 10 EFCDRP CCCOc1ccc(C[NH2+]C[C@H](C)N2CC[NH+](CC)CC2)cc1C ZINC000873011639 1289518219 /nfs/dbraw/zinc/51/82/19/1289518219.db2.gz BUJKPBXBYXFQBR-SFHVURJKSA-N 2 0 333.520 2.899 20 10 EFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1Cn1cccn1 ZINC000873061274 1289545313 /nfs/dbraw/zinc/54/53/13/1289545313.db2.gz RAELXANEGIQLPQ-CRAIPNDOSA-N 2 0 328.460 2.512 20 10 EFCDRP Cc1cc(C)c([C@H](C)Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c(O)c1 ZINC000873240570 1289673465 /nfs/dbraw/zinc/67/34/65/1289673465.db2.gz AKAGMTDJBZAQQD-HNNXBMFYSA-N 2 0 326.444 2.987 20 10 EFCDRP Cc1ccc([C@@H](C)Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c(O)c1C ZINC000873245959 1289677946 /nfs/dbraw/zinc/67/79/46/1289677946.db2.gz QJCPMKJBTVMOJB-OAHLLOKOSA-N 2 0 326.444 2.987 20 10 EFCDRP C[C@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1cc(F)cc(F)c1O ZINC000873244749 1289678298 /nfs/dbraw/zinc/67/82/98/1289678298.db2.gz JUNUXLZNTQLOSD-NSHDSACASA-N 2 0 334.370 2.648 20 10 EFCDRP CC[C@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000873290734 1289706138 /nfs/dbraw/zinc/70/61/38/1289706138.db2.gz GUEBKDRQXMULPU-MOPGFXCFSA-N 2 0 331.504 2.952 20 10 EFCDRP CCC[NH+]1CCC(N(C)Cc2ccc(N3CCOCC3)c(F)c2)CC1 ZINC000092165569 1290656831 /nfs/dbraw/zinc/65/68/31/1290656831.db2.gz HTRQSUIEYQBHNN-UHFFFAOYSA-N 2 0 349.494 2.969 20 10 EFCDRP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CCOCC3)c(F)c2)CC1 ZINC000092381122 1290687689 /nfs/dbraw/zinc/68/76/89/1290687689.db2.gz AFRHLJCRSGQRLG-UHFFFAOYSA-N 2 0 349.494 2.826 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCC(O)CC3)cc2)C[C@H]1C ZINC000876757998 1291009561 /nfs/dbraw/zinc/00/95/61/1291009561.db2.gz HDALQXVNHGRJPP-XLIONFOSSA-N 2 0 345.531 2.952 20 10 EFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876775024 1291017812 /nfs/dbraw/zinc/01/78/12/1291017812.db2.gz MJYMOXDVQUQDFU-LJQANCHMSA-N 2 0 345.531 2.811 20 10 EFCDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000126386700 1291153645 /nfs/dbraw/zinc/15/36/45/1291153645.db2.gz IIEGAFNMPISSNL-OAHLLOKOSA-N 2 0 335.467 2.655 20 10 EFCDRP CC[N@H+](C)C[C@H]1CCN(Cc2cc(Br)ccc2O)C1 ZINC000093769918 1291214010 /nfs/dbraw/zinc/21/40/10/1291214010.db2.gz CKGGJKJTUYXNLF-GFCCVEGCSA-N 2 0 327.266 2.928 20 10 EFCDRP C[NH+]1CCN(C2CC[NH+](Cc3ccc4ccccc4c3O)CC2)CC1 ZINC000877746576 1291355748 /nfs/dbraw/zinc/35/57/48/1291355748.db2.gz RQWDQXTZINPBCV-UHFFFAOYSA-N 2 0 339.483 2.757 20 10 EFCDRP COc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001203627733 1312974922 /nfs/dbraw/zinc/97/49/22/1312974922.db2.gz MIXIZGLLFGFKEH-KDURUIRLSA-N 2 0 338.451 2.965 20 10 EFCDRP COc1ccc(O)c(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001203678024 1312988192 /nfs/dbraw/zinc/98/81/92/1312988192.db2.gz FSHFMLJVZODTCY-RTBURBONSA-N 2 0 338.451 2.965 20 10 EFCDRP COC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000883290425 1293534378 /nfs/dbraw/zinc/53/43/78/1293534378.db2.gz UTBPBCCDTNYOKH-FQEVSTJZSA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)cc2)CC1 ZINC000775659627 1293943413 /nfs/dbraw/zinc/94/34/13/1293943413.db2.gz ZOQNUOZPTOISQC-GOSISDBHSA-N 2 0 339.487 2.541 20 10 EFCDRP CC(C)CO[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775737866 1294345151 /nfs/dbraw/zinc/34/51/51/1294345151.db2.gz NVADHOALQAWBBK-HXUWFJFHSA-N 2 0 331.504 2.685 20 10 EFCDRP C[C@@H]([NH2+]C[C@@H](O)CN(C)Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000775830925 1294921365 /nfs/dbraw/zinc/92/13/65/1294921365.db2.gz NKJRLJWYUHPATJ-DYESRHJHSA-N 2 0 341.499 2.896 20 10 EFCDRP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4ccc(O)cc4O)C[C@@H]3C2)cc1 ZINC001204272639 1313113430 /nfs/dbraw/zinc/11/34/30/1313113430.db2.gz FGMKEXOUQIJDNL-OALUTQOASA-N 2 0 338.451 2.970 20 10 EFCDRP CC[NH+](CC)CCN(CC[NH+](CC)CC)Cc1ccc(O)cc1O ZINC001204279518 1313115555 /nfs/dbraw/zinc/11/55/55/1313115555.db2.gz ABHCWCLUSFOAOE-UHFFFAOYSA-N 2 0 337.508 2.583 20 10 EFCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)c2c1 ZINC001234535592 1313149107 /nfs/dbraw/zinc/14/91/07/1313149107.db2.gz BJOHEXPGNZHHQV-CVEARBPZSA-N 2 0 326.440 2.938 20 10 EFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccc(OC)cc43)C[C@@H]2C1 ZINC001234570281 1313160379 /nfs/dbraw/zinc/16/03/79/1313160379.db2.gz XUHXWAXYTVGMTP-IYBDPMFKSA-N 2 0 326.440 2.938 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)cc2)CC1 ZINC001234660988 1313180117 /nfs/dbraw/zinc/18/01/17/1313180117.db2.gz NXXYMOHBZJELCS-WGMWDUQUSA-N 2 0 343.515 2.938 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1cccc(-c2ccccc2)c1O ZINC001234996296 1313219232 /nfs/dbraw/zinc/21/92/32/1313219232.db2.gz ZXNGTABAKJGUQW-UHFFFAOYSA-N 2 0 341.499 2.984 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC2(CC[N@H+](Cc3cn[nH]c3)C2)CC1 ZINC001275266937 1296246641 /nfs/dbraw/zinc/24/66/41/1296246641.db2.gz GQSSZRNBMIZQJN-UHFFFAOYSA-N 2 0 326.444 2.603 20 10 EFCDRP Oc1ccc(O)c(C[N@H+]2C[C@@H]3CC[NH+](Cc4ccc[nH]4)CC[C@@H]3C2)c1 ZINC001275419148 1296277940 /nfs/dbraw/zinc/27/79/40/1296277940.db2.gz ROHYCXXZRUSZPY-IYBDPMFKSA-N 2 0 341.455 2.770 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235229290 1313270369 /nfs/dbraw/zinc/27/03/69/1313270369.db2.gz KVFAPTGJCOUQBL-OAQYLSRUSA-N 2 0 343.515 2.877 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c2ccccc2n1C ZINC001205280879 1313264160 /nfs/dbraw/zinc/26/41/60/1313264160.db2.gz KWIAJVYKHGDYQT-IBGZPJMESA-N 2 0 329.444 2.668 20 10 EFCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205289288 1313264901 /nfs/dbraw/zinc/26/49/01/1313264901.db2.gz WDZRNAWKUUMSGD-GOSISDBHSA-N 2 0 337.895 2.880 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235229289 1313270467 /nfs/dbraw/zinc/27/04/67/1313270467.db2.gz KVFAPTGJCOUQBL-NRFANRHFSA-N 2 0 343.515 2.877 20 10 EFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001205581928 1313317839 /nfs/dbraw/zinc/31/78/39/1313317839.db2.gz VKFGLBDUHJDHRR-AWEZNQCLSA-N 2 0 336.329 2.944 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)[C@H](C[NH3+])CC3)cc2)CC1 ZINC001205627231 1313325738 /nfs/dbraw/zinc/32/57/38/1313325738.db2.gz ODVXHNKRNDLCBY-QUCCMNQESA-N 3 0 344.547 2.635 20 10 EFCDRP COC(=O)c1c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c2ccccc2n1C ZINC001205637891 1313328329 /nfs/dbraw/zinc/32/83/29/1313328329.db2.gz JTHOAGUCOJYASN-GJZGRUSLSA-N 2 0 343.471 2.772 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc(O)c(Br)cc2O)CC[C@@H]1C[NH3+] ZINC001205651125 1313331249 /nfs/dbraw/zinc/33/12/49/1313331249.db2.gz AIWFVKOZDFLMHE-GHMZBOCLSA-N 2 0 343.265 2.667 20 10 EFCDRP C[N@H+](CCCc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001235669366 1313370817 /nfs/dbraw/zinc/37/08/17/1313370817.db2.gz GNBYWIHBIVXTHE-UHFFFAOYSA-N 2 0 339.483 2.866 20 10 EFCDRP C[NH2+]CC1CC[NH+](Cc2cc(C)c(Br)cc2O)CC1 ZINC001235679004 1313372954 /nfs/dbraw/zinc/37/29/54/1313372954.db2.gz KAZKQWCVXFMYAT-UHFFFAOYSA-N 2 0 327.266 2.895 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@H+](C)CCC3CC[NH2+]CC3)cc2)CC1 ZINC001235716417 1313383101 /nfs/dbraw/zinc/38/31/01/1313383101.db2.gz AUOKOFVFXMEIST-UHFFFAOYSA-N 3 0 344.547 2.650 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H](N3CC([NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236071860 1313437051 /nfs/dbraw/zinc/43/70/51/1313437051.db2.gz BKSASUZCCGWSRY-NRFANRHFSA-N 2 0 338.499 2.701 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H](N3CC([NH3+])C3)C2)c2ccccc21 ZINC001236073572 1313437758 /nfs/dbraw/zinc/43/77/58/1313437758.db2.gz PAVKZCNUDDAMNK-SFHVURJKSA-N 2 0 338.499 2.513 20 10 EFCDRP C[N@H+](CCN1CC[NH2+]CC1)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001236082009 1313439916 /nfs/dbraw/zinc/43/99/16/1313439916.db2.gz VFFBHXXWJDSYOL-UHFFFAOYSA-N 2 0 339.911 2.680 20 10 EFCDRP C[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236216884 1313457392 /nfs/dbraw/zinc/45/73/92/1313457392.db2.gz LVWDKMYYUFAVEI-QZTJIDSGSA-N 2 0 329.488 2.793 20 10 EFCDRP C[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236216886 1313457468 /nfs/dbraw/zinc/45/74/68/1313457468.db2.gz LVWDKMYYUFAVEI-ZWKOTPCHSA-N 2 0 329.488 2.793 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C3CC3)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001236238514 1313459552 /nfs/dbraw/zinc/45/95/52/1313459552.db2.gz FUNJBKBYPPBWGI-OAQYLSRUSA-N 2 0 342.531 2.545 20 10 EFCDRP CCOC(=O)c1c(C[NH+]2CCC(CC[NH3+])CC2)c2ccccc2n1C ZINC001206506629 1313466123 /nfs/dbraw/zinc/46/61/23/1313466123.db2.gz IKQPSLKSVMJTLA-UHFFFAOYSA-N 2 0 343.471 2.916 20 10 EFCDRP Clc1cc(N2CCOCC2)ccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236320925 1313468947 /nfs/dbraw/zinc/46/89/47/1313468947.db2.gz MHFQYEPABKURHU-IYBDPMFKSA-N 2 0 349.906 2.608 20 10 EFCDRP Oc1cccc(OC(F)(F)F)c1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321653 1313469436 /nfs/dbraw/zinc/46/94/36/1313469436.db2.gz VBDLAUHTJMAZEY-TXEJJXNPSA-N 2 0 330.350 2.722 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236925015 1313554245 /nfs/dbraw/zinc/55/42/45/1313554245.db2.gz VREMCJMNUFKEIU-NRFANRHFSA-N 2 0 344.547 2.793 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(C(C)(C)C)ccc1O)[C@H]1CCC[NH2+]C1 ZINC001236932807 1313556582 /nfs/dbraw/zinc/55/65/82/1313556582.db2.gz NRLLVSYRYBOAMT-SFHVURJKSA-N 2 0 333.520 2.805 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)C[C@@]3(C)CO)c(F)c2)CC1 ZINC001236933130 1313556654 /nfs/dbraw/zinc/55/66/54/1313556654.db2.gz VGDUASVPIJYHNZ-FQEVSTJZSA-N 2 0 349.494 2.560 20 10 EFCDRP C[NH+](C)CCN(Cc1c(O)ccc2ccccc21)[C@@H]1CCC[NH2+]C1 ZINC001236933006 1313556908 /nfs/dbraw/zinc/55/69/08/1313556908.db2.gz PPSYPTPPNCGPBY-QGZVFWFLSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(CO)CC3)c(F)c2)CC1 ZINC001236933057 1313556934 /nfs/dbraw/zinc/55/69/34/1313556934.db2.gz UAROOQOPOMSZIR-HXUWFJFHSA-N 2 0 349.494 2.562 20 10 EFCDRP CCOCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236941869 1313557853 /nfs/dbraw/zinc/55/78/53/1313557853.db2.gz GMGOEWZNGTZPCM-UHFFFAOYSA-N 2 0 349.494 2.826 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]4(C3)CCCOC4)c(F)c2)CC1 ZINC001236941785 1313558232 /nfs/dbraw/zinc/55/82/32/1313558232.db2.gz FPNQJQMYNSTFQH-FQEVSTJZSA-N 2 0 347.478 2.580 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1c(O)ccc(Cl)c1Cl ZINC001237082725 1313583972 /nfs/dbraw/zinc/58/39/72/1313583972.db2.gz UONZWDXQLZXDJE-UHFFFAOYSA-N 2 0 334.291 2.624 20 10 EFCDRP CC(C)c1ccc(CN2CC[NH+](CC3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001237054562 1313578156 /nfs/dbraw/zinc/57/81/56/1313578156.db2.gz CNYQNPGOLPMCML-UHFFFAOYSA-N 2 0 345.531 2.975 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237390495 1313634643 /nfs/dbraw/zinc/63/46/43/1313634643.db2.gz IRXDQVSWMDNDEU-LPHOPBHVSA-N 2 0 341.499 2.665 20 10 EFCDRP Oc1cc(O)c(C[N@H+]2C[C@@H]3CC[NH+](C4CCCC4)CC[C@@H]3C2)cc1O ZINC001276516841 1313638430 /nfs/dbraw/zinc/63/84/30/1313638430.db2.gz RSAWQCGNXIESOQ-GASCZTMLSA-N 2 0 346.471 2.890 20 10 EFCDRP CC(=O)c1cc(F)cc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1O ZINC000852753552 1299863741 /nfs/dbraw/zinc/86/37/41/1299863741.db2.gz DPPSQVVOKOOGKN-HNNXBMFYSA-N 2 0 334.435 2.946 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@H+](C)CCN2CC[NH+](C)CC2)cc1 ZINC001209520174 1314179318 /nfs/dbraw/zinc/17/93/18/1314179318.db2.gz PUAUNRZFZYPWCT-UHFFFAOYSA-N 2 0 340.515 2.773 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCNC3(CC[NH2+]CC3)C2)cc1 ZINC001222085640 1311081796 /nfs/dbraw/zinc/08/17/96/1311081796.db2.gz GDDBLQXEYRKMQY-UHFFFAOYSA-N 2 0 338.499 2.622 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCC[NH2+]4)C3)cc2)CC1 ZINC001222354853 1311118533 /nfs/dbraw/zinc/11/85/33/1311118533.db2.gz OIDPWFIJXAQGGE-NRFANRHFSA-N 3 0 342.531 2.547 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CC[C@]4(C3)CCCC[NH2+]4)cc2)CC1 ZINC001222426658 1311129511 /nfs/dbraw/zinc/12/95/11/1311129511.db2.gz HLDDGNOGQARCCH-NRFANRHFSA-N 2 0 342.531 2.547 20 10 EFCDRP CCN(CC)c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c(OC)c1 ZINC001222623174 1311162872 /nfs/dbraw/zinc/16/28/72/1311162872.db2.gz DMAAJOHQPAXDNA-CALCHBBNSA-N 2 0 331.504 2.973 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)[NH+](C)C)cc1 ZINC000902518332 1311827830 /nfs/dbraw/zinc/82/78/30/1311827830.db2.gz PDQKPDULGHVMBV-BQJUDKOJSA-N 2 0 344.547 2.866 20 10 EFCDRP Cc1cc(F)cc(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001277519885 1312500410 /nfs/dbraw/zinc/50/04/10/1312500410.db2.gz PNIQNTZAKMSTEK-HXUWFJFHSA-N 2 0 349.494 2.689 20 10 EFCDRP C[NH+]1CCN(c2ccc(C3=CC[C@H]([NH+]4CCOCC4)CC3)cc2)CC1 ZINC001245427081 1314489435 /nfs/dbraw/zinc/48/94/35/1314489435.db2.gz VQSBJUAFYODUFG-NRFANRHFSA-N 2 0 341.499 2.707 20 10 EFCDRP Fc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246173295 1314593642 /nfs/dbraw/zinc/59/36/42/1314593642.db2.gz LAXMLLVWGFCQHG-GOSISDBHSA-N 2 0 339.458 2.882 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CCC34CC[NH2+]CC4)cc2)CC1 ZINC001218080219 1315145470 /nfs/dbraw/zinc/14/54/70/1315145470.db2.gz KLPNMLHQJNRNRE-IBGZPJMESA-N 2 0 329.488 2.740 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3CCC[C@@]34CC[NH2+]C4)cc2)CC1 ZINC001218095179 1315147570 /nfs/dbraw/zinc/14/75/70/1315147570.db2.gz GVFUUHAIQCJAAS-UXHICEINSA-N 2 0 329.488 2.740 20 10 EFCDRP CCc1ccc(C[N@@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001276805408 1315318181 /nfs/dbraw/zinc/31/81/81/1315318181.db2.gz WJSANUWXJVYSRL-NRFANRHFSA-N 2 0 345.531 2.804 20 10 EFCDRP COc1cc(O)c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1OC ZINC000827843213 1316021890 /nfs/dbraw/zinc/02/18/90/1316021890.db2.gz ANCWAZSQWSFQIJ-UHFFFAOYSA-N 2 0 334.460 2.621 20 10 EFCDRP C[C@H]1C[N@H+](CCC[NH2+]Cc2ccc(N3CCCC3)cc2)CCCO1 ZINC001320785219 1329301839 /nfs/dbraw/zinc/30/18/39/1329301839.db2.gz BDKXPROORIGYEV-SFHVURJKSA-N 2 0 331.504 2.877 20 10 EFCDRP CCC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001320870017 1329312527 /nfs/dbraw/zinc/31/25/27/1329312527.db2.gz WCHZVWWETPMIIT-FQEVSTJZSA-N 2 0 349.494 2.705 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001321024260 1329332601 /nfs/dbraw/zinc/33/26/01/1329332601.db2.gz QIYGDOCVMFWTAJ-GVDBMIGSSA-N 2 0 331.504 2.865 20 10 EFCDRP C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C[C@H](C2CC2)O1 ZINC001339602689 1331910401 /nfs/dbraw/zinc/91/04/01/1331910401.db2.gz AFLCCZRAUMEWHS-MGPUTAFESA-N 2 0 347.478 2.577 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC001344578243 1332464478 /nfs/dbraw/zinc/46/44/78/1332464478.db2.gz CSNFFZYQPOBLDD-JKSUJKDBSA-N 2 0 331.504 2.865 20 10 EFCDRP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000848565952 1334798305 /nfs/dbraw/zinc/79/83/05/1334798305.db2.gz OGLHGJYYCYLIQJ-INIZCTEOSA-N 2 0 347.503 2.506 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCN4CCCC[C@H]34)cc2)CC1 ZINC000848575714 1334804118 /nfs/dbraw/zinc/80/41/18/1334804118.db2.gz VYORRYHEQAVDGT-LEWJYISDSA-N 3 0 342.531 2.545 20 10 EFCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000849350185 1335596491 /nfs/dbraw/zinc/59/64/91/1335596491.db2.gz LVNRPGWJHCGHFN-MVJPYGJCSA-N 2 0 329.488 2.784 20 10 EFCDRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891247450 714135341 /nfs/dbraw/zinc/13/53/41/714135341.db2.gz HJLKKNUBVIONQT-QAPCUYQASA-N 2 0 348.535 2.638 20 10 EFCDRP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3cc(Br)ccc3O)C[C@@H]21 ZINC000220348491 720886517 /nfs/dbraw/zinc/88/65/17/720886517.db2.gz DSRUDECEUIWUIX-DDTOSNHZSA-N 2 0 325.250 2.714 20 10 EFCDRP C[C@@H](Cn1ccnc1)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000915229715 726907832 /nfs/dbraw/zinc/90/78/32/726907832.db2.gz NMYMJYSSWZCQHK-HNNXBMFYSA-N 2 0 343.431 2.960 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1CCC[NH2+]C1 ZINC000226439079 728245902 /nfs/dbraw/zinc/24/59/02/728245902.db2.gz MNCGOHDRHCUJRB-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1CCC[NH2+]C1 ZINC000226439084 728246003 /nfs/dbraw/zinc/24/60/03/728246003.db2.gz MNCGOHDRHCUJRB-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[C@H]([NH3+])[C@H]4C3)cc2)CC1 ZINC001578940868 1090484088 /nfs/dbraw/zinc/48/40/88/1090484088.db2.gz LJWJMCMVJNMGRN-YYWHXJBOSA-N 2 0 343.515 2.861 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@H](C)[NH3+])C3)cc2)CC1 ZINC001578941086 1090484189 /nfs/dbraw/zinc/48/41/89/1090484189.db2.gz ODJGYOWWGJGRLS-FUHWJXTLSA-N 2 0 331.504 2.861 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4[NH2+]CCC[C@@H]4C3)cc2)CC1 ZINC001580879771 1091031973 /nfs/dbraw/zinc/03/19/73/1091031973.db2.gz FIOYJTATWOFGFA-DBXWQHBBSA-N 2 0 343.515 2.658 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC001580888747 1091036192 /nfs/dbraw/zinc/03/61/92/1091036192.db2.gz XVZLFMFUXZVUTJ-ZKYQVNSYSA-N 2 0 325.250 2.632 20 10 EFCDRP [NH3+]CC1(N(Cc2ccccc2)c2ccc([C@@H]3CCC[NH2+]3)cc2)COC1 ZINC001167374678 1102916743 /nfs/dbraw/zinc/91/67/43/1102916743.db2.gz RMUGOWOLJRSLDL-FQEVSTJZSA-N 2 0 337.467 2.845 20 10 EFCDRP C[NH+](C)C1CCC([N@H+](C)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001168324604 1106771849 /nfs/dbraw/zinc/77/18/49/1106771849.db2.gz RAWGLOZGWZVWQG-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP COc1cccc(O)c1C[NH+]1CCC(C[NH3+])(c2ccccc2)CC1 ZINC000904458938 1107953539 /nfs/dbraw/zinc/95/35/39/1107953539.db2.gz KVTOIOFRABUQAH-UHFFFAOYSA-N 2 0 326.440 2.893 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000183433473 1118725833 /nfs/dbraw/zinc/72/58/33/1118725833.db2.gz DNZFOKOQZZLDBX-KRWDZBQOSA-N 2 0 339.483 2.990 20 10 EFCDRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185022252 1119685083 /nfs/dbraw/zinc/68/50/83/1119685083.db2.gz UWMDKVXKIZDNOT-DLBZAZTESA-N 2 0 345.531 2.948 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccnn3C)cc2F)CC1 ZINC000192843139 240067188 /nfs/dbraw/zinc/06/71/88/240067188.db2.gz VBEFJVVLMUMEHN-OAHLLOKOSA-N 2 0 345.466 2.552 20 10 EFCDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297165837 241112779 /nfs/dbraw/zinc/11/27/79/241112779.db2.gz DCISCRQJNQQYRX-QGZVFWFLSA-N 2 0 341.455 2.895 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1C ZINC000365431673 242325237 /nfs/dbraw/zinc/32/52/37/242325237.db2.gz UWZGNQIAHDOGFV-UHFFFAOYSA-N 2 0 332.488 2.943 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000363785106 287059745 /nfs/dbraw/zinc/05/97/45/287059745.db2.gz ODPZJTBSYYSEKJ-SJLPKXTDSA-N 2 0 330.520 2.572 20 10 EFCDRP CC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(N(C)C)cc1 ZINC000150975653 473390567 /nfs/dbraw/zinc/39/05/67/473390567.db2.gz RJYRDWTUKURHTB-FQEVSTJZSA-N 2 0 332.536 2.819 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000120929331 472769903 /nfs/dbraw/zinc/76/99/03/472769903.db2.gz SUYINZUWFRNHRP-YLJYHZDGSA-N 2 0 332.536 2.677 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665907 472957714 /nfs/dbraw/zinc/95/77/14/472957714.db2.gz WNPOQFAFMAJBRF-HDICACEKSA-N 2 0 331.504 2.691 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c1 ZINC000185491863 473441277 /nfs/dbraw/zinc/44/12/77/473441277.db2.gz WKWDLRJFTDYQGI-LSDHHAIUSA-N 2 0 334.460 2.552 20 10 EFCDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000178412491 473509154 /nfs/dbraw/zinc/50/91/54/473509154.db2.gz INMKBVKEXHMFOR-MRXNPFEDSA-N 2 0 335.467 2.799 20 10 EFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c1 ZINC000186127103 473596472 /nfs/dbraw/zinc/59/64/72/473596472.db2.gz QOYZJNRQEULAAP-WNYOCNMUSA-N 2 0 348.487 2.819 20 10 EFCDRP CC[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000186580121 473693102 /nfs/dbraw/zinc/69/31/02/473693102.db2.gz BIQHTTMZIILWRG-FXAWDEMLSA-N 2 0 332.536 2.819 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cc1 ZINC000186591659 473695717 /nfs/dbraw/zinc/69/57/17/473695717.db2.gz OMSBEXDPIBWSKV-ROUUACIJSA-N 2 0 332.536 2.819 20 10 EFCDRP Cc1ccc(O)c(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1 ZINC000288610003 473998879 /nfs/dbraw/zinc/99/88/79/473998879.db2.gz QOEZRELRTTZRNO-UHFFFAOYSA-N 2 0 329.444 2.716 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccccc1O ZINC000183609075 474399781 /nfs/dbraw/zinc/39/97/81/474399781.db2.gz JQMVRNTWSOIUMD-HNNXBMFYSA-N 2 0 341.455 2.534 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1OC ZINC000271089465 474401756 /nfs/dbraw/zinc/40/17/56/474401756.db2.gz KHHJVYUNIKIMIB-HNNXBMFYSA-N 2 0 334.460 2.573 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1C ZINC000273389262 474875590 /nfs/dbraw/zinc/87/55/90/474875590.db2.gz KIZBDRQAWKFXGP-MJGOQNOKSA-N 2 0 333.520 2.932 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1C ZINC000273389259 474875717 /nfs/dbraw/zinc/87/57/17/474875717.db2.gz KIZBDRQAWKFXGP-IEBWSBKVSA-N 2 0 333.520 2.932 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)Cn2ccnc2C)c1 ZINC000273608546 474987367 /nfs/dbraw/zinc/98/73/67/474987367.db2.gz UYUIYBOGKOPDAH-STQMWFEESA-N 2 0 331.416 2.671 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)Cn2ccnc2C)c1 ZINC000273608542 474988278 /nfs/dbraw/zinc/98/82/78/474988278.db2.gz UYUIYBOGKOPDAH-OLZOCXBDSA-N 2 0 331.416 2.671 20 10 EFCDRP C[N@H+](Cc1cc(Cl)ccc1O)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377630269 476487562 /nfs/dbraw/zinc/48/75/62/476487562.db2.gz QHRPGJDWADWKJF-QGZVFWFLSA-N 2 0 337.895 2.646 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1 ZINC000375246661 476736987 /nfs/dbraw/zinc/73/69/87/476736987.db2.gz XKGRUNUTFZWVEA-UHFFFAOYSA-N 2 0 331.504 2.550 20 10 EFCDRP CCOc1cccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1O ZINC000371415280 477305349 /nfs/dbraw/zinc/30/53/49/477305349.db2.gz BJPIEMJMXAQNOX-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(C)cc(OC)c2O)C1 ZINC000754735841 575480393 /nfs/dbraw/zinc/48/03/93/575480393.db2.gz DLTKWVLVQYGKLX-QGZVFWFLSA-N 2 0 336.476 2.642 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2c1c(F)ccc2O ZINC000756533527 575756066 /nfs/dbraw/zinc/75/60/66/575756066.db2.gz IOLMWLIGAJZRRC-PBHICJAKSA-N 2 0 349.494 2.943 20 10 EFCDRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)CN1CC[NH+](C)CC1 ZINC000756534144 575756670 /nfs/dbraw/zinc/75/66/70/575756670.db2.gz KUGHIKLINLCSOJ-IIAWOOMASA-N 2 0 335.467 2.553 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c2c1c(F)ccc2O ZINC000756578917 575764917 /nfs/dbraw/zinc/76/49/17/575764917.db2.gz XQJOJYJJEPXOOE-KEYYUXOJSA-N 2 0 347.478 2.838 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)CCO[C@H]3C3CC3)cc2)CC1 ZINC000767194201 577199499 /nfs/dbraw/zinc/19/94/99/577199499.db2.gz ASTYSYROZNTKCU-LEWJYISDSA-N 2 0 343.515 2.733 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(OC)c(C)cc2O)C1 ZINC000768465797 577276311 /nfs/dbraw/zinc/27/63/11/577276311.db2.gz LQSFVLMDBLGKON-QGZVFWFLSA-N 2 0 336.476 2.642 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000770006610 577397526 /nfs/dbraw/zinc/39/75/26/577397526.db2.gz YZQRXHCPLROPPV-FMKPAKJESA-N 2 0 335.467 2.695 20 10 EFCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCOCC1 ZINC000771840863 581249238 /nfs/dbraw/zinc/24/92/38/581249238.db2.gz AHIBYXOXPAEAIA-HXUWFJFHSA-N 2 0 331.504 2.733 20 10 EFCDRP C[C@@H](CC(=O)OC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771842385 581249596 /nfs/dbraw/zinc/24/95/96/581249596.db2.gz GRDYBCBQFJFYGF-INIZCTEOSA-N 2 0 347.503 2.648 20 10 EFCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000773823596 581466325 /nfs/dbraw/zinc/46/63/25/581466325.db2.gz UWLMHUKZQQIGCL-RXVVDRJESA-N 2 0 344.547 2.601 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)ccc1N(C)C ZINC000923386486 1261595050 /nfs/dbraw/zinc/59/50/50/1261595050.db2.gz BYTMMVSBJULZBG-NLWGTHIKSA-N 2 0 331.504 2.779 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000186582434 1266786385 /nfs/dbraw/zinc/78/63/85/1266786385.db2.gz SOZAPVSEXPVEMC-IAGOWNOFSA-N 2 0 345.531 2.948 20 10 EFCDRP COCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000825244978 1278483628 /nfs/dbraw/zinc/48/36/28/1278483628.db2.gz CFNUAXUIBBVPLA-UHFFFAOYSA-N 2 0 331.504 2.735 20 10 EFCDRP Cc1cc(O)c(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cc1Cl ZINC000825440125 1278548934 /nfs/dbraw/zinc/54/89/34/1278548934.db2.gz BWBWOMHQVCSMFN-UHFFFAOYSA-N 2 0 349.862 2.979 20 10 EFCDRP C[C@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000702603456 1271556223 /nfs/dbraw/zinc/55/62/23/1271556223.db2.gz NDVGXCUEBIAPDZ-OXJNMPFZSA-N 2 0 326.440 2.680 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169139675 1272700547 /nfs/dbraw/zinc/70/05/47/1272700547.db2.gz DCSAXZIPKOZOJK-ACDBMABISA-N 2 0 329.488 2.580 20 10 EFCDRP CC[NH+]1CCC(C[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000706871951 1275066084 /nfs/dbraw/zinc/06/60/84/1275066084.db2.gz RSUDGBZVQHXGML-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP CC(C)[NH+]1CCN(Cc2ccc(N(C)C(C)(C)C[NH3+])c(F)c2)CC1 ZINC001170060904 1275457549 /nfs/dbraw/zinc/45/75/49/1275457549.db2.gz WTMUEBBZZOKABX-UHFFFAOYSA-N 2 0 336.499 2.525 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@@H]3C)cc2F)C[C@@H](C)O1 ZINC000817888836 1276347546 /nfs/dbraw/zinc/34/75/46/1276347546.db2.gz PTPNBDLGIBWUTN-WFXMFSGNSA-N 2 0 349.494 2.917 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000817890507 1276347940 /nfs/dbraw/zinc/34/79/40/1276347940.db2.gz YZHVCZPXTJJAGZ-XUVXKRRUSA-N 2 0 331.504 2.780 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3C[NH3+])cc2F)C[C@@H](C)O1 ZINC000817890435 1276348212 /nfs/dbraw/zinc/34/82/12/1276348212.db2.gz XPGMJPLSVXLNBM-AHEZYBDSSA-N 2 0 335.467 2.656 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000817890505 1276348221 /nfs/dbraw/zinc/34/82/21/1276348221.db2.gz YZHVCZPXTJJAGZ-SLFFLAALSA-N 2 0 331.504 2.780 20 10 EFCDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817965458 1276409971 /nfs/dbraw/zinc/40/99/71/1276409971.db2.gz VFVIQRRBVRSLQR-OAHLLOKOSA-N 2 0 335.467 2.703 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000817894739 1276362835 /nfs/dbraw/zinc/36/28/35/1276362835.db2.gz NQWDIAQCYJSQEY-QHAWAJNXSA-N 2 0 343.515 2.924 20 10 EFCDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893104 1276363335 /nfs/dbraw/zinc/36/33/35/1276363335.db2.gz DRBPIJRAJIBCHD-AZUAARDMSA-N 2 0 331.504 2.502 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C3CCC(C[NH3+])CC3)cc2F)CC1 ZINC000817902416 1276367288 /nfs/dbraw/zinc/36/72/88/1276367288.db2.gz QFQDPCHCWZHIGP-UHFFFAOYSA-N 3 0 348.510 2.575 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)CCCC[NH3+])cc2F)CC1 ZINC000817902564 1276367358 /nfs/dbraw/zinc/36/73/58/1276367358.db2.gz UIULWYNILYSCHC-MRXNPFEDSA-N 3 0 336.499 2.575 20 10 EFCDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903882 1276367543 /nfs/dbraw/zinc/36/75/43/1276367543.db2.gz WNNFNAVLDFAWJK-DYVFJYSZSA-N 2 0 339.430 2.974 20 10 EFCDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903204 1276367675 /nfs/dbraw/zinc/36/76/75/1276367675.db2.gz KFCRUMRCQFRBKQ-CHWSQXEVSA-N 2 0 327.419 2.972 20 10 EFCDRP COc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000817940325 1276385274 /nfs/dbraw/zinc/38/52/74/1276385274.db2.gz GBBQOKSYEXIJOD-CXAGYDPISA-N 2 0 329.444 2.817 20 10 EFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000817942752 1276387923 /nfs/dbraw/zinc/38/79/23/1276387923.db2.gz QVLHLRIVLZOQDM-MTQWCTHYSA-N 2 0 330.520 2.653 20 10 EFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000817942758 1276387974 /nfs/dbraw/zinc/38/79/74/1276387974.db2.gz QVLHLRIVLZOQDM-UAFMIMERSA-N 2 0 330.520 2.653 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC[NH2+]C1 ZINC000817947760 1276390375 /nfs/dbraw/zinc/39/03/75/1276390375.db2.gz QJUZCNWYSPGXCK-ZMSDIMECSA-N 2 0 335.467 2.701 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(N2CCOCC2)cc1Cl ZINC000817978023 1276416911 /nfs/dbraw/zinc/41/69/11/1276416911.db2.gz UCENUZGCLMCJAE-UONOGXRCSA-N 2 0 325.884 2.955 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000817976631 1276417333 /nfs/dbraw/zinc/41/73/33/1276417333.db2.gz PWOQKPHMLFRWQM-QMTHXVAHSA-N 2 0 325.250 2.947 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1cc(Br)ccc1O ZINC000817981958 1276419721 /nfs/dbraw/zinc/41/97/21/1276419721.db2.gz OVRBXLMTFWMMKW-TZMCWYRMSA-N 2 0 343.265 2.574 20 10 EFCDRP CCC[NH+]1CCC([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC000818345781 1276512983 /nfs/dbraw/zinc/51/29/83/1276512983.db2.gz XWRSFFFRJMNXTM-KRWDZBQOSA-N 2 0 331.504 2.986 20 10 EFCDRP C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790934312 1277853496 /nfs/dbraw/zinc/85/34/96/1277853496.db2.gz KHKARUHHZGHOSL-PXNSSMCTSA-N 2 0 331.504 2.564 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](CO)C3CCCCC3)cc2)CC1 ZINC000815150485 1287328903 /nfs/dbraw/zinc/32/89/03/1287328903.db2.gz GAAUXWCNNPWJQL-FQEVSTJZSA-N 2 0 345.531 2.717 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCCC[NH+]3CCCC3)cc2)CC1 ZINC000815151408 1287331188 /nfs/dbraw/zinc/33/11/88/1287331188.db2.gz NXBXMTKQPGMIEZ-UHFFFAOYSA-N 3 0 344.547 2.794 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1O ZINC000844902466 1279325829 /nfs/dbraw/zinc/32/58/29/1279325829.db2.gz NCZLMNPZUXLALN-ZVZYQTTQSA-N 2 0 334.460 2.509 20 10 EFCDRP CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000846027757 1279986947 /nfs/dbraw/zinc/98/69/47/1279986947.db2.gz QAPRDPQDWHHUSV-GOSISDBHSA-N 2 0 331.504 2.828 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1O ZINC000846156673 1280040570 /nfs/dbraw/zinc/04/05/70/1280040570.db2.gz GWVNCKZXSFXNTI-AWEZNQCLSA-N 2 0 345.443 2.587 20 10 EFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1c(O)cccc1Cl ZINC000809738574 1282437349 /nfs/dbraw/zinc/43/73/49/1282437349.db2.gz ZLCADLINNLQIPZ-OAHLLOKOSA-N 2 0 339.911 2.894 20 10 EFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000809750174 1282450666 /nfs/dbraw/zinc/45/06/66/1282450666.db2.gz PSDYYOMXLQKWSA-UHFFFAOYSA-N 2 0 331.504 2.831 20 10 EFCDRP CCC[N@H+](CC)C[C@@H](C)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000810179693 1283007138 /nfs/dbraw/zinc/00/71/38/1283007138.db2.gz DVYNFLUJVLQEIP-GOSISDBHSA-N 2 0 332.536 2.648 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC001172107949 1286022278 /nfs/dbraw/zinc/02/22/78/1286022278.db2.gz MGARBNNKXZKRDM-NUZGMZIFSA-N 3 0 342.531 2.543 20 10 EFCDRP COCCC[NH+]1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001172244611 1286077555 /nfs/dbraw/zinc/07/75/55/1286077555.db2.gz VTWNNFMJGVQIBS-UHFFFAOYSA-N 2 0 331.504 2.877 20 10 EFCDRP CCOC1(C)CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000814169909 1286372792 /nfs/dbraw/zinc/37/27/92/1286372792.db2.gz OHGDMMADDONJRZ-UHFFFAOYSA-N 2 0 331.504 2.829 20 10 EFCDRP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3ccc4ccccc4c3O)CC2)C1 ZINC000816507186 1288177169 /nfs/dbraw/zinc/17/71/69/1288177169.db2.gz YPHYBEOUVOJSCZ-LJQANCHMSA-N 2 0 339.483 2.757 20 10 EFCDRP C[N@H+](CCCO)C1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816512038 1288180762 /nfs/dbraw/zinc/18/07/62/1288180762.db2.gz VLXMKXGIGBYKBW-UHFFFAOYSA-N 2 0 328.456 2.824 20 10 EFCDRP C[N@@H+]1CCN(CC[NH2+]Cc2ccc3ccccc3c2O)CC1(C)C ZINC000816599620 1288221121 /nfs/dbraw/zinc/22/11/21/1288221121.db2.gz STQKIXXVSYDWRE-UHFFFAOYSA-N 2 0 327.472 2.661 20 10 EFCDRP C[N@@H+]1CCC[C@@]2(CCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)C1 ZINC000816641671 1288227257 /nfs/dbraw/zinc/22/72/57/1288227257.db2.gz BMXOUGGJSLMIOL-HXUWFJFHSA-N 2 0 347.478 2.580 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3ccc(N(C)C)cc3)CC2)CC1 ZINC000817285764 1288503971 /nfs/dbraw/zinc/50/39/71/1288503971.db2.gz NQVVESOOURGILO-UHFFFAOYSA-N 2 0 344.547 2.745 20 10 EFCDRP COc1ccc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1Cn1cccn1 ZINC000873013716 1289519015 /nfs/dbraw/zinc/51/90/15/1289519015.db2.gz GJBDVLFXHSYYCP-RBUKOAKNSA-N 2 0 340.471 2.656 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC3(CO2)CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000873291970 1289705529 /nfs/dbraw/zinc/70/55/29/1289705529.db2.gz JNDASXUSVRBJMS-IPYPFGDCSA-N 2 0 334.435 2.828 20 10 EFCDRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877073489 1291125560 /nfs/dbraw/zinc/12/55/60/1291125560.db2.gz LMFVSTBDJYQZAY-MJGOQNOKSA-N 2 0 331.504 2.610 20 10 EFCDRP COc1cc(O)c(C[N@H+](C)C2CCN(C)CC2)cc1Br ZINC001233134765 1312861927 /nfs/dbraw/zinc/86/19/27/1312861927.db2.gz DBDKFKOGBBUGLF-UHFFFAOYSA-N 2 0 343.265 2.689 20 10 EFCDRP CCC[NH+](CCC)CCN1CC[NH+](Cc2cc(OC)ccc2O)CC1 ZINC001203680220 1312988998 /nfs/dbraw/zinc/98/89/98/1312988998.db2.gz MAVKGUXSNVOKTL-UHFFFAOYSA-N 2 0 349.519 2.640 20 10 EFCDRP CC[NH+]1C[C@@H]2CN(Cc3cccc(OC(F)(F)F)c3O)C[C@H]2C1 ZINC001233775729 1312989960 /nfs/dbraw/zinc/98/99/60/1312989960.db2.gz BIWUXTWCTWYMJP-CHWSQXEVSA-N 2 0 330.350 2.674 20 10 EFCDRP [O-]c1c(F)cc(F)cc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000883085697 1293456102 /nfs/dbraw/zinc/45/61/02/1293456102.db2.gz XEEDTSZXSMQFKA-QGZVFWFLSA-N 2 0 348.393 2.527 20 10 EFCDRP CC[NH+](CC)CCCN1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001203934352 1313051106 /nfs/dbraw/zinc/05/11/06/1313051106.db2.gz RRMPPLXPFBOZNP-UHFFFAOYSA-N 2 0 332.536 2.602 20 10 EFCDRP CCC[NH+](CCC)CCCN1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204278213 1313115223 /nfs/dbraw/zinc/11/52/23/1313115223.db2.gz YJFFKNJTLAYGLI-UHFFFAOYSA-N 2 0 349.519 2.728 20 10 EFCDRP CC[NH+]1CCN(c2ccc(OC3CC[NH+](C4CC4)CC3)cc2)CC1 ZINC001234658071 1313179450 /nfs/dbraw/zinc/17/94/50/1313179450.db2.gz SKKUZSDRRLTNQJ-UHFFFAOYSA-N 2 0 329.488 2.834 20 10 EFCDRP OCC1CCN(c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000305300260 1296077929 /nfs/dbraw/zinc/07/79/29/1296077929.db2.gz HKRVFBYVUVYWTR-PZJWPPBQSA-N 2 0 343.515 2.612 20 10 EFCDRP OCC1CCN(c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)CC1 ZINC000305300259 1296078579 /nfs/dbraw/zinc/07/85/79/1296078579.db2.gz HKRVFBYVUVYWTR-FPOVZHCZSA-N 2 0 343.515 2.612 20 10 EFCDRP CCCCN(CCCC)c1ccc(CN2C[C@H](O)C[C@H]([NH3+])C2)c(O)c1 ZINC001204954671 1313214824 /nfs/dbraw/zinc/21/48/24/1313214824.db2.gz HUMBNLSZWOLNOI-PKOBYXMFSA-N 2 0 349.519 2.693 20 10 EFCDRP Oc1c(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001234994776 1313219221 /nfs/dbraw/zinc/21/92/21/1313219221.db2.gz VZQSIQDLECADJC-OAQYLSRUSA-N 2 0 341.499 2.667 20 10 EFCDRP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cccc(-c2ccccc2)c1O ZINC001234997218 1313219288 /nfs/dbraw/zinc/21/92/88/1313219288.db2.gz VRQFIBGNCRYIOV-UHFFFAOYSA-N 2 0 339.483 2.738 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)Cc2ccccc21 ZINC001205164835 1313244245 /nfs/dbraw/zinc/24/42/45/1313244245.db2.gz SGHUEYUTYHMVOK-MRXNPFEDSA-N 2 0 337.467 2.921 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@](O)(C[NH3+])CC2)c2ccccc21 ZINC001205209694 1313251658 /nfs/dbraw/zinc/25/16/58/1313251658.db2.gz JZHPSDBWSKDGCB-FQEVSTJZSA-N 2 0 327.472 2.582 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@](O)(C[NH3+])CC2)cc1 ZINC001205220875 1313253370 /nfs/dbraw/zinc/25/33/70/1313253370.db2.gz MWCPWMUOVLVUJW-HXUWFJFHSA-N 2 0 327.472 2.770 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@@]34CCC[NH2+]C4)cc2)CC1 ZINC001235167308 1313256462 /nfs/dbraw/zinc/25/64/62/1313256462.db2.gz HTBSZUBVSBNWEK-NRFANRHFSA-N 3 0 342.531 2.547 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)([NH3+])CC3)cc2)CC1 ZINC001205273181 1313263063 /nfs/dbraw/zinc/26/30/63/1313263063.db2.gz HBLDHXMFNXXZLF-HXUWFJFHSA-N 3 0 330.520 2.532 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c2ccccc2n1C ZINC001205280880 1313263793 /nfs/dbraw/zinc/26/37/93/1313263793.db2.gz KWIAJVYKHGDYQT-LJQANCHMSA-N 2 0 329.444 2.668 20 10 EFCDRP Cc1cc(Br)cc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c1O ZINC001235340642 1313295916 /nfs/dbraw/zinc/29/59/16/1313295916.db2.gz TWVDDLVJWIGVEV-UHFFFAOYSA-N 2 0 339.277 2.895 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)ccc21 ZINC001235424352 1313318225 /nfs/dbraw/zinc/31/82/25/1313318225.db2.gz HBSLPTUWVQGGAF-ZWKOTPCHSA-N 2 0 329.488 2.727 20 10 EFCDRP CCOC[C@@]12CCC[C@@H]1C[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001235492499 1313336475 /nfs/dbraw/zinc/33/64/75/1313336475.db2.gz AXQVTMFXOBYDHH-CTNGQTDRSA-N 2 0 343.515 2.735 20 10 EFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(O)c1 ZINC001205767894 1313352546 /nfs/dbraw/zinc/35/25/46/1313352546.db2.gz CABVZTMVSDVMGP-AWEZNQCLSA-N 2 0 327.419 2.654 20 10 EFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cc(Br)ccc1O ZINC001235714390 1313382956 /nfs/dbraw/zinc/38/29/56/1313382956.db2.gz KPOQVVZAKAINTA-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP CCCCN(CCCC)c1ccc(CN(CC[NH3+])CC[NH3+])c(O)c1 ZINC001235879759 1313413654 /nfs/dbraw/zinc/41/36/54/1313413654.db2.gz FCTBGVJNALDQNG-UHFFFAOYSA-N 2 0 336.524 2.518 20 10 EFCDRP CCc1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2O)cc1 ZINC001235960592 1313423195 /nfs/dbraw/zinc/42/31/95/1313423195.db2.gz UQRIZRTVEHMAFX-UHFFFAOYSA-N 2 0 339.483 2.996 20 10 EFCDRP CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001235963470 1313423489 /nfs/dbraw/zinc/42/34/89/1313423489.db2.gz URGWLTFSSLVAMM-UHFFFAOYSA-N 2 0 343.446 2.963 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c2ccccc2n1C ZINC001206317219 1313435324 /nfs/dbraw/zinc/43/53/24/1313435324.db2.gz DBMCSFYFYDFIQR-HXUWFJFHSA-N 2 0 343.471 2.916 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(C[NH3+])CC3)c(F)c2)CC1 ZINC001206327308 1313436869 /nfs/dbraw/zinc/43/68/69/1313436869.db2.gz VDNOKKLFXOSPTH-HXUWFJFHSA-N 3 0 348.510 2.528 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(C[NH3+])CC3)c(F)c2)CC1 ZINC001206327307 1313437298 /nfs/dbraw/zinc/43/72/98/1313437298.db2.gz VDNOKKLFXOSPTH-FQEVSTJZSA-N 3 0 348.510 2.528 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C)[C@@H]3CCCC[C@H]3[NH3+])cc2)CC1 ZINC001236214340 1313456779 /nfs/dbraw/zinc/45/67/79/1313456779.db2.gz DHDRWSIWOQOAHW-WOJBJXKFSA-N 2 0 330.520 2.530 20 10 EFCDRP Oc1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001236314721 1313467583 /nfs/dbraw/zinc/46/75/83/1313467583.db2.gz FXIWDWAHKQPPIU-CALCHBBNSA-N 2 0 341.499 2.522 20 10 EFCDRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C1 ZINC001206615526 1313484611 /nfs/dbraw/zinc/48/46/11/1313484611.db2.gz HIFQCCGDANORLU-HNNXBMFYSA-N 2 0 329.488 2.652 20 10 EFCDRP CCC[N@@H+](Cc1c2ccccc2n(C)c1C(=O)OC)C[C@@H]1CC[NH2+]C1 ZINC001236844669 1313541262 /nfs/dbraw/zinc/54/12/62/1313541262.db2.gz XOUODTNJAQKJLP-OAHLLOKOSA-N 2 0 343.471 2.786 20 10 EFCDRP COC[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236931260 1313556260 /nfs/dbraw/zinc/55/62/60/1313556260.db2.gz IFNYFYDYOXRPJJ-SFHVURJKSA-N 2 0 335.467 2.578 20 10 EFCDRP CCOC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236937948 1313557187 /nfs/dbraw/zinc/55/71/87/1313557187.db2.gz HKGLVLTUUIKDJZ-UHFFFAOYSA-N 2 0 335.467 2.578 20 10 EFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1O ZINC000852754624 1299863845 /nfs/dbraw/zinc/86/38/45/1299863845.db2.gz YIZAYOQXBVJUQC-HNNXBMFYSA-N 2 0 334.435 2.946 20 10 EFCDRP CC(=O)c1cc(F)cc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1O ZINC000852753553 1299864979 /nfs/dbraw/zinc/86/49/79/1299864979.db2.gz DPPSQVVOKOOGKN-OAHLLOKOSA-N 2 0 334.435 2.946 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000854230189 1300479206 /nfs/dbraw/zinc/47/92/06/1300479206.db2.gz JHRLSCBCHAPMEF-PWRODBHTSA-N 2 0 343.515 2.658 20 10 EFCDRP Cc1cc(F)cc(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1O ZINC001238060779 1313753320 /nfs/dbraw/zinc/75/33/20/1313753320.db2.gz JBOGYUUYBJTKNK-CALCHBBNSA-N 2 0 341.430 2.799 20 10 EFCDRP CC[N@H+]([C@H]1CCOC1)C1CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238065933 1313754562 /nfs/dbraw/zinc/75/45/62/1313754562.db2.gz CKIVOJJVAAUOBM-SFHVURJKSA-N 2 0 336.451 2.915 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645890 1302667975 /nfs/dbraw/zinc/66/79/75/1302667975.db2.gz DQKGBCIBOOSDBZ-OLZOCXBDSA-N 2 0 332.366 2.750 20 10 EFCDRP CC[NH+]1CCC(C[NH+]2CCN(c3ccc(OC)cc3OC)CC2)CC1 ZINC001208602384 1313973632 /nfs/dbraw/zinc/97/36/32/1313973632.db2.gz FCQDQBDZAKBWPD-UHFFFAOYSA-N 2 0 347.503 2.558 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc2c3c1CCCN3CCC2 ZINC001222149506 1311091865 /nfs/dbraw/zinc/09/18/65/1311091865.db2.gz ZPLHKBKKAMDPDD-NRFANRHFSA-N 2 0 341.499 2.667 20 10 EFCDRP Cc1cc(Br)cc(C[NH+]2CCC(F)(C[NH3+])CC2)c1O ZINC001222548571 1311151007 /nfs/dbraw/zinc/15/10/07/1311151007.db2.gz RYUUPVUKDWPKRA-UHFFFAOYSA-N 2 0 331.229 2.726 20 10 EFCDRP C[NH+]1CCC(Oc2cc[nH+]c(NCc3ccc(O)c(O)c3)c2)CC1 ZINC001159004773 1311432139 /nfs/dbraw/zinc/43/21/39/1311432139.db2.gz JZBSBYFENPQKNZ-UHFFFAOYSA-N 2 0 329.400 2.578 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903076865 1312330542 /nfs/dbraw/zinc/33/05/42/1312330542.db2.gz VGNWMVQZUGGOIH-PRJVBOEPSA-N 2 0 341.499 2.771 20 10 EFCDRP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)[C@@H]([NH3+])Cc1ccccc1 ZINC001246049797 1314574677 /nfs/dbraw/zinc/57/46/77/1314574677.db2.gz BWILNDHIEFEZTL-LEWJYISDSA-N 2 0 341.499 2.505 20 10 EFCDRP Fc1cc2c(cc1F)CC([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246173368 1314593562 /nfs/dbraw/zinc/59/35/62/1314593562.db2.gz LVHXSRADLYJWBN-UHFFFAOYSA-N 2 0 343.421 2.631 20 10 EFCDRP Fc1cccc2c1C[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001246176323 1314593982 /nfs/dbraw/zinc/59/39/82/1314593982.db2.gz WLTPBIWDDQEIPI-SFHVURJKSA-N 2 0 339.458 2.882 20 10 EFCDRP C[C@@H]1CC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C[NH2+]1 ZINC001246339620 1314612812 /nfs/dbraw/zinc/61/28/12/1314612812.db2.gz GJRDXSMHOABYBI-RYMBOPBQSA-N 2 0 341.455 2.569 20 10 EFCDRP C[NH2+]CC[C@@H](C)N1CCN(c2ccc(OC(F)(F)F)cc2)CC1 ZINC001246993650 1314726178 /nfs/dbraw/zinc/72/61/78/1314726178.db2.gz IFPDEIQAJWRVOH-CYBMUJFWSA-N 2 0 331.382 2.705 20 10 EFCDRP CC[NH+]1CCN(c2ccc(OC3CCC4(C[NH2+]C4)CC3)cc2)CC1 ZINC001218263609 1315171868 /nfs/dbraw/zinc/17/18/68/1315171868.db2.gz IFPZDIMXLUAPEX-UHFFFAOYSA-N 2 0 329.488 2.740 20 10 EFCDRP CC[NH+](CC)C[C@H](O)CNc1ccccc1OCC1CC[NH+](C)CC1 ZINC001253200343 1315579901 /nfs/dbraw/zinc/57/99/01/1315579901.db2.gz BTRJKMKOXPXMQK-GOSISDBHSA-N 2 0 349.519 2.522 20 10 EFCDRP CC[NH+](CC)C[C@H](O)C[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001253216583 1315582224 /nfs/dbraw/zinc/58/22/24/1315582224.db2.gz OCFUZMFTUQWPGL-DNVCBOLYSA-N 2 0 334.504 2.925 20 10 EFCDRP C[N@@H+]1CCC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C1 ZINC001255475039 1315828286 /nfs/dbraw/zinc/82/82/86/1315828286.db2.gz KCNFXMWTKVYSQU-JSNMRZPZSA-N 2 0 341.455 2.523 20 10 EFCDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC001324543374 1329637825 /nfs/dbraw/zinc/63/78/25/1329637825.db2.gz SKMRANNBXYDJJW-GOSISDBHSA-N 2 0 337.467 2.921 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001325338990 1329681108 /nfs/dbraw/zinc/68/11/08/1329681108.db2.gz FTHTXUNJNNYSPB-SJORKVTESA-N 2 0 331.504 2.866 20 10 EFCDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(Br)cc2O)C1 ZINC001328759245 1330627411 /nfs/dbraw/zinc/62/74/11/1330627411.db2.gz OEGDKDORRKFFTE-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP CN1CCN(c2ccc(CN3CCOC[C@@H]3C3CCC3)cc2F)CC1 ZINC001329514625 1330713985 /nfs/dbraw/zinc/71/39/85/1330713985.db2.gz YOPRIDRWYUWECG-HXUWFJFHSA-N 2 0 347.478 2.578 20 10 EFCDRP C[N@H+](CCN1CC[NH+](Cc2ccc(N)cc2)CC1)Cc1ccccc1 ZINC001336284898 1331455009 /nfs/dbraw/zinc/45/50/09/1331455009.db2.gz DNFZWYXYQPPTHO-UHFFFAOYSA-N 2 0 338.499 2.518 20 10 EFCDRP C[C@@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1ccccc1O ZINC001342179943 1332314022 /nfs/dbraw/zinc/31/40/22/1332314022.db2.gz LIYHVGIWXGMWRY-QGZVFWFLSA-N 2 0 339.483 2.990 20 10 EFCDRP C[C@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1ccccc1O ZINC001342179941 1332314211 /nfs/dbraw/zinc/31/42/11/1332314211.db2.gz LIYHVGIWXGMWRY-KRWDZBQOSA-N 2 0 339.483 2.990 20 10 EFCDRP Fc1cc(C[NH2+][C@@H]2CCCN3CCCC[C@@H]23)ccc1N1CCOCC1 ZINC000848575656 1334803366 /nfs/dbraw/zinc/80/33/66/1334803366.db2.gz URHNGCNDMAYWOF-QUCCMNQESA-N 2 0 347.478 2.769 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCN4CCCC[C@H]34)cc2)CC1 ZINC000848575715 1334803696 /nfs/dbraw/zinc/80/36/96/1334803696.db2.gz VYORRYHEQAVDGT-NHCUHLMSSA-N 3 0 342.531 2.545 20 10 EFCDRP CCc1cccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000848902588 1334973146 /nfs/dbraw/zinc/97/31/46/1334973146.db2.gz QDQHOIQEMZKSNY-UHFFFAOYSA-N 2 0 345.531 2.804 20 10 EFCDRP CCc1cccc(C[N@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000848910925 1334979973 /nfs/dbraw/zinc/97/99/73/1334979973.db2.gz OIUVWONPDPJOBK-LJQANCHMSA-N 2 0 331.504 2.555 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c(O)c1OC ZINC000892237472 715400545 /nfs/dbraw/zinc/40/05/45/715400545.db2.gz ZQLSSKNMMMUEEF-YOEHRIQHSA-N 2 0 346.471 2.858 20 10 EFCDRP COc1ccc(C[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c(O)c1OC ZINC000892591759 718318399 /nfs/dbraw/zinc/31/83/99/718318399.db2.gz JIUYZJDSTFDWTC-GJZGRUSLSA-N 2 0 336.476 2.867 20 10 EFCDRP c1cc(N2CCSCC2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166213919 718604395 /nfs/dbraw/zinc/60/43/95/718604395.db2.gz IGVRKYDCUPIOFP-PKOBYXMFSA-N 2 0 331.529 2.956 20 10 EFCDRP c1cc(N2CCSCC2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166213791 718604689 /nfs/dbraw/zinc/60/46/89/718604689.db2.gz IGVRKYDCUPIOFP-IEBWSBKVSA-N 2 0 331.529 2.956 20 10 EFCDRP C[N@@H+](Cc1cc(Br)ccc1O)C[C@H]1CCC[NH+](C)C1 ZINC000092253335 719435942 /nfs/dbraw/zinc/43/59/42/719435942.db2.gz SMHNNRYUFCTKGK-LBPRGKRZSA-N 2 0 327.266 2.928 20 10 EFCDRP C[N@@H+]1CCCN(CCC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000894377029 722651582 /nfs/dbraw/zinc/65/15/82/722651582.db2.gz XVXCWBSVTJHZFF-UHFFFAOYSA-N 2 0 327.472 2.663 20 10 EFCDRP COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c(O)c1OC ZINC000895508079 724163739 /nfs/dbraw/zinc/16/37/39/724163739.db2.gz DXDVRVLZLVFTIK-GDBMZVCRSA-N 2 0 336.476 2.962 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)C1CC[NH+](C)CC1 ZINC000151593189 725786002 /nfs/dbraw/zinc/78/60/02/725786002.db2.gz CLJSKVQWBXGDSM-QGZVFWFLSA-N 2 0 345.531 2.715 20 10 EFCDRP C[C@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1ccccc1O ZINC000183385671 728063700 /nfs/dbraw/zinc/06/37/00/728063700.db2.gz YOIRYAJUCRWUDC-SFHVURJKSA-N 2 0 339.483 2.861 20 10 EFCDRP C[C@@H]([NH2+]CCN1CC[NH+](Cc2ccccc2)CC1)c1ccccc1O ZINC000183385692 728064043 /nfs/dbraw/zinc/06/40/43/728064043.db2.gz YOIRYAJUCRWUDC-GOSISDBHSA-N 2 0 339.483 2.861 20 10 EFCDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000158257073 728326451 /nfs/dbraw/zinc/32/64/51/728326451.db2.gz JCZMEXBCGTYKEH-JKSUJKDBSA-N 2 0 335.467 2.655 20 10 EFCDRP [NH3+]C[C@@H]1CCCC12CC[NH+](Cc1ccc(N3CCOCC3)cc1)CC2 ZINC001580260780 1090838870 /nfs/dbraw/zinc/83/88/70/1090838870.db2.gz RPWUAERUYZQZDV-IBGZPJMESA-N 2 0 343.515 2.864 20 10 EFCDRP C[NH+]1CCN(c2ccc(CNc3cccc4c3CC[C@H]4[NH3+])cc2)CC1 ZINC001167436950 1101715421 /nfs/dbraw/zinc/71/54/21/1101715421.db2.gz IHQAYFTYAGEBPL-HXUWFJFHSA-N 2 0 336.483 2.997 20 10 EFCDRP Cc1cccc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000905428470 1103188455 /nfs/dbraw/zinc/18/84/55/1103188455.db2.gz UKOXTUGAZOBHIR-OAQYLSRUSA-N 2 0 339.483 2.570 20 10 EFCDRP COC(=O)C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000897888440 1106132033 /nfs/dbraw/zinc/13/20/33/1106132033.db2.gz BBTDDISPINOHKL-SFHVURJKSA-N 2 0 347.503 2.506 20 10 EFCDRP CN(C)c1ccc([C@H](CNC2CC[NH+](C3CC3)CC2)[NH+](C)C)cc1 ZINC000898449332 1108942689 /nfs/dbraw/zinc/94/26/89/1108942689.db2.gz BPZDEFPOUOKITK-FQEVSTJZSA-N 2 0 330.520 2.572 20 10 EFCDRP CC[N@@H+]1CC[C@H](NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)[C@H](C)C1 ZINC000898450567 1108943805 /nfs/dbraw/zinc/94/38/05/1108943805.db2.gz RYWNBHHMYGVWML-UXPWSPDFSA-N 2 0 332.536 2.675 20 10 EFCDRP C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000166322787 239124072 /nfs/dbraw/zinc/12/40/72/239124072.db2.gz GSEDHSWSLQVDNA-HLLBOEOZSA-N 2 0 347.478 2.938 20 10 EFCDRP C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000166322675 239124821 /nfs/dbraw/zinc/12/48/21/239124821.db2.gz GSEDHSWSLQVDNA-ZOBUZTSGSA-N 2 0 347.478 2.938 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCC=CO3)cc2F)CC1 ZINC000194399458 240152144 /nfs/dbraw/zinc/15/21/44/240152144.db2.gz VVKVDDSUNWVMQQ-KRWDZBQOSA-N 2 0 333.451 2.750 20 10 EFCDRP Oc1cccc(Cl)c1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000295522312 241055790 /nfs/dbraw/zinc/05/57/90/241055790.db2.gz VVZVTUAUBBJODZ-MRXNPFEDSA-N 2 0 346.858 2.902 20 10 EFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423081379 301018339 /nfs/dbraw/zinc/01/83/39/301018339.db2.gz BMQHYYCRSVKDPP-RCCFBDPRSA-N 2 0 327.472 2.733 20 10 EFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c1 ZINC000185041948 473310197 /nfs/dbraw/zinc/31/01/97/473310197.db2.gz PUENMRTYVWJOEV-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(CC[NH+](C)C)CC2)cc1 ZINC000150956680 473386940 /nfs/dbraw/zinc/38/69/40/473386940.db2.gz DIYHRYSUPVJTGK-QGZVFWFLSA-N 2 0 332.536 2.819 20 10 EFCDRP CC[C@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(N(C)C)cc1 ZINC000154274257 472410230 /nfs/dbraw/zinc/41/02/30/472410230.db2.gz DZXYSCFQMJFJEV-FQEVSTJZSA-N 2 0 332.536 2.821 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)N1CC[NH+](C)CC1 ZINC000132371397 472729729 /nfs/dbraw/zinc/72/97/29/472729729.db2.gz JYEZUULOSHHJKG-YLJYHZDGSA-N 2 0 332.536 2.675 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000120929180 472769612 /nfs/dbraw/zinc/76/96/12/472769612.db2.gz SUYINZUWFRNHRP-XLIONFOSSA-N 2 0 332.536 2.677 20 10 EFCDRP C[N@H+](CCC[NH+]1CCCCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000160430199 473123062 /nfs/dbraw/zinc/12/30/62/473123062.db2.gz XQZMFCORPVRGLO-UHFFFAOYSA-N 2 0 331.504 2.831 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185344247 473399402 /nfs/dbraw/zinc/39/94/02/473399402.db2.gz DJXJXAFNGUUZPE-DLBZAZTESA-N 2 0 345.531 2.805 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c1 ZINC000185491824 473441857 /nfs/dbraw/zinc/44/18/57/473441857.db2.gz WKWDLRJFTDYQGI-GJZGRUSLSA-N 2 0 334.460 2.552 20 10 EFCDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000178412478 473509016 /nfs/dbraw/zinc/50/90/16/473509016.db2.gz INMKBVKEXHMFOR-INIZCTEOSA-N 2 0 335.467 2.799 20 10 EFCDRP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1O ZINC000186127734 473596298 /nfs/dbraw/zinc/59/62/98/473596298.db2.gz CFPSLZNNVZSFOR-FMEYXAORSA-N 2 0 336.451 2.950 20 10 EFCDRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000282311514 474019428 /nfs/dbraw/zinc/01/94/28/474019428.db2.gz NBEZJRDADZJUGC-MRXNPFEDSA-N 2 0 345.531 2.948 20 10 EFCDRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccccc1O ZINC000183486157 474384960 /nfs/dbraw/zinc/38/49/60/474384960.db2.gz ASFYKAUHSHXIBC-OAHLLOKOSA-N 2 0 341.455 2.534 20 10 EFCDRP CCCOc1ccc(C[N@H+](C)CCN(C)C2CC[NH+](C)CC2)c(O)c1 ZINC000289870959 474463373 /nfs/dbraw/zinc/46/33/73/474463373.db2.gz RJCJOALKWPCLFC-UHFFFAOYSA-N 2 0 349.519 2.639 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(N(C)C)cc1 ZINC000271508867 474575246 /nfs/dbraw/zinc/57/52/46/474575246.db2.gz NLRXMFDDQMUSDX-RYGJVYDSSA-N 2 0 331.504 2.781 20 10 EFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1 ZINC000284279407 474609600 /nfs/dbraw/zinc/60/96/00/474609600.db2.gz XHNXNCSDKMMCCQ-ZWKOTPCHSA-N 2 0 333.520 2.932 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H](C)O[C@H]3C)cc2F)CC1 ZINC000295270905 475117688 /nfs/dbraw/zinc/11/76/88/475117688.db2.gz VPRUCSUTAPJSDU-RVKKMQEKSA-N 2 0 335.467 2.623 20 10 EFCDRP C[N@H+](Cc1cc(Cl)ccc1O)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000377630267 476487928 /nfs/dbraw/zinc/48/79/28/476487928.db2.gz QHRPGJDWADWKJF-KRWDZBQOSA-N 2 0 337.895 2.646 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000370625633 476901259 /nfs/dbraw/zinc/90/12/59/476901259.db2.gz ZHWJDQHHALYBOK-HKUYNNGSSA-N 2 0 344.547 2.962 20 10 EFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423081377 476920834 /nfs/dbraw/zinc/92/08/34/476920834.db2.gz BMQHYYCRSVKDPP-KZNAEPCWSA-N 2 0 327.472 2.733 20 10 EFCDRP Cc1cc(O)c(C[N@@H+](C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1C ZINC000367722783 477656817 /nfs/dbraw/zinc/65/68/17/477656817.db2.gz RLJJYBDRYLCPLW-LJQANCHMSA-N 2 0 331.504 2.609 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1C ZINC000368328315 477797704 /nfs/dbraw/zinc/79/77/04/477797704.db2.gz OTIOJDDOQRTZHL-IAGOWNOFSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CNC(=[NH2+])NC3CCCC3)cc2F)CC1 ZINC000171662813 529153018 /nfs/dbraw/zinc/15/30/18/529153018.db2.gz BZIWOOAZQCERJB-UHFFFAOYSA-N 2 0 347.482 2.524 20 10 EFCDRP Cc1cc(C)c(O)c(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000754739587 575480749 /nfs/dbraw/zinc/48/07/49/575480749.db2.gz DTPPJBAGTJFYSN-UHFFFAOYSA-N 2 0 345.531 2.999 20 10 EFCDRP c1cc(N2CCSCC2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000754784652 575489719 /nfs/dbraw/zinc/48/97/19/575489719.db2.gz IGVRKYDCUPIOFP-HKUYNNGSSA-N 2 0 331.529 2.956 20 10 EFCDRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756409076 575732892 /nfs/dbraw/zinc/73/28/92/575732892.db2.gz XHZFGYAXRVFOMF-KRWDZBQOSA-N 2 0 345.531 2.949 20 10 EFCDRP C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)CN1CC[NH+](C)CC1 ZINC000756534153 575756607 /nfs/dbraw/zinc/75/66/07/575756607.db2.gz KUGHIKLINLCSOJ-YCPHGPKFSA-N 2 0 335.467 2.553 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2c1c(F)ccc2O ZINC000756565121 575763260 /nfs/dbraw/zinc/76/32/60/575763260.db2.gz VONBHCCLYSBNJI-IJEWVQPXSA-N 2 0 336.451 2.906 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(O)c1 ZINC000758547605 575872332 /nfs/dbraw/zinc/87/23/32/575872332.db2.gz XCDBJYGGQPTIRS-MRXNPFEDSA-N 2 0 325.456 2.995 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc2c(cc1O)CCCC2 ZINC000768461435 577275702 /nfs/dbraw/zinc/27/57/02/577275702.db2.gz CWNRPXBBYYEAGG-SFHLNBCPSA-N 2 0 344.499 2.955 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769513495 577368895 /nfs/dbraw/zinc/36/88/95/577368895.db2.gz AUIUDKKUKOCIJC-QGZVFWFLSA-N 2 0 337.483 2.824 20 10 EFCDRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCOCC1 ZINC000771840857 581249233 /nfs/dbraw/zinc/24/92/33/581249233.db2.gz AHIBYXOXPAEAIA-FQEVSTJZSA-N 2 0 331.504 2.733 20 10 EFCDRP CN(C)c1ccccc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771841797 581249494 /nfs/dbraw/zinc/24/94/94/581249494.db2.gz LEZMDWIRJJCPQN-UHFFFAOYSA-N 2 0 338.499 2.794 20 10 EFCDRP CO[C@]1(C)C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000771841078 581249697 /nfs/dbraw/zinc/24/96/97/581249697.db2.gz DEQWKVOHURPVPN-UYAOXDASSA-N 2 0 331.504 2.732 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)cc2)CC1 ZINC000771844315 581249821 /nfs/dbraw/zinc/24/98/21/581249821.db2.gz YMIHVHKILHODHJ-XUVXKRRUSA-N 2 0 343.515 2.732 20 10 EFCDRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000771888372 581255222 /nfs/dbraw/zinc/25/52/22/581255222.db2.gz OLQHXRCCKZCPBX-QUCCMNQESA-N 2 0 331.504 2.732 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccnc3Cl)cc2)CC1 ZINC000850352217 1250446450 /nfs/dbraw/zinc/44/64/50/1250446450.db2.gz OYFYLCHDNMBFTM-UHFFFAOYSA-N 2 0 330.863 2.777 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)ccc1N(C)C ZINC000923381033 1261579852 /nfs/dbraw/zinc/57/98/52/1261579852.db2.gz ZKVUXSBALNQPEP-QUCCMNQESA-N 2 0 331.504 2.779 20 10 EFCDRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921860698 1262923245 /nfs/dbraw/zinc/92/32/45/1262923245.db2.gz UPDCPKODLOJQFK-WOJBJXKFSA-N 2 0 344.499 2.869 20 10 EFCDRP CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000825299583 1278497148 /nfs/dbraw/zinc/49/71/48/1278497148.db2.gz NZSROBHESIQLMZ-WOJBJXKFSA-N 2 0 331.504 2.876 20 10 EFCDRP C[C@H]1CN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2F)C[C@H](C)O1 ZINC000817890526 1276347604 /nfs/dbraw/zinc/34/76/04/1276347604.db2.gz ZQIICYNUKYWUGL-KSTANIPCSA-N 2 0 347.478 2.812 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1F ZINC000817903261 1276366946 /nfs/dbraw/zinc/36/69/46/1276366946.db2.gz LOJLNNLZJGNQBV-NZSAHSFTSA-N 2 0 349.494 2.919 20 10 EFCDRP CC[C@@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817937313 1276384114 /nfs/dbraw/zinc/38/41/14/1276384114.db2.gz WJJCHFSORLVZIE-OAHLLOKOSA-N 2 0 345.409 2.747 20 10 EFCDRP C[C@H]([NH2+]CCN1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817943358 1276389401 /nfs/dbraw/zinc/38/94/01/1276389401.db2.gz MCUBWECJMRBOMQ-SFHVURJKSA-N 2 0 330.520 2.623 20 10 EFCDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817964404 1276402964 /nfs/dbraw/zinc/40/29/64/1276402964.db2.gz BJLAGODMRAKIEG-KXBFYZLASA-N 2 0 335.467 2.703 20 10 EFCDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817981628 1276419930 /nfs/dbraw/zinc/41/99/30/1276419930.db2.gz UCEYDTUUYFEPEK-NVXWUHKLSA-N 2 0 335.467 2.845 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817987457 1276428145 /nfs/dbraw/zinc/42/81/45/1276428145.db2.gz ZLPBXLGGNZKYCT-WBVHZDCISA-N 2 0 347.478 2.988 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C(C)C)CC3)C2)cc1 ZINC000818344171 1276511126 /nfs/dbraw/zinc/51/11/26/1276511126.db2.gz KGTPDIOOKWVEEU-QGZVFWFLSA-N 2 0 331.504 2.984 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)[C@H](C)C1 ZINC000818344139 1276511891 /nfs/dbraw/zinc/51/18/91/1276511891.db2.gz JUARENPNVBUMOD-HLIPFELVSA-N 2 0 331.504 2.841 20 10 EFCDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc(N3CCOCC3)c(F)c1)CC[NH2+]CC2 ZINC000818431313 1276522204 /nfs/dbraw/zinc/52/22/04/1276522204.db2.gz IXPRMZYGFWKFFS-INIZCTEOSA-N 2 0 347.478 2.626 20 10 EFCDRP Cc1[nH+]ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1Cl ZINC000792689978 1279120705 /nfs/dbraw/zinc/12/07/05/1279120705.db2.gz CNWBUAUMSXOFRT-UHFFFAOYSA-N 2 0 330.863 2.829 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c(O)c1 ZINC000844902540 1279323307 /nfs/dbraw/zinc/32/33/07/1279323307.db2.gz OWKBGZLTGCPXIB-BXWFABGCSA-N 2 0 334.460 2.509 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815151114 1287349735 /nfs/dbraw/zinc/34/97/35/1287349735.db2.gz KHOXULSPSSDRQO-UHFFFAOYSA-N 2 0 331.504 2.879 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCCO3)cc2)CC1 ZINC000793609691 1279773009 /nfs/dbraw/zinc/77/30/09/1279773009.db2.gz REFUQLMYSPVKKI-WOJBJXKFSA-N 2 0 329.488 2.582 20 10 EFCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c1O ZINC000846148417 1280036446 /nfs/dbraw/zinc/03/64/46/1280036446.db2.gz ZEEVXESFBITPAG-CABCVRRESA-N 2 0 334.460 2.552 20 10 EFCDRP CN(CC[N@H+](C)Cc1cc(Cl)ccc1O)C1CC[NH+](C)CC1 ZINC000809734503 1282412036 /nfs/dbraw/zinc/41/20/36/1282412036.db2.gz INMWYHONFRQIQO-UHFFFAOYSA-N 2 0 325.884 2.503 20 10 EFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1ccc(N(C)C)cc1 ZINC000809737401 1282437541 /nfs/dbraw/zinc/43/75/41/1282437541.db2.gz HGCMNVLVVPWIRS-HXUWFJFHSA-N 2 0 332.536 2.601 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1cc(-c2ccccc2)ccc1O ZINC000809741810 1282443736 /nfs/dbraw/zinc/44/37/36/1282443736.db2.gz XGILCIPUHSZLQJ-UHFFFAOYSA-N 2 0 341.499 2.984 20 10 EFCDRP CCCCN(C)C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000810163595 1282998794 /nfs/dbraw/zinc/99/87/94/1282998794.db2.gz ZSVZHJIDBNHWNZ-GOSISDBHSA-N 2 0 332.536 2.648 20 10 EFCDRP CCCc1nc(C)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000813792683 1286120354 /nfs/dbraw/zinc/12/03/54/1286120354.db2.gz URYFGSATWDGZKS-UHFFFAOYSA-N 2 0 342.487 2.977 20 10 EFCDRP C[N@@H+]1CCC[C@]2(CCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)C1 ZINC000816641670 1288227017 /nfs/dbraw/zinc/22/70/17/1288227017.db2.gz BMXOUGGJSLMIOL-FQEVSTJZSA-N 2 0 347.478 2.580 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@]4(CCCO4)[C@@H]3C3CC3)cc2)CC1 ZINC000816666291 1288235981 /nfs/dbraw/zinc/23/59/81/1288235981.db2.gz JLXQTSPBEXLLCR-LEWJYISDSA-N 2 0 341.499 2.582 20 10 EFCDRP CC[N@H+](C)CCC(=O)N[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135861644 1288518661 /nfs/dbraw/zinc/51/86/61/1288518661.db2.gz UZLZGRIAUHHHKW-IRXDYDNUSA-N 2 0 349.519 2.718 20 10 EFCDRP CC[N@H+](C)CCC(=O)N[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135861645 1288518929 /nfs/dbraw/zinc/51/89/29/1288518929.db2.gz UZLZGRIAUHHHKW-SJORKVTESA-N 2 0 349.519 2.718 20 10 EFCDRP C[C@@H]([NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C)C1CC[NH+](C)CC1 ZINC000903448365 1312694996 /nfs/dbraw/zinc/69/49/96/1312694996.db2.gz NSVKSCGUYQCJDN-UZLBHIALSA-N 2 0 332.536 2.675 20 10 EFCDRP COC(=O)c1c(C[N@H+](C)CC2CC[NH+](C)CC2)c2ccccc2n1C ZINC001232408156 1312695457 /nfs/dbraw/zinc/69/54/57/1312695457.db2.gz XENBSCMJZVDRHB-UHFFFAOYSA-N 2 0 343.471 2.739 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CSC[C@H]3C)cc2F)CC1 ZINC000823801482 1289462815 /nfs/dbraw/zinc/46/28/15/1289462815.db2.gz GOQCKVVYMGVKLH-RHSMWYFYSA-N 2 0 337.508 2.809 20 10 EFCDRP COc1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1Cn1cccn1 ZINC000873044959 1289538094 /nfs/dbraw/zinc/53/80/94/1289538094.db2.gz ZUIXWYWERVTIBM-UHFFFAOYSA-N 2 0 342.487 2.762 20 10 EFCDRP CCCOc1ccc(C[NH2+]CCCN2CCC[N@H+](C)CC2)cc1C ZINC000873044639 1289538566 /nfs/dbraw/zinc/53/85/66/1289538566.db2.gz TXLXALGWQJNBSY-UHFFFAOYSA-N 2 0 333.520 2.901 20 10 EFCDRP COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1Cn1cccn1 ZINC000873131625 1289587451 /nfs/dbraw/zinc/58/74/51/1289587451.db2.gz RLWFLDFMGJXEBC-YQQQUEKLSA-N 2 0 340.471 2.655 20 10 EFCDRP C[C@@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc(N(C)C)cc1 ZINC000873242881 1289675668 /nfs/dbraw/zinc/67/56/68/1289675668.db2.gz SOAGLVWCVMGZPU-OAHLLOKOSA-N 2 0 325.460 2.730 20 10 EFCDRP C[C@@H]1C[C@H](Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c2c1c(F)ccc2O ZINC000873243950 1289676434 /nfs/dbraw/zinc/67/64/34/1289676434.db2.gz DUUUQZYDRCIDBA-DOMZBBRYSA-N 2 0 342.418 2.996 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000873290735 1289706212 /nfs/dbraw/zinc/70/62/12/1289706212.db2.gz GUEBKDRQXMULPU-OALUTQOASA-N 2 0 331.504 2.952 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000247072806 1289866637 /nfs/dbraw/zinc/86/66/37/1289866637.db2.gz QHIJVYLSJVDIJA-OXJNMPFZSA-N 2 0 331.504 2.984 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(O)c1 ZINC000877190401 1291160538 /nfs/dbraw/zinc/16/05/38/1291160538.db2.gz DNMZLQFVYHRSIV-FQEVSTJZSA-N 2 0 340.467 2.947 20 10 EFCDRP Fc1cc(CN2CC[C@@H](C[NH+]3CCCC3)C2)ccc1N1CCOCC1 ZINC000093597561 1291178252 /nfs/dbraw/zinc/17/82/52/1291178252.db2.gz OIXZMSHLLPQQHK-SFHVURJKSA-N 2 0 347.478 2.580 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000877517769 1291255362 /nfs/dbraw/zinc/25/53/62/1291255362.db2.gz PGWICMSIZRSGBR-YOFSQIOKSA-N 2 0 343.515 2.705 20 10 EFCDRP CCC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775174995 1291407337 /nfs/dbraw/zinc/40/73/37/1291407337.db2.gz DWDQMINPSFVPIX-FQEVSTJZSA-N 2 0 331.504 2.565 20 10 EFCDRP C[N@@H+](Cc1ccc(Br)cc1O)CC1CC[NH+](C)CC1 ZINC000691680215 1291677581 /nfs/dbraw/zinc/67/75/81/1291677581.db2.gz UIYVFUCYLJIHSW-UHFFFAOYSA-N 2 0 327.266 2.928 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775502210 1292789955 /nfs/dbraw/zinc/78/99/55/1292789955.db2.gz QHRILCPMGPSQSA-XJKSGUPXSA-N 2 0 325.884 2.722 20 10 EFCDRP C[N@@H+]1C[C@H](COCC2CC2)[C@]2(CC[NH+](Cc3ccccc3O)C2)C1 ZINC001203551834 1312954306 /nfs/dbraw/zinc/95/43/06/1312954306.db2.gz PUYASRLWKRZNTC-UYAOXDASSA-N 2 0 330.472 2.573 20 10 EFCDRP C[NH+]1CCC2(C[NH+](Cc3cccc(OC(F)(F)F)c3O)C2)CC1 ZINC001233767965 1312987407 /nfs/dbraw/zinc/98/74/07/1312987407.db2.gz INZUTNAZLRRXFW-UHFFFAOYSA-N 2 0 330.350 2.818 20 10 EFCDRP CCOC1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000883291243 1293533925 /nfs/dbraw/zinc/53/39/25/1293533925.db2.gz WVDCTCBTUFMNTL-UHFFFAOYSA-N 2 0 331.504 2.876 20 10 EFCDRP COC1([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000883291117 1293534331 /nfs/dbraw/zinc/53/43/31/1293534331.db2.gz SRBGCRYKCMHIBS-KRWDZBQOSA-N 2 0 331.504 2.876 20 10 EFCDRP CN(C)c1ccc(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)cc1 ZINC001203930660 1313050025 /nfs/dbraw/zinc/05/00/25/1313050025.db2.gz CBCOZKWQVHVWGH-BGYRXZFFSA-N 2 0 336.483 2.711 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(OCC4CC4)CC3)cc2)CC1 ZINC000775726848 1294294345 /nfs/dbraw/zinc/29/43/45/1294294345.db2.gz YQTDJRZSDCWDTI-UHFFFAOYSA-N 2 0 343.515 2.829 20 10 EFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cc(C(C)(C)C)ccc1O ZINC001276446638 1313097625 /nfs/dbraw/zinc/09/76/25/1313097625.db2.gz YAOGYNACNDWXBZ-OALUTQOASA-N 2 0 345.531 2.900 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)cc2)CC1 ZINC001234660987 1313179748 /nfs/dbraw/zinc/17/97/48/1313179748.db2.gz NXXYMOHBZJELCS-RMFSNUHRSA-N 2 0 343.515 2.938 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C[C@H]1C[NH3+] ZINC001205150443 1313241123 /nfs/dbraw/zinc/24/11/23/1313241123.db2.gz BYRNQCUYONIAMD-MAUKXSAKSA-N 2 0 326.440 2.998 20 10 EFCDRP C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001205164748 1313244193 /nfs/dbraw/zinc/24/41/93/1313244193.db2.gz RUYPICZKAJJDMY-MRXNPFEDSA-N 2 0 337.467 2.921 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCCC[C@]34CC[NH2+]C4)cc2)CC1 ZINC001235117339 1313245259 /nfs/dbraw/zinc/24/52/59/1313245259.db2.gz AGVGMQIWEHLCTG-OAQYLSRUSA-N 2 0 342.531 2.547 20 10 EFCDRP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3cccc(C(C)(C)C)c3O)[C@@H]2C1 ZINC001275802807 1296412969 /nfs/dbraw/zinc/41/29/69/1296412969.db2.gz PAIGLAXMQRDOHK-QFBILLFUSA-N 2 0 345.531 2.757 20 10 EFCDRP Cc1cccc(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001276080266 1296593876 /nfs/dbraw/zinc/59/38/76/1296593876.db2.gz MZHZESYLNHLMDF-FQEVSTJZSA-N 2 0 331.504 2.550 20 10 EFCDRP CCN(CC)c1ccc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c(OC)c1 ZINC001235336741 1313294233 /nfs/dbraw/zinc/29/42/33/1313294233.db2.gz ZYLYZQJVOULUNQ-UHFFFAOYSA-N 2 0 331.504 2.973 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc(Br)ccc2O)CC1 ZINC001205545827 1313310194 /nfs/dbraw/zinc/31/01/94/1313310194.db2.gz NQOKRWYEEBFSGP-CQSZACIVSA-N 2 0 331.229 2.808 20 10 EFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC1 ZINC001205558996 1313312999 /nfs/dbraw/zinc/31/29/99/1313312999.db2.gz MTEPDAOQPDKIHL-FQEVSTJZSA-N 2 0 347.478 2.744 20 10 EFCDRP CCOC(=O)c1c(C[N@H+](C)CC2CC[NH2+]CC2)c2ccccc2n1C ZINC001235432575 1313320107 /nfs/dbraw/zinc/32/01/07/1313320107.db2.gz LJZVLVRMFIHAND-UHFFFAOYSA-N 2 0 343.471 2.786 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@H]1C[NH3+] ZINC001205626715 1313325769 /nfs/dbraw/zinc/32/57/69/1313325769.db2.gz IJOGNDCUEKQBAN-RYUDHWBXSA-N 2 0 327.266 2.962 20 10 EFCDRP Nc1ccc(C[N@@H+]2CCCn3cnc(C[NH2+]C4CCCC4)c3C2)cc1 ZINC001235649789 1313366776 /nfs/dbraw/zinc/36/67/76/1313366776.db2.gz UAAHMMBDPMBJOY-UHFFFAOYSA-N 2 0 339.487 2.903 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H](Cc3ccccc3)C1)C[NH2+]CCO2 ZINC001235715899 1313382706 /nfs/dbraw/zinc/38/27/06/1313382706.db2.gz XIVPLOFNCCNBCP-QGZVFWFLSA-N 2 0 338.451 2.939 20 10 EFCDRP COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC2(C)CC[NH2+]CC2)C1 ZINC001235839210 1313406664 /nfs/dbraw/zinc/40/66/64/1313406664.db2.gz NFNNBHCDTMLTSG-UHFFFAOYSA-N 2 0 327.472 2.935 20 10 EFCDRP Cc1ccc(CC[N@@H+](C)Cc2cc3c(cc2O)OCC[NH2+]C3)cc1 ZINC001235840674 1313407464 /nfs/dbraw/zinc/40/74/64/1313407464.db2.gz SOQGRJBMSXPCQJ-UHFFFAOYSA-N 2 0 326.440 2.857 20 10 EFCDRP COc1ccccc1CC[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235843541 1313408224 /nfs/dbraw/zinc/40/82/24/1313408224.db2.gz YOYBAJWNELWAIY-UHFFFAOYSA-N 2 0 339.483 2.779 20 10 EFCDRP c1c(C[NH+]2CC3(C2)CCC[NH2+]CC3)cc2c3c1CCCN3CCC2 ZINC001236010836 1313431347 /nfs/dbraw/zinc/43/13/47/1313431347.db2.gz YXSQOLVZZSJRNL-UHFFFAOYSA-N 2 0 325.500 2.961 20 10 EFCDRP COc1cc(C)c(C[N@@H+]2C[C@H]3C[NH2+]C[C@@]3(c3ccccc3)C2)c(O)c1 ZINC001236011102 1313431416 /nfs/dbraw/zinc/43/14/16/1313431416.db2.gz RHZINJUOSRFLPK-UTKZUKDTSA-N 2 0 338.451 2.682 20 10 EFCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC001206311645 1313434470 /nfs/dbraw/zinc/43/44/70/1313434470.db2.gz RWGCDYSNVRXVMH-FQEVSTJZSA-N 2 0 331.504 2.599 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@H](N3CC([NH3+])C3)C2)cc1 ZINC001236073425 1313437533 /nfs/dbraw/zinc/43/75/33/1313437533.db2.gz MZBDLBMHMHYKQM-NRFANRHFSA-N 2 0 338.499 2.701 20 10 EFCDRP C[N@H+](CCN1CC[NH2+]CC1)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001236081458 1313439711 /nfs/dbraw/zinc/43/97/11/1313439711.db2.gz NEDZERCYOSZXNF-UHFFFAOYSA-N 2 0 343.446 2.535 20 10 EFCDRP CCCC[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[NH2+]1 ZINC001236141772 1313446275 /nfs/dbraw/zinc/44/62/75/1313446275.db2.gz MCVCBADWZFXOPP-GOSISDBHSA-N 2 0 348.510 2.542 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C)[C@@H]3CCCC[C@@H]3[NH3+])cc2)CC1 ZINC001236214338 1313456865 /nfs/dbraw/zinc/45/68/65/1313456865.db2.gz DHDRWSIWOQOAHW-VQTJNVASSA-N 2 0 330.520 2.530 20 10 EFCDRP CCN(CC)c1ccc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(OC)c1 ZINC001236315821 1313467718 /nfs/dbraw/zinc/46/77/18/1313467718.db2.gz OFQWSRHAZLTHKT-CALCHBBNSA-N 2 0 331.504 2.973 20 10 EFCDRP c1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001236321192 1313469090 /nfs/dbraw/zinc/46/90/90/1313469090.db2.gz YALRNSKAGZWUNX-BGYRXZFFSA-N 2 0 325.500 2.817 20 10 EFCDRP Cc1cc(Br)cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1O ZINC001236321295 1313469112 /nfs/dbraw/zinc/46/91/12/1313469112.db2.gz HTKIWILUQLLBRX-BETUJISGSA-N 2 0 339.277 2.895 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)c(C)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236410608 1313476767 /nfs/dbraw/zinc/47/67/67/1313476767.db2.gz HXSQDVRSDQFIBJ-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C2CCC2)CC1 ZINC001236571817 1313493430 /nfs/dbraw/zinc/49/34/30/1313493430.db2.gz DTNGAWYTQIFSEH-XGAFWQRZSA-N 3 0 342.531 2.721 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3ccncc3C)C2)cc1OC ZINC001236753133 1313522293 /nfs/dbraw/zinc/52/22/93/1313522293.db2.gz HDYZFHPGBWQTIU-OAHLLOKOSA-N 2 0 344.411 2.766 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1cc(Cl)c(Cl)cc1O ZINC001236797339 1313531392 /nfs/dbraw/zinc/53/13/92/1313531392.db2.gz XELDXFGGASYZNR-UHFFFAOYSA-N 2 0 334.291 2.624 20 10 EFCDRP CCC[N@@H+](Cc1cc2c3c(c1O)CCCN3CCC2)C[C@@H]1CC[NH2+]C1 ZINC001236835678 1313538367 /nfs/dbraw/zinc/53/83/67/1313538367.db2.gz OQHIKFKBSMMLHG-MRXNPFEDSA-N 2 0 343.515 2.913 20 10 EFCDRP C[NH+]1CCN(C2CC[NH+](Cc3cc4ccccc4cc3O)CC2)CC1 ZINC001236841636 1313540515 /nfs/dbraw/zinc/54/05/15/1313540515.db2.gz NGGFWLUEKZUGPK-UHFFFAOYSA-N 2 0 339.483 2.757 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(C(F)(F)F)cc1O)[C@H]1CCC[NH2+]C1 ZINC001236931456 1313556203 /nfs/dbraw/zinc/55/62/03/1313556203.db2.gz HILGGAKOHOTESJ-HNNXBMFYSA-N 2 0 345.409 2.527 20 10 EFCDRP C[NH+](C)CCN(Cc1c(O)ccc2ccccc21)[C@H]1CCC[NH2+]C1 ZINC001236933005 1313556605 /nfs/dbraw/zinc/55/66/05/1313556605.db2.gz PPSYPTPPNCGPBY-KRWDZBQOSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4CCCO[C@H]4C3)c(F)c2)CC1 ZINC001236935217 1313557472 /nfs/dbraw/zinc/55/74/72/1313557472.db2.gz GMOAOLGFVSNSRE-UZLBHIALSA-N 2 0 347.478 2.578 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]4(C3)CCCCO4)c(F)c2)CC1 ZINC001236936918 1313557557 /nfs/dbraw/zinc/55/75/57/1313557557.db2.gz UQVFESBNDMWWOU-FQEVSTJZSA-N 2 0 347.478 2.723 20 10 EFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C[C@@H]2C1 ZINC001237062035 1313579670 /nfs/dbraw/zinc/57/96/70/1313579670.db2.gz JAVPKSKPWYENKX-OKILXGFUSA-N 2 0 344.377 2.717 20 10 EFCDRP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C[C@H]1Cc2ccccc2O1 ZINC001237266741 1313614930 /nfs/dbraw/zinc/61/49/30/1313614930.db2.gz ZJGKGLSPJXWLCK-HXUWFJFHSA-N 2 0 337.467 2.532 20 10 EFCDRP CO[C@@H]1[C@H](C)[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000776497807 1299317253 /nfs/dbraw/zinc/31/72/53/1299317253.db2.gz GBQYLOITEMGKNN-ATZDWAIDSA-N 2 0 331.504 2.588 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cccc1OC(F)(F)F ZINC001237415859 1313641634 /nfs/dbraw/zinc/64/16/34/1313641634.db2.gz OQRYHHSKABTVNP-WCQYABFASA-N 2 0 330.350 2.865 20 10 EFCDRP COC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237494429 1313655897 /nfs/dbraw/zinc/65/58/97/1313655897.db2.gz IRFOFSMNEPPSBI-INIZCTEOSA-N 2 0 346.471 2.550 20 10 EFCDRP CC[NH+](CC)CCCN1CC[NH+](Cc2cc(F)cc(C)c2O)CC1 ZINC001238063502 1313754200 /nfs/dbraw/zinc/75/42/00/1313754200.db2.gz XLGQGSKQQGJGQX-UHFFFAOYSA-N 2 0 337.483 2.689 20 10 EFCDRP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000119868129 1302785841 /nfs/dbraw/zinc/78/58/41/1302785841.db2.gz SIVXOVVDOZBKFL-UHFFFAOYSA-N 2 0 331.504 2.876 20 10 EFCDRP CN(C)c1ccc(CNc2cc(N3CC[NH+](C)CC3)cc[nH+]2)cc1 ZINC000865296535 1303211286 /nfs/dbraw/zinc/21/12/86/1303211286.db2.gz ZBORYIBCUZLUCH-UHFFFAOYSA-N 2 0 325.460 2.512 20 10 EFCDRP Cc1cc(O)c(C[N@H+]2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)cc1Cl ZINC001276372161 1314245560 /nfs/dbraw/zinc/24/55/60/1314245560.db2.gz HUPPBVVXNWVHEI-IRXDYDNUSA-N 2 0 337.895 2.564 20 10 EFCDRP c1c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc2c3c1CCCN3CCC2 ZINC001222149518 1311091789 /nfs/dbraw/zinc/09/17/89/1311091789.db2.gz ZYEQXRHGPRYCPU-NRFANRHFSA-N 2 0 325.500 2.961 20 10 EFCDRP CN(C)c1ccc(CN2CCO[C@]3(CCC[NH2+]C3)C2)c2ccccc21 ZINC001222360743 1311118890 /nfs/dbraw/zinc/11/88/90/1311118890.db2.gz UCOOYDIQPOKANJ-NRFANRHFSA-N 2 0 339.483 2.860 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@@]4(CCCC[NH2+]4)C3)cc2)CC1 ZINC001222391163 1311123474 /nfs/dbraw/zinc/12/34/74/1311123474.db2.gz YVWVKJWIIOROMZ-NRFANRHFSA-N 2 0 342.531 2.547 20 10 EFCDRP Cc1cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c(O)cc1Br ZINC001222635027 1311164735 /nfs/dbraw/zinc/16/47/35/1311164735.db2.gz OHVHNXVDVDOTDX-BETUJISGSA-N 2 0 339.277 2.895 20 10 EFCDRP COc1cc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(O)cc1O ZINC001231637026 1312536896 /nfs/dbraw/zinc/53/68/96/1312536896.db2.gz DARJWTTWOOCFDE-HOTGVXAUSA-N 2 0 334.460 2.945 20 10 EFCDRP CCCCOC(=O)CC[C@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172208 1314593199 /nfs/dbraw/zinc/59/31/99/1314593199.db2.gz GPJRYYFKTXXYJC-KRWDZBQOSA-N 2 0 347.503 2.698 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246173005 1314593266 /nfs/dbraw/zinc/59/32/66/1314593266.db2.gz JFWXJIMFRQQPBP-LJQANCHMSA-N 3 0 342.531 2.641 20 10 EFCDRP c1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CS2 ZINC001246173335 1314593352 /nfs/dbraw/zinc/59/33/52/1314593352.db2.gz LJDBFWGVZVBYCA-SFHVURJKSA-N 2 0 339.508 2.903 20 10 EFCDRP [NH3+]CCCC[C@H]([NH3+])Cc1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217718201 1315105406 /nfs/dbraw/zinc/10/54/06/1315105406.db2.gz TULFVSVCJYMSOR-HNNXBMFYSA-N 2 0 325.416 2.526 20 10 EFCDRP C[N@@H+]1CCC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C1 ZINC001255475041 1315828532 /nfs/dbraw/zinc/82/85/32/1315828532.db2.gz KCNFXMWTKVYSQU-VHKYSDTDSA-N 2 0 341.455 2.523 20 10 EFCDRP Oc1ccccc1CN1CCC([NH2+]C2CCC3(COC3)CC2)CC1 ZINC001257901603 1316102041 /nfs/dbraw/zinc/10/20/41/1316102041.db2.gz KEUQSWWXNBNAQA-UHFFFAOYSA-N 2 0 330.472 2.905 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC001320245945 1329105983 /nfs/dbraw/zinc/10/59/83/1329105983.db2.gz KNUHNWLWMPXBMX-IAGOWNOFSA-N 2 0 331.504 2.866 20 10 EFCDRP COc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccc1F ZINC001331538163 1330850123 /nfs/dbraw/zinc/85/01/23/1330850123.db2.gz WSZHKIZHEITZMF-UHFFFAOYSA-N 2 0 343.446 2.876 20 10 EFCDRP CC[NH+](CC)CCOCC[NH2+]Cc1c(O)cccc1Br ZINC001348098951 1332800078 /nfs/dbraw/zinc/80/00/78/1332800078.db2.gz AWARUEHEWOXPQY-UHFFFAOYSA-N 2 0 345.281 2.603 20 10 EFCDRP CCSC1(C[NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 ZINC001350143528 1333040298 /nfs/dbraw/zinc/04/02/98/1333040298.db2.gz OGBOREHQQWXTJF-UHFFFAOYSA-N 2 0 337.508 2.953 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300403721 713398063 /nfs/dbraw/zinc/39/80/63/713398063.db2.gz ACIPFSYDNDRHIB-KBPBESRZSA-N 2 0 325.250 2.871 20 10 EFCDRP CC[C@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)ccc1O ZINC000219315740 716386577 /nfs/dbraw/zinc/38/65/77/716386577.db2.gz RCBBQVCLSCJRSP-AWEZNQCLSA-N 2 0 345.281 2.774 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+]CC3CC[NH+](C)CC3)cc2F)C[C@H](C)O1 ZINC000892624054 718352153 /nfs/dbraw/zinc/35/21/53/718352153.db2.gz YRPOCVPOFPAWRR-IYBDPMFKSA-N 2 0 349.494 2.871 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2[O-])C1 ZINC000894070552 720266136 /nfs/dbraw/zinc/26/61/36/720266136.db2.gz CPUCHKUSUFOMON-OAHLLOKOSA-N 2 0 328.403 2.603 20 10 EFCDRP COc1cc(C)cc(C[NH2+]Cc2ccccc2OCC[NH+](C)C)c1O ZINC000894208689 721214846 /nfs/dbraw/zinc/21/48/46/721214846.db2.gz KEMJBGCIFVBWNM-UHFFFAOYSA-N 2 0 344.455 2.939 20 10 EFCDRP CCc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1O ZINC000895607709 724221753 /nfs/dbraw/zinc/22/17/53/724221753.db2.gz UKZGITILTKIZSY-UHFFFAOYSA-N 2 0 339.483 2.996 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C3CCOCC3)cc2)CC1 ZINC000897452831 726213440 /nfs/dbraw/zinc/21/34/40/726213440.db2.gz XFWUGTLBWDEAQE-UHFFFAOYSA-N 2 0 345.531 2.981 20 10 EFCDRP C[C@H](Cn1ccnc1)[NH2+]Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000915229716 726907798 /nfs/dbraw/zinc/90/77/98/726907798.db2.gz NMYMJYSSWZCQHK-OAHLLOKOSA-N 2 0 343.431 2.960 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@H](C)C3CC[NH+](C)CC3)CC2)cc1 ZINC000157452737 728151869 /nfs/dbraw/zinc/15/18/69/728151869.db2.gz WLHGTEXDOZGUPA-MRXNPFEDSA-N 2 0 331.504 2.984 20 10 EFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000227441923 728333168 /nfs/dbraw/zinc/33/31/68/728333168.db2.gz INDXNPUOACMHCY-GFCCVEGCSA-N 2 0 327.266 2.975 20 10 EFCDRP COC1CCN(c2ccc(C[NH2+][C@H](C)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001578941234 1090484046 /nfs/dbraw/zinc/48/40/46/1090484046.db2.gz QCUVKELLPAEDBO-AEFFLSMTSA-N 2 0 331.504 2.780 20 10 EFCDRP [NH3+][C@H](CC[NH2+]Cc1ccc(N2CCOCC2)cc1)Cc1ccccc1 ZINC001580127597 1090783028 /nfs/dbraw/zinc/78/30/28/1090783028.db2.gz MWKMGKMLTUTBSV-HXUWFJFHSA-N 2 0 339.483 2.573 20 10 EFCDRP OC1CCN(c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)cc2)CC1 ZINC001580880824 1091033183 /nfs/dbraw/zinc/03/31/83/1091033183.db2.gz YOCDSMKHOZWNRC-UHFFFAOYSA-N 2 0 343.515 2.613 20 10 EFCDRP Oc1ccc(Cl)cc1CN1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001580888508 1091035260 /nfs/dbraw/zinc/03/52/60/1091035260.db2.gz NKKHVFFDRZIIEC-SOABOVLPSA-N 2 0 349.906 2.883 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001580888745 1091036087 /nfs/dbraw/zinc/03/60/87/1091036087.db2.gz XVZLFMFUXZVUTJ-SCDSUCTJSA-N 2 0 325.250 2.632 20 10 EFCDRP CC[N@@H+]1CC[C@H](NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)[C@@H](C)C1 ZINC000898450561 1108943927 /nfs/dbraw/zinc/94/39/27/1108943927.db2.gz RYWNBHHMYGVWML-FFZOFVMBSA-N 2 0 332.536 2.675 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(C)CC2)cc1 ZINC000154357276 1112021542 /nfs/dbraw/zinc/02/15/42/1112021542.db2.gz RYMHPAHIFBXBJP-SFHVURJKSA-N 2 0 332.536 2.821 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)c(O)c1 ZINC000185166033 473349810 /nfs/dbraw/zinc/34/98/10/473349810.db2.gz MHMJTXWNLFRJEK-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)c1 ZINC000185165755 473349962 /nfs/dbraw/zinc/34/99/62/473349962.db2.gz GZKMVULGHKMXRV-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(CC[NH+](C)C)CC2)cc1 ZINC000150956767 473386916 /nfs/dbraw/zinc/38/69/16/473386916.db2.gz DIYHRYSUPVJTGK-KRWDZBQOSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(N(C)C)cc1 ZINC000132858026 472759259 /nfs/dbraw/zinc/75/92/59/472759259.db2.gz KAQOJBNIGFYUIF-DLBZAZTESA-N 2 0 331.504 2.904 20 10 EFCDRP CCCOc1ccc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c(O)c1 ZINC000134117610 472877038 /nfs/dbraw/zinc/87/70/38/472877038.db2.gz SPRKFJJHKVIWBT-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N1CC[NH+](C)CC1 ZINC000185364524 473407354 /nfs/dbraw/zinc/40/73/54/473407354.db2.gz AIVOLFJFRGBWGR-CVEARBPZSA-N 2 0 327.472 2.832 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c1 ZINC000186127046 473596741 /nfs/dbraw/zinc/59/67/41/473596741.db2.gz QOYZJNRQEULAAP-QMIHWGKISA-N 2 0 348.487 2.819 20 10 EFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c1 ZINC000186127066 473596932 /nfs/dbraw/zinc/59/69/32/473596932.db2.gz QOYZJNRQEULAAP-DJKXOVBDSA-N 2 0 348.487 2.819 20 10 EFCDRP CC[C@@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000186580150 473693326 /nfs/dbraw/zinc/69/33/26/473693326.db2.gz BIQHTTMZIILWRG-YLJYHZDGSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc2ccccc2c1O ZINC000192923900 473747501 /nfs/dbraw/zinc/74/75/01/473747501.db2.gz HCOPOFWLEHOABR-INIZCTEOSA-N 2 0 327.472 2.834 20 10 EFCDRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1cc(F)ccc1O ZINC000290229709 474563032 /nfs/dbraw/zinc/56/30/32/474563032.db2.gz STPMNDKRXQLIGT-UHFFFAOYSA-N 2 0 333.407 2.547 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(N(C)C)cc1 ZINC000271508864 474575312 /nfs/dbraw/zinc/57/53/12/474575312.db2.gz NLRXMFDDQMUSDX-CWFSZBLJSA-N 2 0 331.504 2.781 20 10 EFCDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000271873202 474596541 /nfs/dbraw/zinc/59/65/41/474596541.db2.gz NGHFCJDDTWBZPV-HNNXBMFYSA-N 2 0 333.451 2.575 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273563861 474965395 /nfs/dbraw/zinc/96/53/95/474965395.db2.gz IXVIIHVLBBVLGH-YJBOKZPZSA-N 2 0 333.520 2.933 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)c(O)c1C ZINC000273605171 474986662 /nfs/dbraw/zinc/98/66/62/474986662.db2.gz TWXJXSSJZUUCMT-KRWDZBQOSA-N 2 0 333.520 2.933 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)Cn2ccnc2C)c1 ZINC000273608540 474987715 /nfs/dbraw/zinc/98/77/15/474987715.db2.gz UYUIYBOGKOPDAH-CHWSQXEVSA-N 2 0 331.416 2.671 20 10 EFCDRP C[N@@H+]1CC[C@@]2(CCN(Cc3cc(Br)ccc3O)C2)C1 ZINC000292777175 475193601 /nfs/dbraw/zinc/19/36/01/475193601.db2.gz LALDBUKAAOTCFA-OAHLLOKOSA-N 2 0 325.250 2.682 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1C ZINC000368328317 477798157 /nfs/dbraw/zinc/79/81/57/477798157.db2.gz OTIOJDDOQRTZHL-SJORKVTESA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1cc(Cl)ccc1O ZINC000368328338 477798647 /nfs/dbraw/zinc/79/86/47/477798647.db2.gz OXXABPXTZANBPC-DZGCQCFKSA-N 2 0 337.895 2.865 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@H](C)C[NH+]3CCCC3)CC2)cc1 ZINC000165299978 533999918 /nfs/dbraw/zinc/99/99/18/533999918.db2.gz CRYMHJFOIPDMTR-KRWDZBQOSA-N 2 0 331.504 2.986 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)OCO2 ZINC000157931804 534448641 /nfs/dbraw/zinc/44/86/41/534448641.db2.gz WVFJGNIEIAKBED-CJNGLKHVSA-N 2 0 330.428 2.570 20 10 EFCDRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cc(F)ccc3O)CC2)CC1 ZINC000272446352 535197623 /nfs/dbraw/zinc/19/76/23/535197623.db2.gz PDKBOTFPVIPSAJ-UHFFFAOYSA-N 2 0 335.467 2.522 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)N1CC[NH+](C)CC1 ZINC000756398122 575730690 /nfs/dbraw/zinc/73/06/90/575730690.db2.gz BTLJORIXIJSWDI-DJIMGWMZSA-N 2 0 349.494 2.941 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756408608 575732378 /nfs/dbraw/zinc/73/23/78/575732378.db2.gz QDSYHLLYMQQEHM-GDBMZVCRSA-N 2 0 335.467 2.697 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756412934 575733887 /nfs/dbraw/zinc/73/38/87/575733887.db2.gz WKQAPNILJMEGFB-LZWOXQAQSA-N 2 0 335.467 2.695 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534784 575756472 /nfs/dbraw/zinc/75/64/72/575756472.db2.gz OQYIGFOJHVFLIS-BFYDXBDKSA-N 2 0 349.494 2.943 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534786 575756689 /nfs/dbraw/zinc/75/66/89/575756689.db2.gz OQYIGFOJHVFLIS-HLLBOEOZSA-N 2 0 349.494 2.943 20 10 EFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1 ZINC000758255084 575864970 /nfs/dbraw/zinc/86/49/70/575864970.db2.gz XBNBMKIOIOBBSY-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000765039197 576539642 /nfs/dbraw/zinc/53/96/42/576539642.db2.gz RGVIBFFSFLIBKC-MJGOQNOKSA-N 2 0 329.488 2.880 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000769513610 577368976 /nfs/dbraw/zinc/36/89/76/577368976.db2.gz CXLSCKAOWFVVKW-CQSZACIVSA-N 2 0 326.868 2.978 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000769515364 577369137 /nfs/dbraw/zinc/36/91/37/577369137.db2.gz OZHLGEZFXROIMD-MRXNPFEDSA-N 2 0 326.868 2.978 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000770006612 577397513 /nfs/dbraw/zinc/39/75/13/577397513.db2.gz YZQRXHCPLROPPV-LZWOXQAQSA-N 2 0 335.467 2.695 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCC(=O)OC(C)(C)C)cc2)CC1 ZINC000771843377 581249437 /nfs/dbraw/zinc/24/94/37/581249437.db2.gz PGHIMTUGGVSLSW-UHFFFAOYSA-N 2 0 347.503 2.650 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@](C)(CO)C3CCCCC3)cc2)CC1 ZINC000771842290 581249521 /nfs/dbraw/zinc/24/95/21/581249521.db2.gz MEPDOZGGXORLQQ-OAQYLSRUSA-N 2 0 345.531 2.859 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)cc2)CC1 ZINC000771844319 581249941 /nfs/dbraw/zinc/24/99/41/581249941.db2.gz YMIHVHKILHODHJ-ZCNNSNEGSA-N 2 0 343.515 2.732 20 10 EFCDRP COc1cc(C[NH2+]C[C@@H]2CN3CCC[C@@H]3CO2)c(O)c(C(C)(C)C)c1 ZINC000850118473 1250291546 /nfs/dbraw/zinc/29/15/46/1250291546.db2.gz HJKLAUKOETVIMP-NVXWUHKLSA-N 2 0 348.487 2.651 20 10 EFCDRP COc1cc(C[NH2+]C[C@@H]2CN3CCC[C@H]3CO2)c(O)c(C(C)(C)C)c1 ZINC000850118470 1250292209 /nfs/dbraw/zinc/29/22/09/1250292209.db2.gz HJKLAUKOETVIMP-DOTOQJQBSA-N 2 0 348.487 2.651 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)ccc1N(C)C ZINC000923374914 1261575236 /nfs/dbraw/zinc/57/52/36/1261575236.db2.gz FKPWFLLGGKVHLW-UYAOXDASSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)ccc1N(C)C ZINC000923393766 1261599900 /nfs/dbraw/zinc/59/99/00/1261599900.db2.gz XNAJVZWSNOJISK-RLLQIKCJSA-N 2 0 331.504 2.922 20 10 EFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000825167485 1278432481 /nfs/dbraw/zinc/43/24/81/1278432481.db2.gz MXERMKAWCLWIAG-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP Cc1cc(O)c(C[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825261048 1278489623 /nfs/dbraw/zinc/48/96/23/1278489623.db2.gz WXFZSPAEEKTMIF-OAHLLOKOSA-N 2 0 337.895 2.612 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)CCC[C@@H]1C[NH3+] ZINC001206003148 1272721273 /nfs/dbraw/zinc/72/12/73/1272721273.db2.gz FKQOXZIDBIKFCC-VXGBXAGGSA-N 2 0 327.266 2.962 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000691447765 1274087594 /nfs/dbraw/zinc/08/75/94/1274087594.db2.gz VSRLAACTPQQDBX-KGLIPLIRSA-N 2 0 325.250 2.871 20 10 EFCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000706059864 1274357158 /nfs/dbraw/zinc/35/71/58/1274357158.db2.gz PISHTJPETATOMV-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000691488556 1274717973 /nfs/dbraw/zinc/71/79/73/1274717973.db2.gz MRGMZTILHFROHT-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)C(C)(C)OC)cc2F)CC1 ZINC000788592074 1276234329 /nfs/dbraw/zinc/23/43/29/1276234329.db2.gz AEACETVUBKXSAT-HNNXBMFYSA-N 2 0 337.483 2.871 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2F)C[C@H](C)O1 ZINC000817890527 1276347752 /nfs/dbraw/zinc/34/77/52/1276347752.db2.gz ZQIICYNUKYWUGL-SSAZZLEASA-N 2 0 347.478 2.812 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000817898532 1276366415 /nfs/dbraw/zinc/36/64/15/1276366415.db2.gz IHQWMDAECVTVQD-HSALFYBXSA-N 2 0 329.488 2.534 20 10 EFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817901812 1276366737 /nfs/dbraw/zinc/36/67/37/1276366737.db2.gz XSNJVVXBQJVAEI-MJBXVCDLSA-N 2 0 327.419 2.972 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817897941 1276366795 /nfs/dbraw/zinc/36/67/95/1276366795.db2.gz AWAYZDQZAMFRJG-VBQJREDUSA-N 2 0 339.430 2.974 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@H]2[C@@H]2CCC[NH2+]2)cc1F ZINC000817903263 1276367167 /nfs/dbraw/zinc/36/71/67/1276367167.db2.gz LOJLNNLZJGNQBV-YTQUADARSA-N 2 0 349.494 2.919 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903884 1276367466 /nfs/dbraw/zinc/36/74/66/1276367466.db2.gz WNNFNAVLDFAWJK-GUYCJALGSA-N 2 0 339.430 2.974 20 10 EFCDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCN1CC[NH2+]CC1 ZINC000817944698 1276389391 /nfs/dbraw/zinc/38/93/91/1276389391.db2.gz JVPVMTXJBRNKDW-FQEVSTJZSA-N 2 0 339.483 2.561 20 10 EFCDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817954792 1276396922 /nfs/dbraw/zinc/39/69/22/1276396922.db2.gz JZGNXNWEHJITCT-LSDHHAIUSA-N 2 0 337.895 2.827 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)CC2)cc1 ZINC000817986902 1276424119 /nfs/dbraw/zinc/42/41/19/1276424119.db2.gz VPQJFESMMJSJQV-XYJFISCASA-N 2 0 329.488 2.642 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000817987151 1276429598 /nfs/dbraw/zinc/42/95/98/1276429598.db2.gz WTERELRAOXZWPY-GDAAHCPNSA-N 2 0 329.488 2.562 20 10 EFCDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815055781 1287270563 /nfs/dbraw/zinc/27/05/63/1287270563.db2.gz NLJAJUPITCGFLI-LJQANCHMSA-N 2 0 333.520 2.994 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815055780 1287270856 /nfs/dbraw/zinc/27/08/56/1287270856.db2.gz NLJAJUPITCGFLI-IBGZPJMESA-N 2 0 333.520 2.994 20 10 EFCDRP CN1CCCC(C)(C)[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790485465 1277596798 /nfs/dbraw/zinc/59/67/98/1277596798.db2.gz LXEDOXYSLJGZER-HXUWFJFHSA-N 2 0 344.547 2.648 20 10 EFCDRP Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)ccc1N(C)C ZINC000815074257 1287301032 /nfs/dbraw/zinc/30/10/32/1287301032.db2.gz NMHVIFJRPRLKMO-DFQSSKMNSA-N 2 0 331.504 2.745 20 10 EFCDRP C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790934310 1277853327 /nfs/dbraw/zinc/85/33/27/1277853327.db2.gz KHKARUHHZGHOSL-FXAWDEMLSA-N 2 0 331.504 2.564 20 10 EFCDRP C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790934314 1277853427 /nfs/dbraw/zinc/85/34/27/1277853427.db2.gz KHKARUHHZGHOSL-XLIONFOSSA-N 2 0 331.504 2.564 20 10 EFCDRP CC(C)O[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000846016502 1279979701 /nfs/dbraw/zinc/97/97/01/1279979701.db2.gz UWTTVBZXIIXIHY-FQEVSTJZSA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](O)c1ccccc1 ZINC000808446913 1281714990 /nfs/dbraw/zinc/71/49/90/1281714990.db2.gz XLSUJIRPEMJJDE-LAUBAEHRSA-N 2 0 339.483 2.650 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3COc4ccccc43)cc2)CC1 ZINC000808451818 1281716549 /nfs/dbraw/zinc/71/65/49/1281716549.db2.gz YINLAFVHSWYHLY-SFHVURJKSA-N 2 0 337.467 2.704 20 10 EFCDRP CCC[N@H+](CCN1CCCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809701220 1282390092 /nfs/dbraw/zinc/39/00/92/1282390092.db2.gz VZHFKELLXRBODH-UHFFFAOYSA-N 2 0 344.547 2.746 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@H+](Cc3ccccn3)C3CC3)cc2)CC1 ZINC000809764157 1282465263 /nfs/dbraw/zinc/46/52/63/1282465263.db2.gz TYXHZHFAKXWTBE-UHFFFAOYSA-N 2 0 336.483 2.998 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@H]3[C@H]3CCCO3)cc2)CC1 ZINC000811510674 1284390373 /nfs/dbraw/zinc/39/03/73/1284390373.db2.gz MSICSDFXBBWEJZ-WOJBJXKFSA-N 2 0 343.515 2.828 20 10 EFCDRP CC(C)COCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172454722 1286156852 /nfs/dbraw/zinc/15/68/52/1286156852.db2.gz BOVMHTXDPNCGJY-SFHVURJKSA-N 2 0 333.520 2.979 20 10 EFCDRP CC[N@@H+]1CC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C1 ZINC001173356521 1286545142 /nfs/dbraw/zinc/54/51/42/1286545142.db2.gz DTRUOAOPADMJIR-VHKYSDTDSA-N 2 0 341.455 2.523 20 10 EFCDRP CC[N@H+](C)CCC(=O)N[C@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135861642 1288519156 /nfs/dbraw/zinc/51/91/56/1288519156.db2.gz UZLZGRIAUHHHKW-DLBZAZTESA-N 2 0 349.519 2.718 20 10 EFCDRP CCC[N@H+](C)CC(=O)N[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135979025 1288703239 /nfs/dbraw/zinc/70/32/39/1288703239.db2.gz AXIQTWWPPFBFAL-IRXDYDNUSA-N 2 0 349.519 2.718 20 10 EFCDRP COC(=O)c1c(C[NH+]2CCC(C[NH+](C)C)CC2)c2ccccc2n1C ZINC001232408303 1312695776 /nfs/dbraw/zinc/69/57/76/1312695776.db2.gz ZWUVKSOZCWNOEN-UHFFFAOYSA-N 2 0 343.471 2.739 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CSC[C@@H]3C)cc2F)CC1 ZINC000823801483 1289462947 /nfs/dbraw/zinc/46/29/47/1289462947.db2.gz GOQCKVVYMGVKLH-WMLDXEAASA-N 2 0 337.508 2.809 20 10 EFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000873020647 1289524391 /nfs/dbraw/zinc/52/43/91/1289524391.db2.gz YZPOEKXLIARZDK-GOSISDBHSA-N 2 0 342.487 2.762 20 10 EFCDRP CC[N@H+](C)C[C@@H]1CCN(Cc2cc(Br)ccc2O)C1 ZINC000093769917 1291214737 /nfs/dbraw/zinc/21/47/37/1291214737.db2.gz CKGGJKJTUYXNLF-LBPRGKRZSA-N 2 0 327.266 2.928 20 10 EFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cc(C(C)(C)C)ccc1O ZINC001233285935 1312895318 /nfs/dbraw/zinc/89/53/18/1312895318.db2.gz YAOGYNACNDWXBZ-RBUKOAKNSA-N 2 0 345.531 2.900 20 10 EFCDRP COc1ccc(N2CCN(CC[C@@H]3CCCC[N@@H+]3C)CC2)c(OC)c1 ZINC000879463706 1292146257 /nfs/dbraw/zinc/14/62/57/1292146257.db2.gz NGSKLRKBGCAFBT-KRWDZBQOSA-N 2 0 347.503 2.700 20 10 EFCDRP COC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000883290426 1293533626 /nfs/dbraw/zinc/53/36/26/1293533626.db2.gz UTBPBCCDTNYOKH-HXUWFJFHSA-N 2 0 331.504 2.733 20 10 EFCDRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775657775 1293934072 /nfs/dbraw/zinc/93/40/72/1293934072.db2.gz HVTVDNQXFPCKCD-UHFFFAOYSA-N 3 0 344.547 2.745 20 10 EFCDRP CC[N@H+](CCc1ccccn1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775660100 1293942848 /nfs/dbraw/zinc/94/28/48/1293942848.db2.gz ARMXKNOAWGXRAX-UHFFFAOYSA-N 2 0 338.499 2.898 20 10 EFCDRP Cc1ncsc1C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775676353 1294075940 /nfs/dbraw/zinc/07/59/40/1294075940.db2.gz RHMIMYWHLTUBCH-UHFFFAOYSA-N 2 0 330.501 2.835 20 10 EFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775724111 1294272329 /nfs/dbraw/zinc/27/23/29/1294272329.db2.gz GXMXSFBTOFXWIA-FQEVSTJZSA-N 3 0 344.547 2.602 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C4CCOCC4)C3)cc2)CC1 ZINC000775725012 1294285372 /nfs/dbraw/zinc/28/53/72/1294285372.db2.gz FGQVHLACJORFIY-FQEVSTJZSA-N 2 0 343.515 2.687 20 10 EFCDRP CC[NH+](CC)C[C@@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775724888 1294286847 /nfs/dbraw/zinc/28/68/47/1294286847.db2.gz OJCBFBXTJOWXPN-FQEVSTJZSA-N 2 0 344.547 2.602 20 10 EFCDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccc(O)cc4O)C[C@H]3C2)cc1 ZINC001204272640 1313113727 /nfs/dbraw/zinc/11/37/27/1313113727.db2.gz FGMKEXOUQIJDNL-RTBURBONSA-N 2 0 338.451 2.970 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3ccc4c(c3)CC[NH2+]C4)CC2)cc1 ZINC001204622008 1313174123 /nfs/dbraw/zinc/17/41/23/1313174123.db2.gz WHPGICDKNSYTEP-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCC3(CCC[N@@H+](CCN(C)C)C3)CC2)c1 ZINC001275313124 1296255138 /nfs/dbraw/zinc/25/51/38/1296255138.db2.gz AXSJGMIHXIMPAL-UHFFFAOYSA-N 2 0 345.531 2.940 20 10 EFCDRP Cc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c1 ZINC001275315099 1296256083 /nfs/dbraw/zinc/25/60/83/1296256083.db2.gz PNDRCBPFVSMVAK-FQEVSTJZSA-N 2 0 331.504 2.550 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)cc1OC ZINC001235237231 1313271376 /nfs/dbraw/zinc/27/13/76/1313271376.db2.gz KMGCBHHQRVHWCY-MRXNPFEDSA-N 2 0 334.460 2.764 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC1 ZINC001205558998 1313312862 /nfs/dbraw/zinc/31/28/62/1313312862.db2.gz MTEPDAOQPDKIHL-HXUWFJFHSA-N 2 0 347.478 2.744 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@]2(C1)C[NH2+]CC[C@H]2F ZINC001235408517 1313314555 /nfs/dbraw/zinc/31/45/55/1313314555.db2.gz UJVVMIJHNYBBCW-CABCVRRESA-N 2 0 332.341 2.935 20 10 EFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205578614 1313316309 /nfs/dbraw/zinc/31/63/09/1313316309.db2.gz GYUNYPJGERWOAG-AWEZNQCLSA-N 2 0 347.228 2.513 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)c2ccccc2n1C ZINC001205581539 1313316779 /nfs/dbraw/zinc/31/67/79/1313316779.db2.gz VHTPNMNQTKNZKL-IBGZPJMESA-N 2 0 347.434 2.618 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c2ccccc2n1C ZINC001205637895 1313328586 /nfs/dbraw/zinc/32/85/86/1313328586.db2.gz JTHOAGUCOJYASN-LSDHHAIUSA-N 2 0 343.471 2.772 20 10 EFCDRP Cc1cc(Br)c(O)c(CN2CCC(F)(F)[C@@H](C[NH3+])C2)c1 ZINC001205787753 1313356233 /nfs/dbraw/zinc/35/62/33/1313356233.db2.gz IFEXSUJPDLCSSC-NSHDSACASA-N 2 0 349.219 2.879 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CCC[C@@H]1C[NH3+] ZINC001205984259 1313385981 /nfs/dbraw/zinc/38/59/81/1313385981.db2.gz RRKWVXWXAVAGJN-NWDGAFQWSA-N 2 0 327.266 2.962 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c2ccccc2n1C ZINC001206012257 1313390645 /nfs/dbraw/zinc/39/06/45/1313390645.db2.gz JIKFFQJTGRBZML-CABCVRRESA-N 2 0 343.471 2.772 20 10 EFCDRP CCN(CC)c1ccc(CN(CCCOC)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001235805034 1313399813 /nfs/dbraw/zinc/39/98/13/1313399813.db2.gz GLGBXAPOXBTLHX-LJQANCHMSA-N 2 0 349.519 2.829 20 10 EFCDRP COc1cccc(CC[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001235839863 1313407380 /nfs/dbraw/zinc/40/73/80/1313407380.db2.gz BAHPVWQNGYYPHC-UHFFFAOYSA-N 2 0 339.483 2.779 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001235993819 1313428615 /nfs/dbraw/zinc/42/86/15/1313428615.db2.gz RGYGMLAWYWMTLE-UHFFFAOYSA-N 2 0 337.467 2.966 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001236045566 1313433251 /nfs/dbraw/zinc/43/32/51/1313433251.db2.gz WFFNNERCZWHGSB-UHFFFAOYSA-N 2 0 329.488 2.631 20 10 EFCDRP Fc1cccc2c1CC[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001236049111 1313434531 /nfs/dbraw/zinc/43/45/31/1313434531.db2.gz YMHILLQTTMCEMG-UHFFFAOYSA-N 2 0 325.431 2.794 20 10 EFCDRP CCCC[C@@H]1CN(Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC[NH2+]1 ZINC001236138067 1313445713 /nfs/dbraw/zinc/44/57/13/1313445713.db2.gz OPCGNLJIJVMQFD-HXUWFJFHSA-N 2 0 344.547 2.793 20 10 EFCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccccc2N2CC[NH2+]CC2)cc1 ZINC001236189353 1313453752 /nfs/dbraw/zinc/45/37/52/1313453752.db2.gz LPOMYPLJVGMYEQ-UHFFFAOYSA-N 2 0 338.499 2.794 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C)[C@H]3CCCC[C@@H]3[NH3+])cc2)CC1 ZINC001236214335 1313456623 /nfs/dbraw/zinc/45/66/23/1313456623.db2.gz DHDRWSIWOQOAHW-PMACEKPBSA-N 2 0 330.520 2.530 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3ccc(C[NH3+])cc3)CC2)c(C)c1 ZINC001236366389 1313474097 /nfs/dbraw/zinc/47/40/97/1313474097.db2.gz BRAFZMKEPLDHRB-UHFFFAOYSA-N 2 0 325.456 2.785 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c2ccccc2n1C ZINC001206564529 1313477401 /nfs/dbraw/zinc/47/74/01/1313477401.db2.gz QDNJDUVTDFLYFF-HXUWFJFHSA-N 2 0 343.471 2.916 20 10 EFCDRP CCC[NH+](CCC)CCCN1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001236433758 1313480423 /nfs/dbraw/zinc/48/04/23/1313480423.db2.gz LEHOISWRDLQZFT-UHFFFAOYSA-N 2 0 332.536 2.899 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001236434791 1313481050 /nfs/dbraw/zinc/48/10/50/1313481050.db2.gz VTUNJRTULXGQAH-OAQYLSRUSA-N 2 0 343.515 2.877 20 10 EFCDRP CC(C)C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551032 1313490898 /nfs/dbraw/zinc/49/08/98/1313490898.db2.gz JRUDJUTYKWXGBZ-XUTJKUGGSA-N 3 0 344.547 2.824 20 10 EFCDRP CC[NH+]1C[C@H]2CN(Cc3cc(C)cc(Br)c3O)C[C@@H]2C1 ZINC001236670971 1313506832 /nfs/dbraw/zinc/50/68/32/1313506832.db2.gz QYUHCZHQVDHDHW-KBPBESRZSA-N 2 0 339.277 2.847 20 10 EFCDRP CCc1ccc(C[NH+]2CCN(CCC[NH+](CC)CC)CC2)c(O)c1 ZINC001236795312 1313530342 /nfs/dbraw/zinc/53/03/42/1313530342.db2.gz UAYGLCIASYZBTM-UHFFFAOYSA-N 2 0 333.520 2.804 20 10 EFCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(N4CCOCC4)cc3Cl)C2)CC1 ZINC001236919540 1313552876 /nfs/dbraw/zinc/55/28/76/1313552876.db2.gz NHPQESGSYHKUKO-UHFFFAOYSA-N 2 0 349.906 2.704 20 10 EFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3Cl)C[C@@H]2C1 ZINC001236923709 1313554150 /nfs/dbraw/zinc/55/41/50/1313554150.db2.gz ZFOSQSMFCAAVSA-WBVHZDCISA-N 2 0 349.906 2.560 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4[C@H](CC4(F)F)C3)c(F)c2)CC1 ZINC001236936912 1313557359 /nfs/dbraw/zinc/55/73/59/1313557359.db2.gz UJRWYABDDMLMRP-ZBFHGGJFSA-N 2 0 339.405 2.665 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCOC(C)(C)C3)c(F)c2)CC1 ZINC001236940150 1313557384 /nfs/dbraw/zinc/55/73/84/1313557384.db2.gz YMDUVPDXXBKHQP-UHFFFAOYSA-N 2 0 335.467 2.578 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CCC[C@@]1(C)O ZINC001236937011 1313557653 /nfs/dbraw/zinc/55/76/53/1313557653.db2.gz XJUBZLGNNPBBQL-OXQOHEQNSA-N 2 0 349.494 2.560 20 10 EFCDRP CCO[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940867 1313558072 /nfs/dbraw/zinc/55/80/72/1313558072.db2.gz VKNVNVIVBSPLAQ-SFHVURJKSA-N 2 0 335.467 2.578 20 10 EFCDRP CC(C)c1ccc(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)c(O)c1 ZINC001237048457 1313575858 /nfs/dbraw/zinc/57/58/58/1313575858.db2.gz GNWOLINGLZAUCY-UHFFFAOYSA-N 2 0 331.504 2.729 20 10 EFCDRP c1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237405789 1313638853 /nfs/dbraw/zinc/63/88/53/1313638853.db2.gz RWCBVCUFEZVNJE-PMACEKPBSA-N 2 0 325.500 2.959 20 10 EFCDRP c1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237405794 1313638945 /nfs/dbraw/zinc/63/89/45/1313638945.db2.gz RWCBVCUFEZVNJE-VQTJNVASSA-N 2 0 325.500 2.959 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)cc2)CC1 ZINC000854230187 1300479566 /nfs/dbraw/zinc/47/95/66/1300479566.db2.gz JHRLSCBCHAPMEF-NJDAHSKKSA-N 2 0 343.515 2.658 20 10 EFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1cc(F)c(Cl)cc1O ZINC001237950460 1313735734 /nfs/dbraw/zinc/73/57/34/1313735734.db2.gz UWSUNXGKQCRGOT-UHFFFAOYSA-N 2 0 345.890 2.890 20 10 EFCDRP COc1ccc(N2CC[NH+](CC3(C)CC[NH+](C)CC3)CC2)c(OC)c1 ZINC001208111750 1313849560 /nfs/dbraw/zinc/84/95/60/1313849560.db2.gz NXBUPIFLEIXISU-UHFFFAOYSA-N 2 0 347.503 2.558 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CC3(C)CC[NH+](C)CC3)CC2)cc1 ZINC001208112202 1313850248 /nfs/dbraw/zinc/85/02/48/1313850248.db2.gz SRKBOTNWLAEPGO-UHFFFAOYSA-N 2 0 331.504 2.939 20 10 EFCDRP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001276576584 1314000369 /nfs/dbraw/zinc/00/03/69/1314000369.db2.gz JFTMUYRHYGNGIA-AYHJJNSGSA-N 2 0 341.499 2.806 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[NH+]2CCN(CC[NH+](C)C)CC2)cc1 ZINC001209519610 1314178275 /nfs/dbraw/zinc/17/82/75/1314178275.db2.gz YCSLBIXCGSHVPE-UHFFFAOYSA-N 2 0 340.515 2.773 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC34CCOCC4)cc2)CC1 ZINC000800294169 1307668925 /nfs/dbraw/zinc/66/89/25/1307668925.db2.gz ZGUPQCPLBMFDKH-FQEVSTJZSA-N 2 0 343.515 2.877 20 10 EFCDRP Cc1cc(C[N@@H+]2CCNC3(CC[NH2+]CC3)C2)c(C)n1-c1ccccc1 ZINC001222090755 1311082602 /nfs/dbraw/zinc/08/26/02/1311082602.db2.gz JLYSLNYMQUDOET-UHFFFAOYSA-N 2 0 338.499 2.622 20 10 EFCDRP c1c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc2c3c1CCCN3CCC2 ZINC001222149519 1311091888 /nfs/dbraw/zinc/09/18/88/1311091888.db2.gz ZYEQXRHGPRYCPU-OAQYLSRUSA-N 2 0 325.500 2.961 20 10 EFCDRP CCOC(=O)c1c(C[NH+]2CCC(F)(C[NH3+])CC2)c2ccccc2n1C ZINC001222548242 1311151079 /nfs/dbraw/zinc/15/10/79/1311151079.db2.gz CKVSVGJEMNGQMY-UHFFFAOYSA-N 2 0 347.434 2.618 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(F)(C[NH3+])CC2)cc1Br ZINC001222552916 1311151891 /nfs/dbraw/zinc/15/18/91/1311151891.db2.gz LJJJHCPYYWZEEK-UHFFFAOYSA-N 2 0 331.229 2.726 20 10 EFCDRP CCOc1ccc(C[N@@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222615969 1311161522 /nfs/dbraw/zinc/16/15/22/1311161522.db2.gz UOAXNEXRKRLMBR-LJQANCHMSA-N 2 0 338.451 2.980 20 10 EFCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(N4CCOCC4)c(Cl)c3)C2)CC1 ZINC001232199402 1312647083 /nfs/dbraw/zinc/64/70/83/1312647083.db2.gz GNTWYAKAHQLVOU-UHFFFAOYSA-N 2 0 349.906 2.704 20 10 EFCDRP Fc1cccc2c1CC[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246173298 1314593289 /nfs/dbraw/zinc/59/32/89/1314593289.db2.gz LAXMLLVWGFCQHG-SFHVURJKSA-N 2 0 339.458 2.882 20 10 EFCDRP Fc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246177066 1314594185 /nfs/dbraw/zinc/59/41/85/1314594185.db2.gz YTIFRRAXQKPWTC-HXUWFJFHSA-N 2 0 339.458 2.882 20 10 EFCDRP Fc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001246177063 1314594374 /nfs/dbraw/zinc/59/43/74/1314594374.db2.gz YTIFRRAXQKPWTC-FQEVSTJZSA-N 2 0 339.458 2.882 20 10 EFCDRP CC[C@@H]1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H](CC)[NH2+]1 ZINC001246186070 1314594715 /nfs/dbraw/zinc/59/47/15/1314594715.db2.gz WQYQPCBQYDCMOU-RTBURBONSA-N 3 0 344.547 2.837 20 10 EFCDRP C[NH2+]CC[C@H](C)N1CCN(c2ccc(OC(F)(F)F)cc2)CC1 ZINC001246993651 1314726263 /nfs/dbraw/zinc/72/62/63/1314726263.db2.gz IFPDEIQAJWRVOH-ZDUSSCGKSA-N 2 0 331.382 2.705 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CC[NH2+]C4(CCC4)C3)cc2)CC1 ZINC001218310676 1315177137 /nfs/dbraw/zinc/17/71/37/1315177137.db2.gz JKCMCUVXMCRKLY-IBGZPJMESA-N 2 0 329.488 2.882 20 10 EFCDRP C[NH+]1CCC(N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)CC1 ZINC001256200306 1315916592 /nfs/dbraw/zinc/91/65/92/1315916592.db2.gz PCMSAHNPYOQIHT-WOJBJXKFSA-N 2 0 341.455 2.523 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001321024261 1329332476 /nfs/dbraw/zinc/33/24/76/1329332476.db2.gz QIYGDOCVMFWTAJ-ZACQAIPSSA-N 2 0 331.504 2.865 20 10 EFCDRP CCCCC[N@H+](CCO)Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001341523156 1332265039 /nfs/dbraw/zinc/26/50/39/1332265039.db2.gz FPMCSCHPPFEWTI-UHFFFAOYSA-N 2 0 337.483 2.562 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC001346539708 1332654754 /nfs/dbraw/zinc/65/47/54/1332654754.db2.gz FZLQZORWJRVRJL-FQEVSTJZSA-N 2 0 343.515 2.974 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1OC ZINC000849349496 1335597031 /nfs/dbraw/zinc/59/70/31/1335597031.db2.gz BGTHCYMJLZEVDK-OAHLLOKOSA-N 2 0 334.460 2.621 20 10 EFCDRP COc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(O)cc1C ZINC000160336116 713859519 /nfs/dbraw/zinc/85/95/19/713859519.db2.gz ZPRPUKUCCGOSSK-UHFFFAOYSA-N 2 0 348.487 2.786 20 10 EFCDRP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(N2CCOCC2)cc1Cl ZINC000925740842 716202540 /nfs/dbraw/zinc/20/25/40/716202540.db2.gz LYUKHKYMJWZHQF-ZDUSSCGKSA-N 2 0 325.884 2.955 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)CCCOC)cc2F)CC1 ZINC000177972068 718230447 /nfs/dbraw/zinc/23/04/47/718230447.db2.gz IVKQCDKWRLPPGB-MRXNPFEDSA-N 2 0 337.483 2.872 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000161613613 718338605 /nfs/dbraw/zinc/33/86/05/718338605.db2.gz RGVIBFFSFLIBKC-IEBWSBKVSA-N 2 0 329.488 2.880 20 10 EFCDRP [NH3+]C[C@]12CCC[C@H]1C[N@H+](Cc1cc(Br)ccc1O)C2 ZINC000311905419 718963658 /nfs/dbraw/zinc/96/36/58/718963658.db2.gz DEMOMNQNBHIFPR-WFASDCNBSA-N 2 0 325.250 2.716 20 10 EFCDRP C[NH2+]CCC1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000220341630 720874891 /nfs/dbraw/zinc/87/48/91/720874891.db2.gz KTOOBNMDPIBNKV-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3cc(Br)ccc3O)C[C@@H]21 ZINC000220348635 720886777 /nfs/dbraw/zinc/88/67/77/720886777.db2.gz DSRUDECEUIWUIX-LEWSCRJBSA-N 2 0 325.250 2.714 20 10 EFCDRP C[NH+]1CCN(c2ccc(CNCc3c(F)ccc(O)c3F)cc2)CC1 ZINC000895607349 724221832 /nfs/dbraw/zinc/22/18/32/724221832.db2.gz NCWZAEXYZLEZCD-UHFFFAOYSA-N 2 0 347.409 2.712 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[C@@H]([NH3+])[C@@H]4C3)cc2)CC1 ZINC001578940866 1090484031 /nfs/dbraw/zinc/48/40/31/1090484031.db2.gz LJWJMCMVJNMGRN-IOMROCGXSA-N 2 0 343.515 2.861 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3CCC[C@@H]([C@@H](C)[NH3+])C3)cc2)CC1 ZINC001578941088 1090484242 /nfs/dbraw/zinc/48/42/42/1090484242.db2.gz ODJGYOWWGJGRLS-SJLPKXTDSA-N 2 0 331.504 2.861 20 10 EFCDRP COc1cc(Br)cc(C[NH2+]CC2([NH3+])CCCC2)c1O ZINC000849350154 1104581395 /nfs/dbraw/zinc/58/13/95/1104581395.db2.gz SGXLKWHKOPUUSL-UHFFFAOYSA-N 2 0 329.238 2.524 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031489 1105940628 /nfs/dbraw/zinc/94/06/28/1105940628.db2.gz SOEGMBBYBAMGAE-ZWNOBZJWSA-N 2 0 343.265 2.770 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC(NC2CC[NH+](CC3CC3)CC2)CC1 ZINC001168366585 1109774054 /nfs/dbraw/zinc/77/40/54/1109774054.db2.gz XMBNWLKVYXHVBG-UHFFFAOYSA-N 2 0 343.515 2.821 20 10 EFCDRP CC[N@@H+](Cc1cc(C)c(Br)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236410179 1112616027 /nfs/dbraw/zinc/61/60/27/1112616027.db2.gz FQYFINHICNRPQO-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP COc1cc(O)c(CN2CC[C@@H](C[NH+]3CCCCC3)C2)cc1OC ZINC000160296981 239046899 /nfs/dbraw/zinc/04/68/99/239046899.db2.gz NYDSRESNCLVUHR-HNNXBMFYSA-N 2 0 334.460 2.717 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000364452035 242299249 /nfs/dbraw/zinc/29/92/49/242299249.db2.gz WBCRJDMCGQRUEN-SZMVWBNQSA-N 2 0 347.478 2.940 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000370625636 284371781 /nfs/dbraw/zinc/37/17/81/284371781.db2.gz ZHWJDQHHALYBOK-PKOBYXMFSA-N 2 0 344.547 2.962 20 10 EFCDRP CC[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000370637898 288069714 /nfs/dbraw/zinc/06/97/14/288069714.db2.gz VULIJEISYKUYAJ-NQIIRXRSSA-N 2 0 344.547 2.962 20 10 EFCDRP C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)CN1CC[NH+](C)CC1 ZINC000185344228 289689754 /nfs/dbraw/zinc/68/97/54/289689754.db2.gz DJXJXAFNGUUZPE-SJORKVTESA-N 2 0 345.531 2.805 20 10 EFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c1 ZINC000184968431 473286723 /nfs/dbraw/zinc/28/67/23/473286723.db2.gz OPZUKHJBKZLHTB-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185014042 473301601 /nfs/dbraw/zinc/30/16/01/473301601.db2.gz MNFZHHSOLOHWOD-QGZVFWFLSA-N 2 0 345.531 2.949 20 10 EFCDRP CC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(N(C)C)cc1 ZINC000128408129 472447510 /nfs/dbraw/zinc/44/75/10/472447510.db2.gz MBWJXWFWGOCTHK-HXUWFJFHSA-N 2 0 332.536 2.821 20 10 EFCDRP C[NH+]1CCC(CC[NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000105454399 472754780 /nfs/dbraw/zinc/75/47/80/472754780.db2.gz BFXDHLQRLGZFRE-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(N(C)C)cc1 ZINC000132857656 472759377 /nfs/dbraw/zinc/75/93/77/472759377.db2.gz KAQOJBNIGFYUIF-IRXDYDNUSA-N 2 0 331.504 2.904 20 10 EFCDRP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(N(C)C)cc1 ZINC000132858194 472759810 /nfs/dbraw/zinc/75/98/10/472759810.db2.gz KAQOJBNIGFYUIF-IAGOWNOFSA-N 2 0 331.504 2.904 20 10 EFCDRP COc1cccc(C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c1O ZINC000092587381 472943296 /nfs/dbraw/zinc/94/32/96/472943296.db2.gz OEGQGANRVRURCF-HOTGVXAUSA-N 2 0 348.487 2.722 20 10 EFCDRP C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)N1CC[NH+](C)CC1 ZINC000185365580 473406770 /nfs/dbraw/zinc/40/67/70/473406770.db2.gz ZRRYAPXZALVFHK-HOTGVXAUSA-N 2 0 331.504 2.558 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cc1 ZINC000185881782 473537377 /nfs/dbraw/zinc/53/73/77/473537377.db2.gz SGUXPUOGSOQJNS-SFHVURJKSA-N 2 0 332.536 2.648 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000152423542 473561747 /nfs/dbraw/zinc/56/17/47/473561747.db2.gz VROXWKNXEPJONJ-MRXNPFEDSA-N 2 0 329.488 2.738 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1O ZINC000186127685 473596336 /nfs/dbraw/zinc/59/63/36/473596336.db2.gz CFPSLZNNVZSFOR-IRWQIABSSA-N 2 0 336.451 2.950 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000186197318 473613993 /nfs/dbraw/zinc/61/39/93/473613993.db2.gz NMNHNRAHZUAEIZ-AWEZNQCLSA-N 2 0 345.443 2.587 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cn[nH]c3)cc2F)CC1 ZINC000283934164 474530214 /nfs/dbraw/zinc/53/02/14/474530214.db2.gz FERYOHNIJCMGJX-CQSZACIVSA-N 2 0 331.439 2.542 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(N(C)C)cc1 ZINC000271508870 474575778 /nfs/dbraw/zinc/57/57/78/474575778.db2.gz NLRXMFDDQMUSDX-YSSFQJQWSA-N 2 0 331.504 2.781 20 10 EFCDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1 ZINC000284279402 474609281 /nfs/dbraw/zinc/60/92/81/474609281.db2.gz XHNXNCSDKMMCCQ-ROUUACIJSA-N 2 0 333.520 2.932 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273563859 474964757 /nfs/dbraw/zinc/96/47/57/474964757.db2.gz IXVIIHVLBBVLGH-MAUKXSAKSA-N 2 0 333.520 2.933 20 10 EFCDRP COc1ccc(O)c(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000279611237 474982167 /nfs/dbraw/zinc/98/21/67/474982167.db2.gz FSHFMLJVZODTCY-KDURUIRLSA-N 2 0 338.451 2.965 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)Cn2ccnc2C)c1 ZINC000273608544 474988241 /nfs/dbraw/zinc/98/82/41/474988241.db2.gz UYUIYBOGKOPDAH-QWHCGFSZSA-N 2 0 331.416 2.671 20 10 EFCDRP C[C@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1ccc(N2CCCCC2)cc1 ZINC000268879910 475048369 /nfs/dbraw/zinc/04/83/69/475048369.db2.gz HQCJMEJAVPBHOB-FXAWDEMLSA-N 2 0 330.520 2.573 20 10 EFCDRP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000268998040 475119220 /nfs/dbraw/zinc/11/92/20/475119220.db2.gz OGCVTVMOOPNYDF-INIZCTEOSA-N 2 0 349.494 2.923 20 10 EFCDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)CC1 ZINC000369704819 476485503 /nfs/dbraw/zinc/48/55/03/476485503.db2.gz RVRXVKJSCIBNPN-UHFFFAOYSA-N 2 0 343.515 2.831 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1 ZINC000160177509 527869934 /nfs/dbraw/zinc/86/99/34/527869934.db2.gz VRXOZTNGWYEQNV-QGZVFWFLSA-N 2 0 332.536 2.819 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)COC)cc2F)CC1 ZINC000755193093 575559031 /nfs/dbraw/zinc/55/90/31/575559031.db2.gz BYEXAUKDKXZTFI-UHFFFAOYSA-N 2 0 337.483 2.730 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534790 575756556 /nfs/dbraw/zinc/75/65/56/575756556.db2.gz OQYIGFOJHVFLIS-VYDXJSESSA-N 2 0 349.494 2.943 20 10 EFCDRP Cn1nc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000759191345 575886638 /nfs/dbraw/zinc/88/66/38/575886638.db2.gz RPUXOXNUSYUJLH-UHFFFAOYSA-N 2 0 349.482 2.615 20 10 EFCDRP COc1cc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c(O)cc1C ZINC000768446839 577274429 /nfs/dbraw/zinc/27/44/29/577274429.db2.gz OXJDGJCTFWRBIA-UHFFFAOYSA-N 2 0 348.487 2.644 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1cc2c(cc1O)CCCC2 ZINC000768461430 577275548 /nfs/dbraw/zinc/27/55/48/577275548.db2.gz CWNRPXBBYYEAGG-SBHAEUEKSA-N 2 0 344.499 2.955 20 10 EFCDRP CCOc1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c(O)c1 ZINC000769206513 577344459 /nfs/dbraw/zinc/34/44/59/577344459.db2.gz OFLFOBSWMKAJKV-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP Cc1cc(Br)cc([C@@H](C)[NH2+]CCOCC[NH+](C)C)c1O ZINC000774377118 581490473 /nfs/dbraw/zinc/49/04/73/581490473.db2.gz QOAVURKESJJTNR-GFCCVEGCSA-N 2 0 345.281 2.692 20 10 EFCDRP COC(=O)c1ccc([O-])c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000850584679 1250549056 /nfs/dbraw/zinc/54/90/56/1250549056.db2.gz TVDZISIJGQADTG-AWEZNQCLSA-N 2 0 346.471 2.951 20 10 EFCDRP Oc1ccc(F)cc1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000180797138 1252490200 /nfs/dbraw/zinc/49/02/00/1252490200.db2.gz QFBIMCDGIHWCPO-UHFFFAOYSA-N 2 0 336.451 2.856 20 10 EFCDRP CCN1CC[NH+](CCCC[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921526965 1257014482 /nfs/dbraw/zinc/01/44/82/1257014482.db2.gz KPYGNYAACPETOJ-UHFFFAOYSA-N 2 0 331.504 2.519 20 10 EFCDRP CN(C)c1ccc(CN2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000843126340 1260705655 /nfs/dbraw/zinc/70/56/55/1260705655.db2.gz JMNBBPBKGSZXBU-CJNGLKHVSA-N 2 0 327.394 2.955 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)ccc1N(C)C ZINC000923386480 1261594976 /nfs/dbraw/zinc/59/49/76/1261594976.db2.gz BYTMMVSBJULZBG-BJLQDIEVSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)ccc1N(C)C ZINC000923386489 1261594993 /nfs/dbraw/zinc/59/49/93/1261594993.db2.gz BYTMMVSBJULZBG-NSHGMRRFSA-N 2 0 331.504 2.779 20 10 EFCDRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921860686 1262922606 /nfs/dbraw/zinc/92/26/06/1262922606.db2.gz UPDCPKODLOJQFK-PMACEKPBSA-N 2 0 344.499 2.869 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](CO)CC(C)(C)C ZINC000825041032 1278394242 /nfs/dbraw/zinc/39/42/42/1278394242.db2.gz ZFIPXWRDZHRJCM-LJQANCHMSA-N 2 0 333.520 2.667 20 10 EFCDRP CO[C@H]1C[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C12CCC2 ZINC000825104218 1278399599 /nfs/dbraw/zinc/39/95/99/1278399599.db2.gz RGMYYMVQTMHWCE-PMACEKPBSA-N 2 0 343.515 2.828 20 10 EFCDRP CCn1cc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000825129770 1278422425 /nfs/dbraw/zinc/42/24/25/1278422425.db2.gz DPIQZGSVBBTTSI-INIZCTEOSA-N 2 0 327.476 2.506 20 10 EFCDRP Cc1cc(O)c(C[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825261046 1278489906 /nfs/dbraw/zinc/48/99/06/1278489906.db2.gz WXFZSPAEEKTMIF-HNNXBMFYSA-N 2 0 337.895 2.612 20 10 EFCDRP Cc1cc(O)c(C[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000825283139 1278492209 /nfs/dbraw/zinc/49/22/09/1278492209.db2.gz GDMZICZEMCALGP-OAHLLOKOSA-N 2 0 326.868 2.681 20 10 EFCDRP C[N@H+](CCCC1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)cc1 ZINC000844221419 1278797006 /nfs/dbraw/zinc/79/70/06/1278797006.db2.gz ZORBSTISFFDGRV-UHFFFAOYSA-N 2 0 331.504 2.735 20 10 EFCDRP C[NH+]1CCC(CC[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000706875436 1275066926 /nfs/dbraw/zinc/06/69/26/1275066926.db2.gz ZTYVOPDXFRHQIF-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817887759 1276346344 /nfs/dbraw/zinc/34/63/44/1276346344.db2.gz DMGOHFWSUIVMIA-STQMWFEESA-N 2 0 345.409 2.757 20 10 EFCDRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817896148 1276364974 /nfs/dbraw/zinc/36/49/74/1276364974.db2.gz YRJLAHLGTOIIEJ-PMACEKPBSA-N 2 0 331.504 2.645 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC[C@@H]3C[NH3+])cc2F)CC1 ZINC000817902643 1276367028 /nfs/dbraw/zinc/36/70/28/1276367028.db2.gz VVKUIMFIBWJEAN-MJGOQNOKSA-N 3 0 348.510 2.575 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc2F)CC1 ZINC000817902563 1276367231 /nfs/dbraw/zinc/36/72/31/1276367231.db2.gz UIULWYNILYSCHC-INIZCTEOSA-N 3 0 336.499 2.575 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1cc(Br)ccc1O ZINC000817981952 1276419746 /nfs/dbraw/zinc/41/97/46/1276419746.db2.gz OVRBXLMTFWMMKW-GXTWGEPZSA-N 2 0 343.265 2.574 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000817980346 1276419809 /nfs/dbraw/zinc/41/98/09/1276419809.db2.gz AHBVYPOBJJXYKS-JSGCOSHPSA-N 2 0 332.366 2.830 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817981077 1276421660 /nfs/dbraw/zinc/42/16/60/1276421660.db2.gz GUVSTXYQHMDPIL-SOUVJXGZSA-N 2 0 337.895 2.955 20 10 EFCDRP CCC[NH+]1CCC([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 ZINC000818345782 1276513090 /nfs/dbraw/zinc/51/30/90/1276513090.db2.gz XWRSFFFRJMNXTM-QGZVFWFLSA-N 2 0 331.504 2.986 20 10 EFCDRP CN1CCCC(C)(C)[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790485464 1277596316 /nfs/dbraw/zinc/59/63/16/1277596316.db2.gz LXEDOXYSLJGZER-FQEVSTJZSA-N 2 0 344.547 2.648 20 10 EFCDRP Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)ccc1N(C)C ZINC000815074259 1287300336 /nfs/dbraw/zinc/30/03/36/1287300336.db2.gz NMHVIFJRPRLKMO-YSIASYRMSA-N 2 0 331.504 2.745 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c1 ZINC000844902490 1279323948 /nfs/dbraw/zinc/32/39/48/1279323948.db2.gz NZGWKQMLZFJZKP-GMBSWORKSA-N 2 0 334.460 2.509 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c1 ZINC000844902492 1279323990 /nfs/dbraw/zinc/32/39/90/1279323990.db2.gz NZGWKQMLZFJZKP-URLQWDBASA-N 2 0 334.460 2.509 20 10 EFCDRP COCC1(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCC1 ZINC000815148342 1287350372 /nfs/dbraw/zinc/35/03/72/1287350372.db2.gz UACGSHHPAHQGFX-UHFFFAOYSA-N 2 0 331.504 2.735 20 10 EFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H](CC)CO1 ZINC000846026757 1279986967 /nfs/dbraw/zinc/98/69/67/1279986967.db2.gz HFOZHTYOMCBDHH-AZUAARDMSA-N 2 0 331.504 2.828 20 10 EFCDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000872250766 1287501524 /nfs/dbraw/zinc/50/15/24/1287501524.db2.gz ATNIVYFTBIKYJV-INIZCTEOSA-N 2 0 335.467 2.530 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](O)c1ccccc1 ZINC000808446915 1281715262 /nfs/dbraw/zinc/71/52/62/1281715262.db2.gz XLSUJIRPEMJJDE-UWJYYQICSA-N 2 0 339.483 2.650 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCN2CC[NH+](C)CC2)c1O ZINC000808672982 1281857909 /nfs/dbraw/zinc/85/79/09/1281857909.db2.gz IYVIDCJUGBVMPN-CQSZACIVSA-N 2 0 325.884 2.642 20 10 EFCDRP CSC1(C[NH2+]Cc2ccc(N(C)C)c(F)c2)CC[NH+](C)CC1 ZINC000810171033 1282964316 /nfs/dbraw/zinc/96/43/16/1282964316.db2.gz VXPHTIPUSUVQQL-UHFFFAOYSA-N 2 0 325.497 2.809 20 10 EFCDRP Cc1cc(Br)cc(CN2CC[C@H]3[NH2+]CC[C@H]3C2)c1O ZINC000843125784 1286088840 /nfs/dbraw/zinc/08/88/40/1286088840.db2.gz AAYKYEBPFWYRPC-SMDDNHRTSA-N 2 0 325.250 2.647 20 10 EFCDRP COC(=O)CCCC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001173437732 1286571908 /nfs/dbraw/zinc/57/19/08/1286571908.db2.gz PBFOYWZMSZWVFM-KRWDZBQOSA-N 2 0 347.503 2.650 20 10 EFCDRP CC(C)[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)N1CC[NH+](C)CC1 ZINC000816534274 1288193252 /nfs/dbraw/zinc/19/32/52/1288193252.db2.gz CSWXMPWFSFUTGH-HXUWFJFHSA-N 2 0 341.499 2.907 20 10 EFCDRP C[NH+]1CCC(N2CC[C@H]([NH2+]Cc3ccc4ccccc4c3O)C2)CC1 ZINC000816549658 1288199964 /nfs/dbraw/zinc/19/99/64/1288199964.db2.gz VFFJZULXTBVEGW-SFHVURJKSA-N 2 0 339.483 2.804 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc(F)ccc3O)CC2)CC1 ZINC000817413801 1288591124 /nfs/dbraw/zinc/59/11/24/1288591124.db2.gz KVQUFQFICFWMNL-UHFFFAOYSA-N 2 0 335.467 2.523 20 10 EFCDRP CCN1CCC[C@@H]1C[NH2+]Cc1ccc(OC)c(Cn2cccn2)c1 ZINC000873007749 1289515155 /nfs/dbraw/zinc/51/51/55/1289515155.db2.gz DLINDBBUPCMSKT-GOSISDBHSA-N 2 0 328.460 2.514 20 10 EFCDRP CCN1CCC[C@H]1C[NH2+]Cc1ccc(OC)c(Cn2cccn2)c1 ZINC000873007750 1289515560 /nfs/dbraw/zinc/51/55/60/1289515560.db2.gz DLINDBBUPCMSKT-SFHVURJKSA-N 2 0 328.460 2.514 20 10 EFCDRP CN(Cc1cc2c(s1)CC[NH2+]C2)c1ccc(OCC[NH+](C)C)cc1 ZINC000873209000 1289643394 /nfs/dbraw/zinc/64/33/94/1289643394.db2.gz HQQVDAIONFOQGD-UHFFFAOYSA-N 2 0 345.512 2.971 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CC3(CO2)CC[NH2+]CC3)cc1 ZINC000873290157 1289704257 /nfs/dbraw/zinc/70/42/57/1289704257.db2.gz BIUFLPDIBNJDCP-QFBILLFUSA-N 2 0 331.504 2.952 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000877076732 1291126859 /nfs/dbraw/zinc/12/68/59/1291126859.db2.gz QEUCRZYOFMYZAG-UHFFFAOYSA-N 2 0 340.467 2.947 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001205581930 1292800339 /nfs/dbraw/zinc/80/03/39/1292800339.db2.gz VKFGLBDUHJDHRR-CQSZACIVSA-N 2 0 336.329 2.944 20 10 EFCDRP Oc1ccccc1C[N@H+]1CCc2ncc(C[NH+]3CCCCC3)n2CC1 ZINC001203552217 1312953856 /nfs/dbraw/zinc/95/38/56/1312953856.db2.gz FHAGDQAUSPFYRO-UHFFFAOYSA-N 2 0 340.471 2.633 20 10 EFCDRP CCOc1cccc(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c1O ZINC001203616989 1312972451 /nfs/dbraw/zinc/97/24/51/1312972451.db2.gz DXQBPVYEFKPXTF-UHFFFAOYSA-N 2 0 327.428 2.817 20 10 EFCDRP COc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(O)c1 ZINC001203627735 1312975004 /nfs/dbraw/zinc/97/50/04/1312975004.db2.gz MIXIZGLLFGFKEH-RTBURBONSA-N 2 0 338.451 2.965 20 10 EFCDRP COc1ccc(O)c(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001203678021 1312987861 /nfs/dbraw/zinc/98/78/61/1312987861.db2.gz FSHFMLJVZODTCY-OALUTQOASA-N 2 0 338.451 2.965 20 10 EFCDRP Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)n1 ZINC000883289607 1293533034 /nfs/dbraw/zinc/53/30/34/1293533034.db2.gz UUWKEZFPJUAMLD-OAHLLOKOSA-N 2 0 339.487 2.696 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCO)C3CCCCC3)cc2)CC1 ZINC000775634048 1293792590 /nfs/dbraw/zinc/79/25/90/1293792590.db2.gz OBJSXQTYCFOBQN-UHFFFAOYSA-N 2 0 331.504 2.565 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4cc[nH]n4)C3)cc2)CC1 ZINC000775657870 1293934038 /nfs/dbraw/zinc/93/40/38/1293934038.db2.gz ANYHSDIAFFDAPE-GOSISDBHSA-N 2 0 339.487 2.541 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)cc2)CC1 ZINC000775659628 1293943354 /nfs/dbraw/zinc/94/33/54/1293943354.db2.gz ZOQNUOZPTOISQC-SFHVURJKSA-N 2 0 339.487 2.541 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCO[C@H](c4ccco4)C3)cc2)CC1 ZINC000775734712 1294323096 /nfs/dbraw/zinc/32/30/96/1294323096.db2.gz XSIOZZZDTVAZMQ-FQEVSTJZSA-N 2 0 341.455 2.605 20 10 EFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3c(O)ccc4ccc(OC)cc43)C[C@H]2C1 ZINC001234570279 1313160622 /nfs/dbraw/zinc/16/06/22/1313160622.db2.gz XUHXWAXYTVGMTP-HZPDHXFCSA-N 2 0 326.440 2.938 20 10 EFCDRP CCC[NH+]1CCC([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)CC1 ZINC000305101705 1295910116 /nfs/dbraw/zinc/91/01/16/1295910116.db2.gz BNFAZUCIFSXAMY-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN1CC[NH+](C2CCCCC2)CC1 ZINC001204854242 1313203810 /nfs/dbraw/zinc/20/38/10/1313203810.db2.gz JNAZKLVKIXBCNA-UHFFFAOYSA-N 2 0 342.531 2.547 20 10 EFCDRP C[NH+](C)CCN1CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234992825 1313219010 /nfs/dbraw/zinc/21/90/10/1313219010.db2.gz SBECJEZLIJZAEU-UHFFFAOYSA-N 2 0 339.483 2.738 20 10 EFCDRP Cc1c(CN2CCOC[C@@]3(CCC[NH2+]C3)C2)c2ccccc2n1C ZINC001235008761 1313222552 /nfs/dbraw/zinc/22/25/52/1313222552.db2.gz QPZQTSXMXOZFDR-HXUWFJFHSA-N 2 0 327.472 2.689 20 10 EFCDRP Cc1ccc(O)c(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c1 ZINC001275315102 1296255066 /nfs/dbraw/zinc/25/50/66/1296255066.db2.gz PNDRCBPFVSMVAK-HXUWFJFHSA-N 2 0 331.504 2.550 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@](O)(C[NH3+])CC2)c(C)n1-c1ccccc1 ZINC001205219440 1313253077 /nfs/dbraw/zinc/25/30/77/1313253077.db2.gz DBERONIAPXGYAV-HXUWFJFHSA-N 2 0 327.472 2.770 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001275802774 1296413300 /nfs/dbraw/zinc/41/33/00/1296413300.db2.gz NSOAMWRPKHTSHN-AEFFLSMTSA-N 2 0 345.531 2.757 20 10 EFCDRP [NH3+]C[C@@]1(O)CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001205248773 1313258744 /nfs/dbraw/zinc/25/87/44/1313258744.db2.gz SPNMCUHPEHIJKN-HXUWFJFHSA-N 2 0 326.440 2.735 20 10 EFCDRP [NH3+]C[C@]1(O)CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001205248771 1313258844 /nfs/dbraw/zinc/25/88/44/1313258844.db2.gz SPNMCUHPEHIJKN-FQEVSTJZSA-N 2 0 326.440 2.735 20 10 EFCDRP Cc1ccc(C)c(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c1O ZINC001275968920 1296464004 /nfs/dbraw/zinc/46/40/04/1296464004.db2.gz SMOGMQGWWBGALU-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc(Br)ccc2O)CC1 ZINC001205545826 1313310216 /nfs/dbraw/zinc/31/02/16/1313310216.db2.gz NQOKRWYEEBFSGP-AWEZNQCLSA-N 2 0 331.229 2.808 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc(Br)ccc2O)CC[C@H]1C[NH3+] ZINC001205602676 1313321379 /nfs/dbraw/zinc/32/13/79/1313321379.db2.gz LKTVYNSLWVMLQH-RYUDHWBXSA-N 2 0 327.266 2.962 20 10 EFCDRP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001205726866 1313345900 /nfs/dbraw/zinc/34/59/00/1313345900.db2.gz YUCDRZGIYOLOLL-FQEVSTJZSA-N 2 0 344.430 2.874 20 10 EFCDRP CCN(CC)c1ccc(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(O)c1 ZINC001205767896 1313352721 /nfs/dbraw/zinc/35/27/21/1313352721.db2.gz CABVZTMVSDVMGP-CQSZACIVSA-N 2 0 327.419 2.654 20 10 EFCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCC(F)(F)[C@H](C[NH3+])C3)c2c1 ZINC001205788672 1313355906 /nfs/dbraw/zinc/35/59/06/1313355906.db2.gz PQBBYNURGSLISD-CYBMUJFWSA-N 2 0 336.382 2.970 20 10 EFCDRP Cc1cc(Br)c(O)c(CN2CCC(F)(F)[C@H](C[NH3+])C2)c1 ZINC001205787752 1313356170 /nfs/dbraw/zinc/35/61/70/1313356170.db2.gz IFEXSUJPDLCSSC-LLVKDONJSA-N 2 0 349.219 2.879 20 10 EFCDRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 ZINC000776257498 1297289096 /nfs/dbraw/zinc/28/90/96/1297289096.db2.gz LXOLEXANVCIHQN-UHFFFAOYSA-N 2 0 344.459 2.937 20 10 EFCDRP C[NH+](C)CCCN1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235681212 1313372929 /nfs/dbraw/zinc/37/29/29/1313372929.db2.gz ZJNXJSGYSNADKU-UHFFFAOYSA-N 2 0 333.520 2.759 20 10 EFCDRP C[NH2+]CC1CC[NH+](Cc2cc(Br)c(C)cc2O)CC1 ZINC001235679772 1313373010 /nfs/dbraw/zinc/37/30/10/1313373010.db2.gz NLTIZVIRLFSESD-UHFFFAOYSA-N 2 0 327.266 2.895 20 10 EFCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c1 ZINC001235821588 1313405096 /nfs/dbraw/zinc/40/50/96/1313405096.db2.gz KDSQUAHBGRBRGP-UHFFFAOYSA-N 2 0 345.531 2.949 20 10 EFCDRP COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC[C@H]2CCC[NH2+]C2)C1 ZINC001235839437 1313407534 /nfs/dbraw/zinc/40/75/34/1313407534.db2.gz RPIDRXWRQIFHNV-OAHLLOKOSA-N 2 0 327.472 2.935 20 10 EFCDRP Cc1cccc(CC[N@@H+](C)Cc2cc3c(cc2O)OCC[NH2+]C3)c1 ZINC001235839440 1313407594 /nfs/dbraw/zinc/40/75/94/1313407594.db2.gz RWMOXWOLYGCRRS-UHFFFAOYSA-N 2 0 326.440 2.857 20 10 EFCDRP CCOC(=O)c1c(C[N@@H+]2CCC[C@H]2CC[NH3+])c2ccccc2n1C ZINC001235925193 1313418837 /nfs/dbraw/zinc/41/88/37/1313418837.db2.gz DQUXAQPWLBVIOC-AWEZNQCLSA-N 2 0 329.444 2.668 20 10 EFCDRP C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236072118 1313437943 /nfs/dbraw/zinc/43/79/43/1313437943.db2.gz OEQHUSXONKBSTM-INIZCTEOSA-N 2 0 337.467 2.749 20 10 EFCDRP CCCCN(CCCC)c1ccc(C[N@@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)c(O)c1 ZINC001206491219 1313463889 /nfs/dbraw/zinc/46/38/89/1313463889.db2.gz IKEVISAPPXZIQJ-FXAWDEMLSA-N 2 0 349.519 2.550 20 10 EFCDRP Clc1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)ccc1N1CCOCC1 ZINC001236321432 1313468942 /nfs/dbraw/zinc/46/89/42/1313468942.db2.gz JSASHSGCJSHOGR-CALCHBBNSA-N 2 0 349.906 2.608 20 10 EFCDRP COc1ccc(N2CC[NH+](CC3CC4(C3)CC[NH2+]CC4)CC2)c(C)c1 ZINC001236367350 1313474027 /nfs/dbraw/zinc/47/40/27/1313474027.db2.gz OCALDWANXXTTDF-UHFFFAOYSA-N 2 0 343.515 2.905 20 10 EFCDRP CCOc1ccc(N2CC[NH+](Cc3ccc(C[NH3+])cc3)CC2)cc1 ZINC001236433683 1313480366 /nfs/dbraw/zinc/48/03/66/1313480366.db2.gz KFNLVIHEHNJYBB-UHFFFAOYSA-N 2 0 325.456 2.866 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CCOC[C@@H]1C1CCCCC1)C[NH2+]CCO2 ZINC001236433323 1313480399 /nfs/dbraw/zinc/48/03/99/1313480399.db2.gz GXDSJRHUYXOUAT-GOSISDBHSA-N 2 0 346.471 2.655 20 10 EFCDRP O=C(c1ccccc1)[C@H]1CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001236434830 1313480879 /nfs/dbraw/zinc/48/08/79/1313480879.db2.gz WVPKVSCEWHITIE-FQEVSTJZSA-N 2 0 349.478 2.801 20 10 EFCDRP CC(C)N(Cc1cc2c3c(c1O)CCCN3CCC2)[C@H]1CC[NH2+]C1 ZINC001236530438 1313488930 /nfs/dbraw/zinc/48/89/30/1313488930.db2.gz QCLSFPNYRYBABC-KRWDZBQOSA-N 2 0 329.488 2.663 20 10 EFCDRP C[N@@H+](Cc1cc(O)c(Br)cc1O)CC1CC[NH+](C)CC1 ZINC001236776387 1313527067 /nfs/dbraw/zinc/52/70/67/1313527067.db2.gz WLDHOZSJQNUVNS-UHFFFAOYSA-N 2 0 343.265 2.634 20 10 EFCDRP C[NH+](C)CCN(Cc1cccc(C(C)(C)C)c1O)[C@H]1CCC[NH2+]C1 ZINC001236930424 1313555622 /nfs/dbraw/zinc/55/56/22/1313555622.db2.gz AMKMIBGHNPJQHL-KRWDZBQOSA-N 2 0 333.520 2.805 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(C(F)(F)F)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236931457 1313555869 /nfs/dbraw/zinc/55/58/69/1313555869.db2.gz HILGGAKOHOTESJ-OAHLLOKOSA-N 2 0 345.409 2.527 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[C@@]1(C)O ZINC001236932436 1313556114 /nfs/dbraw/zinc/55/61/14/1313556114.db2.gz OSMPFZAHXBCEIH-OXJNMPFZSA-N 2 0 349.494 2.560 20 10 EFCDRP COCCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236940423 1313557156 /nfs/dbraw/zinc/55/71/56/1313557156.db2.gz QSUSIBHSEGETHW-UHFFFAOYSA-N 2 0 349.494 2.826 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]4(CC4(F)F)C3)c(F)c2)CC1 ZINC001236938849 1313557178 /nfs/dbraw/zinc/55/71/78/1313557178.db2.gz OKQBHFMDSKPTIO-KRWDZBQOSA-N 2 0 339.405 2.809 20 10 EFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C[C@@H]1CCCCO1 ZINC001236938059 1313557519 /nfs/dbraw/zinc/55/75/19/1313557519.db2.gz IXDHDZFUMUFLOX-SFHVURJKSA-N 2 0 335.467 2.578 20 10 EFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CCC[C@@]1(C)O ZINC001236937010 1313557713 /nfs/dbraw/zinc/55/77/13/1313557713.db2.gz XJUBZLGNNPBBQL-OXJNMPFZSA-N 2 0 349.494 2.560 20 10 EFCDRP CO[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)C1 ZINC001236944807 1313558607 /nfs/dbraw/zinc/55/86/07/1313558607.db2.gz GEOIFUZTXBYONK-MAUKXSAKSA-N 2 0 335.467 2.577 20 10 EFCDRP CC(C)[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCOCC1 ZINC001236947394 1313559219 /nfs/dbraw/zinc/55/92/19/1313559219.db2.gz RCUSNFAFLLFRGU-UHFFFAOYSA-N 2 0 349.494 2.967 20 10 EFCDRP CCOc1ccc(C[NH+]2CCN(c3cc[nH+]c(C)c3)CC2)c(O)c1 ZINC001237048553 1313576077 /nfs/dbraw/zinc/57/60/77/1313576077.db2.gz TZWBLWJRKLQQTF-UHFFFAOYSA-N 2 0 327.428 2.817 20 10 EFCDRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C2)C1 ZINC001237060641 1313578649 /nfs/dbraw/zinc/57/86/49/1313578649.db2.gz WLHZGYJGTDNTLV-MRXNPFEDSA-N 2 0 344.377 2.861 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC001237204674 1313605214 /nfs/dbraw/zinc/60/52/14/1313605214.db2.gz NEGNDSVHNHTFJX-UHFFFAOYSA-N 2 0 329.488 2.958 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237390497 1313634884 /nfs/dbraw/zinc/63/48/84/1313634884.db2.gz IRXDQVSWMDNDEU-QFBILLFUSA-N 2 0 341.499 2.665 20 10 EFCDRP Oc1cc(O)c(C[NH+]2CCC3(C[NH+](C4CCCC4)C3)CC2)cc1O ZINC001276516416 1313637249 /nfs/dbraw/zinc/63/72/49/1313637249.db2.gz BFJLLHZIFILYDZ-UHFFFAOYSA-N 2 0 332.444 2.644 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cccc1OC(F)(F)F ZINC001237415855 1313641522 /nfs/dbraw/zinc/64/15/22/1313641522.db2.gz OQRYHHSKABTVNP-AAEUAGOBSA-N 2 0 330.350 2.865 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cccc1OC(F)(F)F ZINC001237415856 1313641594 /nfs/dbraw/zinc/64/15/94/1313641594.db2.gz OQRYHHSKABTVNP-DGCLKSJQSA-N 2 0 330.350 2.865 20 10 EFCDRP COC(=O)CCN(CCC[NH+](C)C)Cc1cc(F)c(Cl)cc1O ZINC001237938130 1313733867 /nfs/dbraw/zinc/73/38/67/1313733867.db2.gz YKXHRFKPFYBNDF-UHFFFAOYSA-N 2 0 346.830 2.502 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4c(O)cccc4C3)cc2)CC1 ZINC000862528889 1302406053 /nfs/dbraw/zinc/40/60/53/1302406053.db2.gz DQYXGGPTSPBRKW-UHFFFAOYSA-N 2 0 337.467 2.702 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc2c3c1CCCN3CCC2 ZINC001222149507 1311091875 /nfs/dbraw/zinc/09/18/75/1311091875.db2.gz ZPLHKBKKAMDPDD-OAQYLSRUSA-N 2 0 341.499 2.667 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@@]34CCC[NH2+]C4)cc2)CC1 ZINC001222242162 1311103864 /nfs/dbraw/zinc/10/38/64/1311103864.db2.gz BZXRXUBPAGSYHW-OAQYLSRUSA-N 2 0 342.531 2.547 20 10 EFCDRP Oc1c(C[N@@H+]2CCN[C@H]3CC[NH2+]CC[C@@H]32)cccc1-c1ccccc1 ZINC001222506984 1311144285 /nfs/dbraw/zinc/14/42/85/1311144285.db2.gz LANPHUJIJNGVIC-PMACEKPBSA-N 2 0 337.467 2.585 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)[NH+](C)C)cc1 ZINC000902518333 1311827667 /nfs/dbraw/zinc/82/76/67/1311827667.db2.gz PDQKPDULGHVMBV-BURNTYAHSA-N 2 0 344.547 2.866 20 10 EFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(C)c1O)C2 ZINC001231591400 1312529025 /nfs/dbraw/zinc/52/90/25/1312529025.db2.gz BSUXPTURGCLUMJ-FPOVZHCZSA-N 2 0 344.499 2.881 20 10 EFCDRP COc1cc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(O)cc1O ZINC001231637030 1312536775 /nfs/dbraw/zinc/53/67/75/1312536775.db2.gz DARJWTTWOOCFDE-JKSUJKDBSA-N 2 0 334.460 2.945 20 10 EFCDRP C[N@@H+]1CC[C@@]2(CCN(Cc3ccc(N4CCOCC4)c(Cl)c3)C2)C1 ZINC001232199064 1312646804 /nfs/dbraw/zinc/64/68/04/1312646804.db2.gz BCKSZNAOXKCRQZ-LJQANCHMSA-N 2 0 349.906 2.704 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2ccccc2c1O ZINC001276373838 1314574785 /nfs/dbraw/zinc/57/47/85/1314574785.db2.gz LBXHNVXPPLPSLJ-KDURUIRLSA-N 2 0 339.483 2.756 20 10 EFCDRP COc1cccc(C[C@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001246174997 1314593153 /nfs/dbraw/zinc/59/31/53/1314593153.db2.gz RELIPZJJQIJXGE-KRWDZBQOSA-N 2 0 339.483 2.826 20 10 EFCDRP C[C@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246173399 1314593613 /nfs/dbraw/zinc/59/36/13/1314593613.db2.gz LXHKYYBOSGUEAK-MRXNPFEDSA-N 2 0 327.447 2.956 20 10 EFCDRP CCCC[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[NH2+]1 ZINC001246184722 1314594608 /nfs/dbraw/zinc/59/46/08/1314594608.db2.gz OOXLKLXQHRVXFZ-UXHICEINSA-N 3 0 344.547 2.839 20 10 EFCDRP c1ccn(-c2ccc(-c3nnc([C@@H]4C[NH2+]CC45CC[NH2+]CC5)o3)cc2)c1 ZINC001217707315 1315104700 /nfs/dbraw/zinc/10/47/00/1315104700.db2.gz ZQKZPYSYGBLFAC-KRWDZBQOSA-N 2 0 349.438 2.584 20 10 EFCDRP c1ccc(C[N@@H+]2CC[C@@H](Oc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001217946138 1315123459 /nfs/dbraw/zinc/12/34/59/1315123459.db2.gz NPVQVJZQGICJGN-OAQYLSRUSA-N 2 0 337.467 2.750 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1cc3ccccc3cc1O)C2 ZINC001276811879 1315390804 /nfs/dbraw/zinc/39/08/04/1315390804.db2.gz AHIXMBVTDRRQBH-UZLBHIALSA-N 2 0 339.483 2.613 20 10 EFCDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000904405059 1324875414 /nfs/dbraw/zinc/87/54/14/1324875414.db2.gz ICLXJVHBLNBISS-HNNXBMFYSA-N 2 0 332.448 2.756 20 10 EFCDRP COc1cc(C[N@@H+]2CCN(c3cc[nH+]cc3)C[C@H]2C)c(O)cc1C ZINC001337238395 1331552974 /nfs/dbraw/zinc/55/29/74/1331552974.db2.gz VYXHISOTSNRSLM-OAHLLOKOSA-N 2 0 327.428 2.815 20 10 EFCDRP C[C@H]([NH2+]Cc1ccccc1N1CC[NH+](C)CC1)c1ccccc1O ZINC001337613324 1331587435 /nfs/dbraw/zinc/58/74/35/1331587435.db2.gz VOESTHSWTSAECJ-INIZCTEOSA-N 2 0 325.456 2.995 20 10 EFCDRP CC[C@@H]1CO[C@@H](C)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001341523429 1332265126 /nfs/dbraw/zinc/26/51/26/1332265126.db2.gz BFKPFFHVWVDNSB-DOTOQJQBSA-N 2 0 335.467 2.577 20 10 EFCDRP CCc1cccc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000848890667 1334964370 /nfs/dbraw/zinc/96/43/70/1334964370.db2.gz TXUNRHDZQDQDKX-UHFFFAOYSA-N 2 0 345.531 2.945 20 10 EFCDRP CCC(C)(C)[NH2+][C@@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891247447 714135148 /nfs/dbraw/zinc/13/51/48/714135148.db2.gz HJLKKNUBVIONQT-MAUKXSAKSA-N 2 0 348.535 2.638 20 10 EFCDRP CCC(C)(C)[NH2+][C@@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000891247451 714135199 /nfs/dbraw/zinc/13/51/99/714135199.db2.gz HJLKKNUBVIONQT-YJBOKZPZSA-N 2 0 348.535 2.638 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)CCCOC)cc2F)CC1 ZINC000177972053 718230513 /nfs/dbraw/zinc/23/05/13/718230513.db2.gz IVKQCDKWRLPPGB-INIZCTEOSA-N 2 0 337.483 2.872 20 10 EFCDRP Cc1nccn1CCCC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000162714628 718362841 /nfs/dbraw/zinc/36/28/41/718362841.db2.gz RBYBMFNADGQBQQ-UHFFFAOYSA-N 2 0 342.487 2.940 20 10 EFCDRP C[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1CCC[NH+](C)C1 ZINC000092253336 719435867 /nfs/dbraw/zinc/43/58/67/719435867.db2.gz SMHNNRYUFCTKGK-GFCCVEGCSA-N 2 0 327.266 2.928 20 10 EFCDRP COc1ccc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)c(O)c1OC ZINC000893331874 720699967 /nfs/dbraw/zinc/69/99/67/720699967.db2.gz PIFRNGOCWQHSFY-UHFFFAOYSA-N 2 0 330.428 2.761 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccnc(Cl)c3F)cc2)CC1 ZINC000895607070 724221235 /nfs/dbraw/zinc/22/12/35/724221235.db2.gz KLRCLIRDIFSJIG-UHFFFAOYSA-N 2 0 348.853 2.916 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(O)c1 ZINC000895607755 724221850 /nfs/dbraw/zinc/22/18/50/724221850.db2.gz BHOFYGJHOFUYLC-UHFFFAOYSA-N 2 0 325.456 2.742 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H](C)C3CC[NH+](C)CC3)CC2)cc1 ZINC000157452585 728151879 /nfs/dbraw/zinc/15/18/79/728151879.db2.gz WLHGTEXDOZGUPA-INIZCTEOSA-N 2 0 331.504 2.984 20 10 EFCDRP COC1CCN(c2ccc(C[NH2+][C@@H](C)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001578941235 1090483983 /nfs/dbraw/zinc/48/39/83/1090483983.db2.gz QCUVKELLPAEDBO-FUHWJXTLSA-N 2 0 331.504 2.780 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC001580888744 1091035909 /nfs/dbraw/zinc/03/59/09/1091035909.db2.gz XVZLFMFUXZVUTJ-MPKXVKKWSA-N 2 0 325.250 2.632 20 10 EFCDRP Cc1cc(N(C)C)[nH+]cc1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167434282 1101662706 /nfs/dbraw/zinc/66/27/06/1101662706.db2.gz GUQIYGTYNYTKCR-UHFFFAOYSA-N 2 0 339.487 2.820 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCC([NH2+]C4CCC4)CC3)cc2)CC1 ZINC000897980660 1106183792 /nfs/dbraw/zinc/18/37/92/1106183792.db2.gz BLTVQAYYYXOEGH-UHFFFAOYSA-N 2 0 342.531 2.545 20 10 EFCDRP [NH3+]CC1(c2ccccc2)CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000904458720 1107954455 /nfs/dbraw/zinc/95/44/55/1107954455.db2.gz GJRBNMIAUDANCP-UHFFFAOYSA-N 2 0 340.423 2.613 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185022270 1119685138 /nfs/dbraw/zinc/68/51/38/1119685138.db2.gz UWMDKVXKIZDNOT-IAGOWNOFSA-N 2 0 345.531 2.948 20 10 EFCDRP CC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccccc1O ZINC000155181322 529633517 /nfs/dbraw/zinc/63/35/17/529633517.db2.gz AKBDEFGRLAKOOP-SFHVURJKSA-N 2 0 340.471 2.780 20 10 EFCDRP COc1cc(O)c(CN2CCC[C@H]([NH+]3CCCC3)CC2)cc1OC ZINC000160275258 239049174 /nfs/dbraw/zinc/04/91/74/239049174.db2.gz YUGHXCAPLSEQLW-INIZCTEOSA-N 2 0 334.460 2.860 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCSC3)cc2F)CC1 ZINC000278531797 240813607 /nfs/dbraw/zinc/81/36/07/240813607.db2.gz RTZRLCIYOYKGRX-MRXNPFEDSA-N 2 0 337.508 2.810 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@H]3O)CC1)CC2 ZINC000296245744 241078295 /nfs/dbraw/zinc/07/82/95/241078295.db2.gz AYYQGYWWJRBPLI-KZNAEPCWSA-N 2 0 330.472 2.737 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@H]3O)CC1)CC2 ZINC000296245724 241078697 /nfs/dbraw/zinc/07/86/97/241078697.db2.gz AYYQGYWWJRBPLI-FGTMMUONSA-N 2 0 330.472 2.737 20 10 EFCDRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCc3cccc(O)c32)ccn1 ZINC000297080116 241110999 /nfs/dbraw/zinc/11/09/99/241110999.db2.gz WSYKALLQAUFMTL-INIZCTEOSA-N 2 0 327.428 2.505 20 10 EFCDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297165829 241113357 /nfs/dbraw/zinc/11/33/57/241113357.db2.gz DCISCRQJNQQYRX-KRWDZBQOSA-N 2 0 341.455 2.895 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000363785103 299386556 /nfs/dbraw/zinc/38/65/56/299386556.db2.gz ODPZJTBSYYSEKJ-FUHWJXTLSA-N 2 0 330.520 2.572 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000162560000 533384061 /nfs/dbraw/zinc/38/40/61/533384061.db2.gz ULRRRYPZIIFFPT-LJQANCHMSA-N 2 0 344.547 2.965 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)N1CC[NH+](C)CC1 ZINC000184976998 473288972 /nfs/dbraw/zinc/28/89/72/473288972.db2.gz MSDMICLADWHTOF-PBHICJAKSA-N 2 0 339.911 2.968 20 10 EFCDRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000184983044 473291578 /nfs/dbraw/zinc/29/15/78/473291578.db2.gz JEMZXXZYDXJCRZ-CYBMUJFWSA-N 2 0 325.884 2.722 20 10 EFCDRP CC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(N(C)C)cc1 ZINC000150975701 473391274 /nfs/dbraw/zinc/39/12/74/473391274.db2.gz RJYRDWTUKURHTB-HXUWFJFHSA-N 2 0 332.536 2.819 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cnn(C)c3)cc2F)CC1 ZINC000155285681 472528151 /nfs/dbraw/zinc/52/81/51/472528151.db2.gz MFQDZTGAMGHFGX-OAHLLOKOSA-N 2 0 345.466 2.552 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cccn3C)cc2F)CC1 ZINC000119139902 472530912 /nfs/dbraw/zinc/53/09/12/472530912.db2.gz PIFNVABMIYAZGE-UHFFFAOYSA-N 2 0 330.451 2.596 20 10 EFCDRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000090937166 472667178 /nfs/dbraw/zinc/66/71/78/472667178.db2.gz NQJOTLJMMGTJEU-INIZCTEOSA-N 2 0 342.487 2.939 20 10 EFCDRP C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)CN1CC[NH+](C)CC1 ZINC000185343706 473398859 /nfs/dbraw/zinc/39/88/59/473398859.db2.gz MBZPCXTXBGMPQL-ZIAGYGMSSA-N 2 0 325.884 2.580 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc2ccccc2c1O ZINC000185364540 473407375 /nfs/dbraw/zinc/40/73/75/473407375.db2.gz AIVOLFJFRGBWGR-JKSUJKDBSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185392430 473414252 /nfs/dbraw/zinc/41/42/52/473414252.db2.gz MXVLQJVZBSXBOG-HOTGVXAUSA-N 2 0 327.472 2.832 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)ccc1O)CC1CC[NH2+]CC1 ZINC000178976679 473602960 /nfs/dbraw/zinc/60/29/60/473602960.db2.gz WFWODSJRAROMJU-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c(O)c1 ZINC000186197444 473613526 /nfs/dbraw/zinc/61/35/26/473613526.db2.gz RNDDIBFWBOLEGB-OAHLLOKOSA-N 2 0 329.444 2.887 20 10 EFCDRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc2c(cc1O)CCCC2 ZINC000282311509 474019329 /nfs/dbraw/zinc/01/93/29/474019329.db2.gz NBEZJRDADZJUGC-INIZCTEOSA-N 2 0 345.531 2.948 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000282462023 474074978 /nfs/dbraw/zinc/07/49/78/474074978.db2.gz TZTVSORTVGFSFS-UHFFFAOYSA-N 2 0 332.536 2.648 20 10 EFCDRP Cc1cccc(C[N@@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000190310314 474575704 /nfs/dbraw/zinc/57/57/04/474575704.db2.gz HDXAGJTWFLHYGC-NRFANRHFSA-N 2 0 340.467 2.769 20 10 EFCDRP COc1c(O)c(CN2CCC([NH+]3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000278296954 474606908 /nfs/dbraw/zinc/60/69/08/474606908.db2.gz VKUZKRYOXPNZCS-UHFFFAOYSA-N 2 0 349.431 2.759 20 10 EFCDRP CCCOc1ccc(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)c(O)c1 ZINC000268416006 474967217 /nfs/dbraw/zinc/96/72/17/474967217.db2.gz JSIQJIGWLNUKNK-UHFFFAOYSA-N 2 0 336.476 2.506 20 10 EFCDRP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000756399128 575731222 /nfs/dbraw/zinc/73/12/22/575731222.db2.gz MLTKFNFJRXPTPL-MRXNPFEDSA-N 2 0 345.531 2.948 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CC(C)(C)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756400028 575731231 /nfs/dbraw/zinc/73/12/31/575731231.db2.gz UHHYGYUYNVYSRC-HIFRSBDPSA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Cl)ccc1O ZINC000756408489 575732577 /nfs/dbraw/zinc/73/25/77/575732577.db2.gz OPBKNMBFXQZAQA-AWEZNQCLSA-N 2 0 325.884 2.724 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756412938 575733836 /nfs/dbraw/zinc/73/38/36/575733836.db2.gz WKQAPNILJMEGFB-SQWLQELKSA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2c1c(F)ccc2O ZINC000756565117 575763221 /nfs/dbraw/zinc/76/32/21/575763221.db2.gz VONBHCCLYSBNJI-FMKPAKJESA-N 2 0 336.451 2.906 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(O)c1 ZINC000767729943 577230800 /nfs/dbraw/zinc/23/08/00/577230800.db2.gz XCDBJYGGQPTIRS-INIZCTEOSA-N 2 0 325.456 2.995 20 10 EFCDRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000768231829 577261986 /nfs/dbraw/zinc/26/19/86/577261986.db2.gz ZSTGMLIHEYSTIG-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C ZINC000769471336 577364940 /nfs/dbraw/zinc/36/49/40/577364940.db2.gz SSAQJWCBMNXSNK-FXAWDEMLSA-N 2 0 331.504 2.828 20 10 EFCDRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769513591 577368804 /nfs/dbraw/zinc/36/88/04/577368804.db2.gz CGKVJVWGRARBSJ-FQEVSTJZSA-N 2 0 343.515 2.687 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000770006611 577397457 /nfs/dbraw/zinc/39/74/57/577397457.db2.gz YZQRXHCPLROPPV-IIAWOOMASA-N 2 0 335.467 2.695 20 10 EFCDRP CCCC(O)(CCC)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771840039 581249296 /nfs/dbraw/zinc/24/92/96/581249296.db2.gz DDPCZYAKRQZRSQ-UHFFFAOYSA-N 2 0 333.520 2.859 20 10 EFCDRP CCC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCOCC1 ZINC000771844467 581249887 /nfs/dbraw/zinc/24/98/87/581249887.db2.gz VXPYLFXQTVHJBB-UHFFFAOYSA-N 2 0 331.504 2.735 20 10 EFCDRP COc1cccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1O ZINC000850361970 1250451306 /nfs/dbraw/zinc/45/13/06/1250451306.db2.gz GSMNRHPSKBUJLY-UHFFFAOYSA-N 2 0 341.455 2.798 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850420003 1250477804 /nfs/dbraw/zinc/47/78/04/1250477804.db2.gz JRQRFJOFTMMWTG-UHFFFAOYSA-N 2 0 343.515 2.735 20 10 EFCDRP CN(C)c1ccc(CN2CC[C@H]3[NH2+]CC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000843126342 1260705677 /nfs/dbraw/zinc/70/56/77/1260705677.db2.gz JMNBBPBKGSZXBU-CZUORRHYSA-N 2 0 327.394 2.955 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)ccc1N(C)C ZINC000923374908 1261575219 /nfs/dbraw/zinc/57/52/19/1261575219.db2.gz FKPWFLLGGKVHLW-AZUAARDMSA-N 2 0 331.504 2.779 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CO)CC(C)(C)C ZINC000825041031 1278394369 /nfs/dbraw/zinc/39/43/69/1278394369.db2.gz ZFIPXWRDZHRJCM-IBGZPJMESA-N 2 0 333.520 2.667 20 10 EFCDRP CO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C12CCC2 ZINC000825104220 1278399129 /nfs/dbraw/zinc/39/91/29/1278399129.db2.gz RGMYYMVQTMHWCE-VQTJNVASSA-N 2 0 343.515 2.828 20 10 EFCDRP C[C@@H](Cc1cccc(O)c1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000825124636 1278419011 /nfs/dbraw/zinc/41/90/11/1278419011.db2.gz VFZUJKXKMZNCPK-KRWDZBQOSA-N 2 0 339.483 2.865 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825247892 1278484532 /nfs/dbraw/zinc/48/45/32/1278484532.db2.gz ZDXSAGIODKOLSX-AWEZNQCLSA-N 2 0 339.911 2.717 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825247893 1278485163 /nfs/dbraw/zinc/48/51/63/1278485163.db2.gz ZDXSAGIODKOLSX-CQSZACIVSA-N 2 0 339.911 2.717 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000742717472 1270197333 /nfs/dbraw/zinc/19/73/33/1270197333.db2.gz IKWXSBMXRHDDKL-UHFFFAOYSA-N 2 0 329.488 2.630 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169139676 1272700873 /nfs/dbraw/zinc/70/08/73/1272700873.db2.gz DCSAXZIPKOZOJK-PMOLBWCYSA-N 2 0 329.488 2.580 20 10 EFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000691455340 1274132767 /nfs/dbraw/zinc/13/27/67/1274132767.db2.gz NYUYSIISXSKLDZ-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2c(O)cccc2Br)CC1 ZINC000706875012 1275066367 /nfs/dbraw/zinc/06/63/67/1275066367.db2.gz JRTXLCIUZCWPPG-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817887757 1276345834 /nfs/dbraw/zinc/34/58/34/1276345834.db2.gz DMGOHFWSUIVMIA-OLZOCXBDSA-N 2 0 345.409 2.757 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000817890504 1276347711 /nfs/dbraw/zinc/34/77/11/1276347711.db2.gz YZHVCZPXTJJAGZ-HSALFYBXSA-N 2 0 331.504 2.780 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@H]3C)cc2F)C[C@@H](C)O1 ZINC000817888838 1276348397 /nfs/dbraw/zinc/34/83/97/1276348397.db2.gz PTPNBDLGIBWUTN-YKTARERQSA-N 2 0 349.494 2.917 20 10 EFCDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893106 1276362919 /nfs/dbraw/zinc/36/29/19/1276362919.db2.gz DRBPIJRAJIBCHD-QUCCMNQESA-N 2 0 331.504 2.502 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000817898533 1276366722 /nfs/dbraw/zinc/36/67/22/1276366722.db2.gz IHQWMDAECVTVQD-SLFFLAALSA-N 2 0 329.488 2.534 20 10 EFCDRP CC[C@H](NCc1ccc(N2CC[NH+](CC)CC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817902407 1276366987 /nfs/dbraw/zinc/36/69/87/1276366987.db2.gz PWNWWOQWNVEKOG-OALUTQOASA-N 2 0 348.510 2.588 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC[C@@H]3C[NH3+])cc2F)CC1 ZINC000817902642 1276367443 /nfs/dbraw/zinc/36/74/43/1276367443.db2.gz VVKUIMFIBWJEAN-IEBWSBKVSA-N 3 0 348.510 2.575 20 10 EFCDRP CC[C@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1O ZINC000817937310 1276384242 /nfs/dbraw/zinc/38/42/42/1276384242.db2.gz WJJCHFSORLVZIE-HNNXBMFYSA-N 2 0 345.409 2.747 20 10 EFCDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccc(N2CCOCC2)c(F)c1 ZINC000817959547 1276399280 /nfs/dbraw/zinc/39/92/80/1276399280.db2.gz GXWXFEZYHWBSOI-ZVZYQTTQSA-N 2 0 335.467 2.830 20 10 EFCDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817964402 1276403032 /nfs/dbraw/zinc/40/30/32/1276403032.db2.gz BJLAGODMRAKIEG-DNVCBOLYSA-N 2 0 335.467 2.703 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817985486 1276424361 /nfs/dbraw/zinc/42/43/61/1276424361.db2.gz KPPMAHZSMSDNKW-LEUOFYLZSA-N 2 0 347.478 2.701 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)cc1 ZINC000818342722 1276511387 /nfs/dbraw/zinc/51/13/87/1276511387.db2.gz UXEPNQIAFORMKB-VBZNHOPUSA-N 2 0 329.488 2.736 20 10 EFCDRP Cc1cc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](C)C2)ccc1N(C)C ZINC000815078043 1287301891 /nfs/dbraw/zinc/30/18/91/1287301891.db2.gz LZPUSWSABYUTGG-WIYYLYMNSA-N 2 0 344.547 2.519 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000844902455 1279325629 /nfs/dbraw/zinc/32/56/29/1279325629.db2.gz MYINEGWICGNXKF-CMKODMSKSA-N 2 0 331.504 2.779 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)cc1F ZINC000844902231 1279325650 /nfs/dbraw/zinc/32/56/50/1279325650.db2.gz MDVVQSBKIUVQOV-FRQCXROJSA-N 2 0 335.467 2.610 20 10 EFCDRP CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000846027758 1279986271 /nfs/dbraw/zinc/98/62/71/1279986271.db2.gz QAPRDPQDWHHUSV-SFHVURJKSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H](CC)CO1 ZINC000846026762 1279986698 /nfs/dbraw/zinc/98/66/98/1279986698.db2.gz HFOZHTYOMCBDHH-UYAOXDASSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000846026760 1279986715 /nfs/dbraw/zinc/98/67/15/1279986715.db2.gz HFOZHTYOMCBDHH-QUCCMNQESA-N 2 0 331.504 2.828 20 10 EFCDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c1O ZINC000846148419 1280036414 /nfs/dbraw/zinc/03/64/14/1280036414.db2.gz ZEEVXESFBITPAG-HUUCEWRRSA-N 2 0 334.460 2.552 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c1O ZINC000846156060 1280039809 /nfs/dbraw/zinc/03/98/09/1280039809.db2.gz RWOZXJLXCXSSQD-JYJNAYRXSA-N 2 0 336.476 2.941 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c1O ZINC000846155533 1280040607 /nfs/dbraw/zinc/04/06/07/1280040607.db2.gz HACBROKJOJPOSD-QGTPRVQTSA-N 2 0 348.487 2.819 20 10 EFCDRP COc1cc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccn1 ZINC000808432686 1281726412 /nfs/dbraw/zinc/72/64/12/1281726412.db2.gz WYLUKVUIZUEDIU-INIZCTEOSA-N 2 0 340.471 2.693 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]CC3(SC)CC3)cc2F)CC1 ZINC000809615045 1282320523 /nfs/dbraw/zinc/32/05/23/1282320523.db2.gz YIKBPQATYGDTOR-UHFFFAOYSA-N 2 0 337.508 2.953 20 10 EFCDRP CCOC1CC2(C1)CC[N@H+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000809708093 1282419798 /nfs/dbraw/zinc/41/97/98/1282419798.db2.gz YBUZWPVLMAJFBO-UHFFFAOYSA-N 2 0 343.515 2.829 20 10 EFCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000809767500 1282430858 /nfs/dbraw/zinc/43/08/58/1282430858.db2.gz MZORJKSBCHSRTH-HKUYNNGSSA-N 2 0 347.478 2.578 20 10 EFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1ccc(N(C)C)cc1 ZINC000809737399 1282437267 /nfs/dbraw/zinc/43/72/67/1282437267.db2.gz HGCMNVLVVPWIRS-FQEVSTJZSA-N 2 0 332.536 2.601 20 10 EFCDRP CCC[N@H+](CC)C[C@H](C)NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000810180624 1283007814 /nfs/dbraw/zinc/00/78/14/1283007814.db2.gz DVYNFLUJVLQEIP-SFHVURJKSA-N 2 0 332.536 2.648 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@]1(O)CCN(C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810238080 1283088225 /nfs/dbraw/zinc/08/82/25/1283088225.db2.gz XXWIKPGSKCWGED-HIFRSBDPSA-N 2 0 332.366 2.518 20 10 EFCDRP CC(C)OC(=O)CC[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172755562 1286260684 /nfs/dbraw/zinc/26/06/84/1286260684.db2.gz IRQHSAKGWPLYNV-KRWDZBQOSA-N 2 0 347.503 2.648 20 10 EFCDRP COC(=O)CCCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001173437733 1286571868 /nfs/dbraw/zinc/57/18/68/1286571868.db2.gz PBFOYWZMSZWVFM-QGZVFWFLSA-N 2 0 347.503 2.650 20 10 EFCDRP COc1ccc(C[NH2+][C@@H](C)C[C@@H](C)NC(=O)CCC[NH+](C)C)cc1C ZINC001135314539 1287943460 /nfs/dbraw/zinc/94/34/60/1287943460.db2.gz CINRJHWQXNWRAA-DLBZAZTESA-N 2 0 349.519 2.718 20 10 EFCDRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816548949 1288198170 /nfs/dbraw/zinc/19/81/70/1288198170.db2.gz YCTHSWXEMIXQAK-UHFFFAOYSA-N 2 0 341.499 2.909 20 10 EFCDRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccc2ccccc2c1O ZINC000816611472 1288224100 /nfs/dbraw/zinc/22/41/00/1288224100.db2.gz QWFIAENYGIGRJB-UHFFFAOYSA-N 2 0 327.472 2.615 20 10 EFCDRP CC(C)[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCO1 ZINC000816675920 1288241251 /nfs/dbraw/zinc/24/12/51/1288241251.db2.gz OPWBZMSGQZKJHC-FQEVSTJZSA-N 2 0 331.504 2.685 20 10 EFCDRP CCCOc1ccc(C[NH2+]C[C@@H](C)N2CC[NH+](CC)CC2)cc1C ZINC000873011638 1289517745 /nfs/dbraw/zinc/51/77/45/1289517745.db2.gz BUJKPBXBYXFQBR-GOSISDBHSA-N 2 0 333.520 2.899 20 10 EFCDRP CCCOc1ccc(C[NH2+]CCCN2CC[NH+](CC)CC2)cc1C ZINC000873012146 1289518786 /nfs/dbraw/zinc/51/87/86/1289518786.db2.gz NZEAWYTVOGQTKW-UHFFFAOYSA-N 2 0 333.520 2.901 20 10 EFCDRP COc1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)cc1Cn1cccn1 ZINC000873014276 1289519174 /nfs/dbraw/zinc/51/91/74/1289519174.db2.gz NKPQWBLZZADTFN-RBUKOAKNSA-N 2 0 340.471 2.656 20 10 EFCDRP COc1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1Cn1cccn1 ZINC000873014274 1289519753 /nfs/dbraw/zinc/51/97/53/1289519753.db2.gz NKPQWBLZZADTFN-MOPGFXCFSA-N 2 0 340.471 2.656 20 10 EFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000873029534 1289529098 /nfs/dbraw/zinc/52/90/98/1289529098.db2.gz JWRJSRCGKYJAKE-GOSISDBHSA-N 2 0 342.487 2.762 20 10 EFCDRP CCCOc1ccc(C[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)cc1C ZINC000873043931 1289536816 /nfs/dbraw/zinc/53/68/16/1289536816.db2.gz WUVGLDVVMQUNHU-QGZVFWFLSA-N 2 0 333.520 2.757 20 10 EFCDRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cn1cccn1 ZINC000873061275 1289547177 /nfs/dbraw/zinc/54/71/77/1289547177.db2.gz RAELXANEGIQLPQ-MAUKXSAKSA-N 2 0 328.460 2.512 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000873290736 1289706092 /nfs/dbraw/zinc/70/60/92/1289706092.db2.gz GUEBKDRQXMULPU-RBUKOAKNSA-N 2 0 331.504 2.952 20 10 EFCDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877073488 1291125530 /nfs/dbraw/zinc/12/55/30/1291125530.db2.gz LMFVSTBDJYQZAY-IEBWSBKVSA-N 2 0 331.504 2.610 20 10 EFCDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000126386451 1291153749 /nfs/dbraw/zinc/15/37/49/1291153749.db2.gz IIEGAFNMPISSNL-HNNXBMFYSA-N 2 0 335.467 2.655 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c(O)c1 ZINC000877190402 1291160637 /nfs/dbraw/zinc/16/06/37/1291160637.db2.gz DNMZLQFVYHRSIV-HXUWFJFHSA-N 2 0 340.467 2.947 20 10 EFCDRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877532714 1291263017 /nfs/dbraw/zinc/26/30/17/1291263017.db2.gz WSPAQSIUBKQLNO-WIYYLYMNSA-N 2 0 343.515 2.564 20 10 EFCDRP C[NH+]1CCN(C2CC[NH+](Cc3cc(C(C)(C)C)ccc3O)CC2)CC1 ZINC001233285641 1312895764 /nfs/dbraw/zinc/89/57/64/1312895764.db2.gz NTBZSHCPXRWTBE-UHFFFAOYSA-N 2 0 345.531 2.902 20 10 EFCDRP C[NH+](C)CCCN1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286060 1312895861 /nfs/dbraw/zinc/89/58/61/1312895861.db2.gz CVTFORHVAUEYTF-UHFFFAOYSA-N 2 0 333.520 2.759 20 10 EFCDRP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775498100 1292752379 /nfs/dbraw/zinc/75/23/79/1292752379.db2.gz HDMNJNUIWLACTE-YOEHRIQHSA-N 2 0 339.911 2.970 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1cc(Br)ccc1O)CC2 ZINC001203649958 1312980457 /nfs/dbraw/zinc/98/04/57/1312980457.db2.gz KGSVWUQHZISWRO-UHFFFAOYSA-N 2 0 325.250 2.682 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC000775715993 1294241895 /nfs/dbraw/zinc/24/18/95/1294241895.db2.gz OGLIXAWOQYKTLR-GHTZIAJQSA-N 3 0 344.547 2.743 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3cc4c(s3)CC[NH2+]C4)CC2)cc1 ZINC001204621275 1313174192 /nfs/dbraw/zinc/17/41/92/1313174192.db2.gz AENKJSJDZRDMLG-UHFFFAOYSA-N 2 0 343.496 2.725 20 10 EFCDRP Oc1ccc2cc(Br)ccc2c1C[N@H+]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001234980423 1313216298 /nfs/dbraw/zinc/21/62/98/1313216298.db2.gz WXVAYPTWNAJZCE-BETUJISGSA-N 2 0 347.256 2.959 20 10 EFCDRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)cc2Cl)CC1 ZINC001205289289 1313264721 /nfs/dbraw/zinc/26/47/21/1313264721.db2.gz WDZRNAWKUUMSGD-SFHVURJKSA-N 2 0 337.895 2.880 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C[C@H]1C[NH3+] ZINC001205303365 1313266856 /nfs/dbraw/zinc/26/68/56/1313266856.db2.gz DAZNDWSHLIDHFH-RHSMWYFYSA-N 2 0 329.488 2.508 20 10 EFCDRP F[C@@H]1CC[NH2+]C[C@]12CC[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235401872 1313312503 /nfs/dbraw/zinc/31/25/03/1313312503.db2.gz HKZBCNKDGRONIQ-CTNGQTDRSA-N 2 0 343.490 2.909 20 10 EFCDRP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235424391 1313318521 /nfs/dbraw/zinc/31/85/21/1313318521.db2.gz HSOJBOQBSBVCLZ-IAGOWNOFSA-N 2 0 331.504 2.973 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C)[C@@H](C[NH3+])CC3)cc2)CC1 ZINC001205627229 1313325570 /nfs/dbraw/zinc/32/55/70/1313325570.db2.gz ODVXHNKRNDLCBY-AZUAARDMSA-N 3 0 344.547 2.635 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc(O)c(Br)cc2O)CC[C@@H]1C[NH3+] ZINC001205651128 1313331117 /nfs/dbraw/zinc/33/11/17/1313331117.db2.gz AIWFVKOZDFLMHE-WDEREUQCSA-N 2 0 343.265 2.667 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@](O)(C[NH3+])C2)c2ccccc21 ZINC001205665624 1313334132 /nfs/dbraw/zinc/33/41/32/1313334132.db2.gz SWRSZAMMLKERRS-FQEVSTJZSA-N 2 0 327.472 2.582 20 10 EFCDRP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001205726867 1313345584 /nfs/dbraw/zinc/34/55/84/1313345584.db2.gz YUCDRZGIYOLOLL-HXUWFJFHSA-N 2 0 344.430 2.874 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN1CCCC[C@H]1C[NH+]1CCCC1 ZINC001235677809 1313372420 /nfs/dbraw/zinc/37/24/20/1313372420.db2.gz IPRAJBKVGKZKOW-NRFANRHFSA-N 2 0 342.531 2.547 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H](Cc3ccccc3)C1)C[NH2+]CCO2 ZINC001235715898 1313382747 /nfs/dbraw/zinc/38/27/47/1313382747.db2.gz XIVPLOFNCCNBCP-KRWDZBQOSA-N 2 0 338.451 2.939 20 10 EFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001235717622 1313382980 /nfs/dbraw/zinc/38/29/80/1313382980.db2.gz WOYUIPOXUYABLP-UHFFFAOYSA-N 2 0 343.515 2.913 20 10 EFCDRP CN1CCOc2cc(C[NH+]3CCC(C4CC[NH2+]CC4)CC3)ccc21 ZINC001235704987 1313381387 /nfs/dbraw/zinc/38/13/87/1313381387.db2.gz DGWVVHQMPVVIDZ-UHFFFAOYSA-N 2 0 329.488 2.727 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c2ccccc2n1C ZINC001206012258 1313390844 /nfs/dbraw/zinc/39/08/44/1313390844.db2.gz JIKFFQJTGRBZML-GJZGRUSLSA-N 2 0 343.471 2.772 20 10 EFCDRP CCN(CC)c1ccc(CN(CCCOC)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC001235805032 1313399978 /nfs/dbraw/zinc/39/99/78/1313399978.db2.gz GLGBXAPOXBTLHX-IBGZPJMESA-N 2 0 349.519 2.829 20 10 EFCDRP Fc1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001236092809 1313440621 /nfs/dbraw/zinc/44/06/21/1313440621.db2.gz DBGLZCRDEPWWDM-UHFFFAOYSA-N 2 0 325.431 2.794 20 10 EFCDRP Oc1cc(OCC(F)(F)F)ccc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321974 1313469260 /nfs/dbraw/zinc/46/92/60/1313469260.db2.gz YPCQUDQZYRWNHL-BETUJISGSA-N 2 0 344.377 2.765 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3cccc(C[NH3+])c3)CC2)c(C)c1 ZINC001236366940 1313474167 /nfs/dbraw/zinc/47/41/67/1313474167.db2.gz JVFRVAJWCDJQSH-UHFFFAOYSA-N 2 0 325.456 2.785 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@](C)(C[NH3+])C3)c(F)c2)CC1 ZINC001206572176 1313477914 /nfs/dbraw/zinc/47/79/14/1313477914.db2.gz BVGVTXDXMWTUNA-HXUWFJFHSA-N 3 0 348.510 2.528 20 10 EFCDRP Oc1cc2ccccc2cc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001236832780 1313538571 /nfs/dbraw/zinc/53/85/71/1313538571.db2.gz LBVUQZZFWOEEIV-UHFFFAOYSA-N 2 0 339.483 2.759 20 10 EFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)cc1 ZINC001236925291 1313554902 /nfs/dbraw/zinc/55/49/02/1313554902.db2.gz XGGFXAXCNXLFPF-FQEVSTJZSA-N 2 0 332.536 2.648 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[C@]1(C)O ZINC001236932428 1313556006 /nfs/dbraw/zinc/55/60/06/1313556006.db2.gz OSMPFZAHXBCEIH-JXFKEZNVSA-N 2 0 349.494 2.560 20 10 EFCDRP COC[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236931258 1313556235 /nfs/dbraw/zinc/55/62/35/1313556235.db2.gz IFNYFYDYOXRPJJ-GOSISDBHSA-N 2 0 335.467 2.578 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(Cl)c(Cl)cc1O)[C@H]1CCC[NH2+]C1 ZINC001236932966 1313556607 /nfs/dbraw/zinc/55/66/07/1313556607.db2.gz PZRPIKMCUCPHHU-ZDUSSCGKSA-N 2 0 346.302 2.815 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]4(C3)CCCCO4)c(F)c2)CC1 ZINC001236936919 1313557063 /nfs/dbraw/zinc/55/70/63/1313557063.db2.gz UQVFESBNDMWWOU-HXUWFJFHSA-N 2 0 347.478 2.723 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4CCCO[C@H]4C3)c(F)c2)CC1 ZINC001236935211 1313557289 /nfs/dbraw/zinc/55/72/89/1313557289.db2.gz GMOAOLGFVSNSRE-JXFKEZNVSA-N 2 0 347.478 2.578 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)c(F)c2)CC1 ZINC001236938852 1313557595 /nfs/dbraw/zinc/55/75/95/1313557595.db2.gz OKQBHFMDSKPTIO-QGZVFWFLSA-N 2 0 339.405 2.809 20 10 EFCDRP CCOc1ccc(CN2CCC([N@H+](CC)[C@@H]3CCOC3)CC2)c(O)c1 ZINC001237043434 1313573993 /nfs/dbraw/zinc/57/39/93/1313573993.db2.gz OCUAJMLTRUZXEN-GOSISDBHSA-N 2 0 348.487 2.866 20 10 EFCDRP CC(C)c1ccc(C[NH+]2CCC(N3CC[NH+](C)CC3)CC2)c(O)c1 ZINC001237053599 1313576855 /nfs/dbraw/zinc/57/68/55/1313576855.db2.gz OKLUIHXRBUTUEH-UHFFFAOYSA-N 2 0 331.504 2.727 20 10 EFCDRP COc1ccc(N2CC[NH+](CCC3CC[NH+](C)CC3)CC2)c(OC)c1 ZINC001207487760 1313699324 /nfs/dbraw/zinc/69/93/24/1313699324.db2.gz QQPUHBKXAPMTKQ-UHFFFAOYSA-N 2 0 347.503 2.558 20 10 EFCDRP Cc1cc(=O)oc2c1ccc([O-])c2C[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001276826841 1311070145 /nfs/dbraw/zinc/07/01/45/1311070145.db2.gz ZGOZMWKQIWYSBM-FQEVSTJZSA-N 2 0 342.439 2.725 20 10 EFCDRP COC(=O)c1c(CN2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222147841 1311092094 /nfs/dbraw/zinc/09/20/94/1311092094.db2.gz BVDGJSKMUVIGAC-FQEVSTJZSA-N 2 0 341.455 2.540 20 10 EFCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3cc(C[NH+](C)C)c(O)c(OC)c3)(C1)CCC2 ZINC001276861696 1311215962 /nfs/dbraw/zinc/21/59/62/1311215962.db2.gz SDLUUBKXZAERDA-VQTJNVASSA-N 3 0 347.503 2.617 20 10 EFCDRP COc1cc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c(O)cc1O ZINC001231636387 1312536570 /nfs/dbraw/zinc/53/65/70/1312536570.db2.gz UHJPZGDNYPEIOC-MRXNPFEDSA-N 2 0 334.460 2.947 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH2+][C@H]1CCCN(C2CCCC2)C1 ZINC001246175579 1314593514 /nfs/dbraw/zinc/59/35/14/1314593514.db2.gz UGTPCXQAJQYTFC-IBGZPJMESA-N 2 0 342.531 2.593 20 10 EFCDRP c1ccc2c(c1)nc(-c1ccc(N3CC[NH2+]CC3)cc1)n2[C@H]1CC[NH2+]C1 ZINC001247046102 1314734312 /nfs/dbraw/zinc/73/43/12/1314734312.db2.gz CTITYQMRUFERTN-SFHVURJKSA-N 2 0 347.466 2.647 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249244291 1315038093 /nfs/dbraw/zinc/03/80/93/1315038093.db2.gz DUYHOZOKKZYWDE-UHFFFAOYSA-N 2 0 347.503 2.502 20 10 EFCDRP CC(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)N3CC[NH+](C)C)c(O)c1 ZINC001276815078 1315437099 /nfs/dbraw/zinc/43/70/99/1315437099.db2.gz OYIUJWLUHNGVGB-KDURUIRLSA-N 2 0 331.504 2.726 20 10 EFCDRP C[NH+]1CCC(COc2ccccc2NC[C@H](O)C[NH2+]C(C)(C)C)CC1 ZINC001253402924 1315600559 /nfs/dbraw/zinc/60/05/59/1315600559.db2.gz UVBKCSSAEAIVJO-KRWDZBQOSA-N 2 0 349.519 2.568 20 10 EFCDRP CN(C)c1ccc(C[N@H+](C)C2CCC([NH+]3CCOCC3)CC2)cc1 ZINC001256696646 1315983712 /nfs/dbraw/zinc/98/37/12/1315983712.db2.gz JWMLRKJPMXPOCS-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP Oc1cc2c(cc1O)C[N@@H+](C1CCN(c3cc[nH+]cc3)CC1)CCC2 ZINC001256862268 1316001087 /nfs/dbraw/zinc/00/10/87/1316001087.db2.gz LNWRQZVTKROZOV-UHFFFAOYSA-N 2 0 339.439 2.910 20 10 EFCDRP CCC[NH+]1CCC(NC2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001258769716 1316176047 /nfs/dbraw/zinc/17/60/47/1316176047.db2.gz DIIGYVJDSFTTSQ-UHFFFAOYSA-N 2 0 331.504 2.821 20 10 EFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@@H]1CC[NH3+] ZINC001328644445 1330611473 /nfs/dbraw/zinc/61/14/73/1330611473.db2.gz ZDRKVGHUTNWBHN-VQIMIIECSA-N 2 0 348.510 2.527 20 10 EFCDRP CCC(O)(CC)C[N@H+](C)Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001329537153 1330716726 /nfs/dbraw/zinc/71/67/26/1330716726.db2.gz IUGZXCRTYMKJFX-UHFFFAOYSA-N 2 0 337.483 2.560 20 10 EFCDRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001340394399 1332187305 /nfs/dbraw/zinc/18/73/05/1332187305.db2.gz MUKSQPKGCFCZGP-UHFFFAOYSA-N 2 0 331.504 2.612 20 10 EFCDRP CCc1cccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000848890253 1334964885 /nfs/dbraw/zinc/96/48/85/1334964885.db2.gz QWIMLPVEEVRAID-UHFFFAOYSA-N 2 0 345.531 2.945 20 10 EFCDRP CCc1cccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c1O ZINC000848899988 1334972522 /nfs/dbraw/zinc/97/25/22/1334972522.db2.gz WIACSLXFQUVSGG-RTBURBONSA-N 2 0 332.488 2.812 20 10 EFCDRP CCc1cccc(C[N@H+]2CCCN(C3CC[NH+](CC)CC3)CC2)c1O ZINC000848917207 1334985311 /nfs/dbraw/zinc/98/53/11/1334985311.db2.gz CZIKWDXMLOCJEP-UHFFFAOYSA-N 2 0 345.531 2.947 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c(O)c1OC ZINC000892237469 715400667 /nfs/dbraw/zinc/40/06/67/715400667.db2.gz ZQLSSKNMMMUEEF-PBHICJAKSA-N 2 0 346.471 2.858 20 10 EFCDRP COc1cc(Br)cc(CN2CC[C@H](C[NH+](C)C)C2)c1O ZINC000179631777 717815926 /nfs/dbraw/zinc/81/59/26/717815926.db2.gz RYCVEPYKRWUHJT-LLVKDONJSA-N 2 0 343.265 2.547 20 10 EFCDRP COc1ccc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c(O)c1OC ZINC000894230318 721343201 /nfs/dbraw/zinc/34/32/01/721343201.db2.gz DDVXMPGOMFFABN-UHFFFAOYSA-N 2 0 334.460 2.717 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000121177323 723132142 /nfs/dbraw/zinc/13/21/42/723132142.db2.gz BFBCRVDMCYEGHR-ZWKOTPCHSA-N 2 0 332.536 2.677 20 10 EFCDRP COc1cc(Br)cc(C[NH2+]CC[C@H](C)[NH+](C)C)c1O ZINC000895300033 724007222 /nfs/dbraw/zinc/00/72/22/724007222.db2.gz RIDYDCFABVYCDK-JTQLQIEISA-N 2 0 331.254 2.593 20 10 EFCDRP COc1ccc(C[N@@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c(O)c1OC ZINC000895508081 724163923 /nfs/dbraw/zinc/16/39/23/724163923.db2.gz DXDVRVLZLVFTIK-HOCLYGCPSA-N 2 0 336.476 2.962 20 10 EFCDRP C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895606833 724221350 /nfs/dbraw/zinc/22/13/50/724221350.db2.gz GOIOWOPUSLFMBT-KRWDZBQOSA-N 2 0 339.483 2.865 20 10 EFCDRP Cc1ccc(CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000895607091 724221847 /nfs/dbraw/zinc/22/18/47/724221847.db2.gz KVMVLQXFWGUENZ-UHFFFAOYSA-N 2 0 338.499 2.864 20 10 EFCDRP COC(=O)c1c(C[NH2+]CCCCCC[NH3+])c2cc(F)ccc2n1C ZINC001578851417 1090453870 /nfs/dbraw/zinc/45/38/70/1090453870.db2.gz RGFSXRHPAMSCBX-UHFFFAOYSA-N 2 0 335.423 2.713 20 10 EFCDRP COC1CCN(c2ccc(C[NH2+][C@H](C)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001578941236 1090483823 /nfs/dbraw/zinc/48/38/23/1090483823.db2.gz QCUVKELLPAEDBO-SJLPKXTDSA-N 2 0 331.504 2.780 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H]4[NH2+]CCC[C@H]4C3)cc2)CC1 ZINC001580879774 1091032458 /nfs/dbraw/zinc/03/24/58/1091032458.db2.gz FIOYJTATWOFGFA-WAOWUJCRSA-N 2 0 343.515 2.658 20 10 EFCDRP COc1cccc(C[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c1O ZINC000904458926 1107953278 /nfs/dbraw/zinc/95/32/78/1107953278.db2.gz KMGHNSVLSDIBMD-UHFFFAOYSA-N 2 0 326.440 2.893 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)[NH+](C)C)cc1 ZINC000898450135 1108944296 /nfs/dbraw/zinc/94/42/96/1108944296.db2.gz OGYWDEGGMCDWRT-HOJAQTOUSA-N 2 0 330.520 2.572 20 10 EFCDRP CC[N@@H+]1CC[C@H](NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)[C@H](C)C1 ZINC000898450564 1108944542 /nfs/dbraw/zinc/94/45/42/1108944542.db2.gz RYWNBHHMYGVWML-LSTHTHJFSA-N 2 0 332.536 2.675 20 10 EFCDRP Oc1cc2c(cc1C[NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)OCO2 ZINC000192929642 240074673 /nfs/dbraw/zinc/07/46/73/240074673.db2.gz SVDFKWPGMJGPEI-INIZCTEOSA-N 2 0 340.423 2.733 20 10 EFCDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(N2CCOCC2)c(F)c1 ZINC000295908691 241067085 /nfs/dbraw/zinc/06/70/85/241067085.db2.gz JBDZSUCYZHQNTC-MIGBEJBISA-N 2 0 347.478 2.938 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)CC2 ZINC000296490629 241087957 /nfs/dbraw/zinc/08/79/57/241087957.db2.gz POHIGHPVPFTFBH-RTBURBONSA-N 2 0 338.451 2.736 20 10 EFCDRP C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)C1 ZINC000369551244 242424223 /nfs/dbraw/zinc/42/42/23/242424223.db2.gz SAAXEMPYANMOFQ-GOSISDBHSA-N 2 0 339.483 2.757 20 10 EFCDRP CC[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000370637897 280197874 /nfs/dbraw/zinc/19/78/74/280197874.db2.gz VULIJEISYKUYAJ-GHTZIAJQSA-N 2 0 344.547 2.962 20 10 EFCDRP C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)CN1CC[NH+](C)CC1 ZINC000185343652 473399777 /nfs/dbraw/zinc/39/97/77/473399777.db2.gz MBZPCXTXBGMPQL-KBPBESRZSA-N 2 0 325.884 2.580 20 10 EFCDRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000124374948 473238835 /nfs/dbraw/zinc/23/88/35/473238835.db2.gz NEPWHFCERCNXED-KRWDZBQOSA-N 2 0 332.536 2.677 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)N1CC[NH+](C)CC1 ZINC000184976944 473288314 /nfs/dbraw/zinc/28/83/14/473288314.db2.gz MSDMICLADWHTOF-WMLDXEAASA-N 2 0 339.911 2.968 20 10 EFCDRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000184983378 473291789 /nfs/dbraw/zinc/29/17/89/473291789.db2.gz YNJHBJYKMCBWHC-MRXNPFEDSA-N 2 0 345.531 2.948 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185013714 473301159 /nfs/dbraw/zinc/30/11/59/473301159.db2.gz RUOMHXBUSLBMGN-CQSZACIVSA-N 2 0 325.884 2.724 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185014026 473301298 /nfs/dbraw/zinc/30/12/98/473301298.db2.gz MNFZHHSOLOHWOD-KRWDZBQOSA-N 2 0 345.531 2.949 20 10 EFCDRP C[N@@H+]1CCCC[C@@H]1CN1CCN(Cc2c(O)cccc2Cl)CC1 ZINC000120052630 472622487 /nfs/dbraw/zinc/62/24/87/472622487.db2.gz MABZQGGHFOZMLO-OAHLLOKOSA-N 2 0 337.895 2.648 20 10 EFCDRP C[C@H](C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2)CN1CC[NH+](C)CC1 ZINC000185344265 473399057 /nfs/dbraw/zinc/39/90/57/473399057.db2.gz DJXJXAFNGUUZPE-IAGOWNOFSA-N 2 0 345.531 2.805 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000185343687 473399217 /nfs/dbraw/zinc/39/92/17/473399217.db2.gz MBZPCXTXBGMPQL-UONOGXRCSA-N 2 0 325.884 2.580 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185367168 473406928 /nfs/dbraw/zinc/40/69/28/473406928.db2.gz FUNMBUURXNJYPE-QGZVFWFLSA-N 2 0 345.531 2.949 20 10 EFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000151116168 473411032 /nfs/dbraw/zinc/41/10/32/473411032.db2.gz QNLOAMGHISMZDA-KRWDZBQOSA-N 2 0 331.504 2.986 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000185865052 473533241 /nfs/dbraw/zinc/53/32/41/473533241.db2.gz PXEHPHWGNZGBQK-LJQANCHMSA-N 2 0 344.547 2.793 20 10 EFCDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000115628914 473588997 /nfs/dbraw/zinc/58/89/97/473588997.db2.gz MBACJSZXEYGOCQ-YLJYHZDGSA-N 2 0 333.520 2.979 20 10 EFCDRP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000186197335 473614407 /nfs/dbraw/zinc/61/44/07/473614407.db2.gz NMNHNRAHZUAEIZ-CQSZACIVSA-N 2 0 345.443 2.587 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000186592525 473695847 /nfs/dbraw/zinc/69/58/47/473695847.db2.gz BPLQPCRVHXULMJ-KGLIPLIRSA-N 2 0 325.884 2.722 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc2nccn21 ZINC000179616994 473698359 /nfs/dbraw/zinc/69/83/59/473698359.db2.gz ACWDVWBTEPXZEX-UHFFFAOYSA-N 2 0 336.439 2.803 20 10 EFCDRP Cc1cccc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)c1O ZINC000179909564 473753227 /nfs/dbraw/zinc/75/32/27/473753227.db2.gz VWWQWTHQDYXKNR-HDICACEKSA-N 2 0 331.504 2.691 20 10 EFCDRP CC[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000282180250 473972621 /nfs/dbraw/zinc/97/26/21/473972621.db2.gz FPMWFBNXKIWOTJ-IBGZPJMESA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(Cl)ccc1O ZINC000282507622 474090958 /nfs/dbraw/zinc/09/09/58/474090958.db2.gz YOXMATNNFPABKY-ZDUSSCGKSA-N 2 0 325.884 2.722 20 10 EFCDRP CN1CC[NH+](CC2CC[NH+](Cc3c(O)cccc3Cl)CC2)CC1 ZINC000289535676 474312540 /nfs/dbraw/zinc/31/25/40/474312540.db2.gz WIPUHYLAEVUKHD-UHFFFAOYSA-N 2 0 337.895 2.505 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccccc1O ZINC000290167793 474560976 /nfs/dbraw/zinc/56/09/76/474560976.db2.gz DPUVBECQTBCJAA-OAHLLOKOSA-N 2 0 329.444 2.969 20 10 EFCDRP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccccc1O ZINC000290167792 474561044 /nfs/dbraw/zinc/56/10/44/474561044.db2.gz DPUVBECQTBCJAA-HNNXBMFYSA-N 2 0 329.444 2.969 20 10 EFCDRP Cc1cccc(C[N@@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1O ZINC000190310288 474575983 /nfs/dbraw/zinc/57/59/83/474575983.db2.gz HDXAGJTWFLHYGC-OAQYLSRUSA-N 2 0 340.467 2.769 20 10 EFCDRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000272635772 474621354 /nfs/dbraw/zinc/62/13/54/474621354.db2.gz LAKQMTPUZSMHHR-UHFFFAOYSA-N 2 0 344.547 2.746 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273563860 474965164 /nfs/dbraw/zinc/96/51/64/474965164.db2.gz IXVIIHVLBBVLGH-QAPCUYQASA-N 2 0 333.520 2.933 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@@H](C)O[C@@H]3C)cc2F)CC1 ZINC000295270902 475117827 /nfs/dbraw/zinc/11/78/27/475117827.db2.gz VPRUCSUTAPJSDU-IIDMSEBBSA-N 2 0 335.467 2.623 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377619552 476478022 /nfs/dbraw/zinc/47/80/22/476478022.db2.gz DCSAXZIPKOZOJK-YOFSQIOKSA-N 2 0 329.488 2.580 20 10 EFCDRP CC[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(C)cc1O ZINC000375649209 476935103 /nfs/dbraw/zinc/93/51/03/476935103.db2.gz PPLATRLCANSRND-QFBILLFUSA-N 2 0 331.504 2.910 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000371417858 477305936 /nfs/dbraw/zinc/30/59/36/477305936.db2.gz YOIOYSQSWXPYBB-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(C)cc(OC)c2O)C1 ZINC000754735840 575480244 /nfs/dbraw/zinc/48/02/44/575480244.db2.gz DLTKWVLVQYGKLX-KRWDZBQOSA-N 2 0 336.476 2.642 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756395906 575730327 /nfs/dbraw/zinc/73/03/27/575730327.db2.gz KUKKDQQHQICREU-CZUORRHYSA-N 2 0 335.467 2.695 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)N1CC[NH+](C)CC1 ZINC000756398127 575730791 /nfs/dbraw/zinc/73/07/91/575730791.db2.gz BTLJORIXIJSWDI-OIISXLGYSA-N 2 0 349.494 2.941 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2c1c(F)ccc2O ZINC000756408418 575732493 /nfs/dbraw/zinc/73/24/93/575732493.db2.gz MHKZUIMKYIQGDV-GOEBONIOSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756548144 575759197 /nfs/dbraw/zinc/75/91/97/575759197.db2.gz IYMJZLBFUSCJMS-GDBMZVCRSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2c1c(F)ccc2O ZINC000756565122 575763284 /nfs/dbraw/zinc/76/32/84/575763284.db2.gz VONBHCCLYSBNJI-YCPHGPKFSA-N 2 0 336.451 2.906 20 10 EFCDRP COc1cc(Cl)cc(C[NH+]2CCC(OCC[NH+](C)C)CC2)c1O ZINC000761200899 576129012 /nfs/dbraw/zinc/12/90/12/576129012.db2.gz ZWPBMPWZIHTQHV-UHFFFAOYSA-N 2 0 342.867 2.597 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)N2CC[NH+](C)CC2)cc1 ZINC000764838260 576510186 /nfs/dbraw/zinc/51/01/86/576510186.db2.gz CLLJUKYBZMTKCP-QGZVFWFLSA-N 2 0 332.536 2.819 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)N2CC[NH+](C)CC2)cc1 ZINC000764838258 576510203 /nfs/dbraw/zinc/51/02/03/576510203.db2.gz CLLJUKYBZMTKCP-KRWDZBQOSA-N 2 0 332.536 2.819 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCCC(C)(C)C3)cc2)CC1 ZINC000767735786 577231136 /nfs/dbraw/zinc/23/11/36/577231136.db2.gz AJOKWJDRZAYOLB-UHFFFAOYSA-N 2 0 344.547 2.650 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1OC ZINC000768448668 577274852 /nfs/dbraw/zinc/27/48/52/577274852.db2.gz VDNNRUOUDGXCPR-UHFFFAOYSA-N 2 0 336.476 2.962 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1F ZINC000769208468 577344653 /nfs/dbraw/zinc/34/46/53/577344653.db2.gz YCTRGLACUBKEEZ-UHFFFAOYSA-N 2 0 349.494 2.826 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@H](OCC[NH+](CC)CC)C2)c1 ZINC000769514384 577369020 /nfs/dbraw/zinc/36/90/20/577369020.db2.gz KIWDEONYDWFLBZ-SFHVURJKSA-N 2 0 336.476 2.724 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCCc3nccs3)cc2)CC1 ZINC000771840824 581249253 /nfs/dbraw/zinc/24/92/53/581249253.db2.gz GTGBSOKJHHTWKQ-UHFFFAOYSA-N 2 0 330.501 2.617 20 10 EFCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000773823600 581466405 /nfs/dbraw/zinc/46/64/05/581466405.db2.gz UWLMHUKZQQIGCL-WIYYLYMNSA-N 2 0 344.547 2.601 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(O)CCC(C)(C)CC3)cc2)CC1 ZINC000850393366 1250460177 /nfs/dbraw/zinc/46/01/77/1250460177.db2.gz BJIKXWXENBPTSI-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP CO[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000850401363 1250466746 /nfs/dbraw/zinc/46/67/46/1250466746.db2.gz YEKIZLCQYUAWPA-HXUWFJFHSA-N 2 0 331.504 2.733 20 10 EFCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)ccc1N(C)C ZINC000923393765 1261600254 /nfs/dbraw/zinc/60/02/54/1261600254.db2.gz XNAJVZWSNOJISK-MISYRCLQSA-N 2 0 331.504 2.922 20 10 EFCDRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000922012659 1264112559 /nfs/dbraw/zinc/11/25/59/1264112559.db2.gz UHRSPQZHCGAOQP-UHFFFAOYSA-N 2 0 331.504 2.517 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H](CO)c1ccccc1 ZINC000824696837 1278229487 /nfs/dbraw/zinc/22/94/87/1278229487.db2.gz UWKNCQOUXRRIGI-OAQYLSRUSA-N 2 0 339.483 2.604 20 10 EFCDRP Cc1ncsc1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824738965 1278252856 /nfs/dbraw/zinc/25/28/56/1278252856.db2.gz UJCLPRVCRQHRMS-UHFFFAOYSA-N 2 0 330.501 2.536 20 10 EFCDRP Cc1cccnc1CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824783573 1278306988 /nfs/dbraw/zinc/30/69/88/1278306988.db2.gz QPHDKKBNOAWJNH-UHFFFAOYSA-N 2 0 338.499 2.864 20 10 EFCDRP C[C@H](Cc1cccc(O)c1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000825124637 1278419846 /nfs/dbraw/zinc/41/98/46/1278419846.db2.gz VFZUJKXKMZNCPK-QGZVFWFLSA-N 2 0 339.483 2.865 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C3(O)CCCC3)cc2)CC1 ZINC000825241008 1278481821 /nfs/dbraw/zinc/48/18/21/1278481821.db2.gz TUSQEDAMBQZAPY-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP Cc1cc(O)c(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1Cl ZINC000825297641 1278497929 /nfs/dbraw/zinc/49/79/29/1278497929.db2.gz JKZRAGXJECEYFT-CQSZACIVSA-N 2 0 338.879 2.945 20 10 EFCDRP COc1ccc(N2CC[NH+](CCCC3CC[NH2+]CC3)CC2)cc1F ZINC000844221465 1278797020 /nfs/dbraw/zinc/79/70/20/1278797020.db2.gz NQXBPALMAYQCQB-UHFFFAOYSA-N 2 0 335.467 2.736 20 10 EFCDRP COc1ccc(N2CCC[N@H+](CCCC3CC[NH2+]CC3)CC2)cc1 ZINC000844221635 1278797208 /nfs/dbraw/zinc/79/72/08/1278797208.db2.gz IVNOJECZIXWCBZ-UHFFFAOYSA-N 2 0 331.504 2.987 20 10 EFCDRP C[NH+](C)CC1CC[NH+](Cc2c(O)cccc2Br)CC1 ZINC000707137531 1275337864 /nfs/dbraw/zinc/33/78/64/1275337864.db2.gz ZNVAOPVEWUTGPS-UHFFFAOYSA-N 2 0 327.266 2.928 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1c(O)ccc2ccncc21 ZINC000746644218 1275683044 /nfs/dbraw/zinc/68/30/44/1275683044.db2.gz ASNXLNRPJWASJD-BPAFIMBUSA-N 2 0 341.455 2.624 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3C[NH3+])cc2F)C[C@H](C)O1 ZINC000817890441 1276347556 /nfs/dbraw/zinc/34/75/56/1276347556.db2.gz XPGMJPLSVXLNBM-JSSFPYSZSA-N 2 0 335.467 2.656 20 10 EFCDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817895436 1276364225 /nfs/dbraw/zinc/36/42/25/1276364225.db2.gz UWUJPMMKSGCOJN-PKOBYXMFSA-N 2 0 331.504 2.924 20 10 EFCDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817895429 1276364296 /nfs/dbraw/zinc/36/42/96/1276364296.db2.gz UWUJPMMKSGCOJN-HKUYNNGSSA-N 2 0 331.504 2.924 20 10 EFCDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817965457 1276410390 /nfs/dbraw/zinc/41/03/90/1276410390.db2.gz VFVIQRRBVRSLQR-HNNXBMFYSA-N 2 0 335.467 2.703 20 10 EFCDRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817968350 1276411288 /nfs/dbraw/zinc/41/12/88/1276411288.db2.gz QGJGMTMNTCDXIO-CQSZACIVSA-N 2 0 335.879 2.747 20 10 EFCDRP COc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000817940327 1276386378 /nfs/dbraw/zinc/38/63/78/1276386378.db2.gz GBBQOKSYEXIJOD-DYVFJYSZSA-N 2 0 329.444 2.817 20 10 EFCDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817964403 1276403330 /nfs/dbraw/zinc/40/33/30/1276403330.db2.gz BJLAGODMRAKIEG-HNAYVOBHSA-N 2 0 335.467 2.703 20 10 EFCDRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817968347 1276411810 /nfs/dbraw/zinc/41/18/10/1276411810.db2.gz QGJGMTMNTCDXIO-AWEZNQCLSA-N 2 0 335.879 2.747 20 10 EFCDRP COCC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC[NH2+]CC1 ZINC000817974717 1276415951 /nfs/dbraw/zinc/41/59/51/1276415951.db2.gz OAUCMBSZWBKZDQ-HNNXBMFYSA-N 2 0 332.488 2.938 20 10 EFCDRP COCC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC[NH2+]CC1 ZINC000817974718 1276416333 /nfs/dbraw/zinc/41/63/33/1276416333.db2.gz OAUCMBSZWBKZDQ-OAHLLOKOSA-N 2 0 332.488 2.938 20 10 EFCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1cc(Br)ccc1O ZINC000817981956 1276419646 /nfs/dbraw/zinc/41/96/46/1276419646.db2.gz OVRBXLMTFWMMKW-OCCSQVGLSA-N 2 0 343.265 2.574 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000817980343 1276420126 /nfs/dbraw/zinc/42/01/26/1276420126.db2.gz AHBVYPOBJJXYKS-GXTWGEPZSA-N 2 0 332.366 2.830 20 10 EFCDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983572 1276421305 /nfs/dbraw/zinc/42/13/05/1276421305.db2.gz GPNYAPHEGKDPKK-OAHLLOKOSA-N 2 0 333.451 2.623 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817981079 1276421400 /nfs/dbraw/zinc/42/14/00/1276421400.db2.gz GUVSTXYQHMDPIL-ZNMIVQPWSA-N 2 0 337.895 2.955 20 10 EFCDRP CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000789593784 1276870533 /nfs/dbraw/zinc/87/05/33/1276870533.db2.gz WCFYMVFSSJLZGR-NRFANRHFSA-N 2 0 345.531 2.811 20 10 EFCDRP C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000790934316 1277853434 /nfs/dbraw/zinc/85/34/34/1277853434.db2.gz KHKARUHHZGHOSL-YLJYHZDGSA-N 2 0 331.504 2.564 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](CO)C3CCCCC3)cc2)CC1 ZINC000815150486 1287329808 /nfs/dbraw/zinc/32/98/08/1287329808.db2.gz GAAUXWCNNPWJQL-HXUWFJFHSA-N 2 0 345.531 2.717 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c1 ZINC000844902493 1279323616 /nfs/dbraw/zinc/32/36/16/1279323616.db2.gz NZGWKQMLZFJZKP-ZSZQSSIHSA-N 2 0 334.460 2.509 20 10 EFCDRP COc1cc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccn1 ZINC000808432687 1281727208 /nfs/dbraw/zinc/72/72/08/1281727208.db2.gz WYLUKVUIZUEDIU-MRXNPFEDSA-N 2 0 340.471 2.693 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693333 1281847119 /nfs/dbraw/zinc/84/71/19/1281847119.db2.gz GJUKYNSHSBAHES-KBPBESRZSA-N 2 0 325.884 2.641 20 10 EFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1c(O)cccc1Cl ZINC000809727593 1282409083 /nfs/dbraw/zinc/40/90/83/1282409083.db2.gz PCIHUEQNAOJRBZ-UHFFFAOYSA-N 2 0 327.900 2.751 20 10 EFCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000809767503 1282431151 /nfs/dbraw/zinc/43/11/51/1282431151.db2.gz MZORJKSBCHSRTH-PKOBYXMFSA-N 2 0 347.478 2.578 20 10 EFCDRP CCOc1ccc(O)c(CN(CC[NH+](C)C)C[C@H]2CCC[N@@H+]2CC)c1 ZINC000809738336 1282437438 /nfs/dbraw/zinc/43/74/38/1282437438.db2.gz UWDGYALJDBEAPS-GOSISDBHSA-N 2 0 349.519 2.639 20 10 EFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(Cl)ccc1O ZINC000809737006 1282437602 /nfs/dbraw/zinc/43/76/02/1282437602.db2.gz BCVXCHNRUILWNM-QGZVFWFLSA-N 2 0 339.911 2.894 20 10 EFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1c(O)cccc1Cl ZINC000809738573 1282437845 /nfs/dbraw/zinc/43/78/45/1282437845.db2.gz ZLCADLINNLQIPZ-HNNXBMFYSA-N 2 0 339.911 2.894 20 10 EFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000809757604 1282458000 /nfs/dbraw/zinc/45/80/00/1282458000.db2.gz UQBRKHIQLOUNQN-UHFFFAOYSA-N 2 0 337.483 2.826 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@H+](Cc3cccnc3)C3CC3)cc2)CC1 ZINC000809764804 1282464178 /nfs/dbraw/zinc/46/41/78/1282464178.db2.gz ZQWAHPZXXMCXQG-UHFFFAOYSA-N 2 0 336.483 2.998 20 10 EFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000815578982 1287610804 /nfs/dbraw/zinc/61/08/04/1287610804.db2.gz BRAUZMALVVUSPL-SJORKVTESA-N 2 0 331.504 2.828 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810213769 1283037383 /nfs/dbraw/zinc/03/73/83/1283037383.db2.gz XHFKWPPMIQGIET-UKRRQHHQSA-N 2 0 346.393 2.908 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810213767 1283038692 /nfs/dbraw/zinc/03/86/92/1283038692.db2.gz XHFKWPPMIQGIET-HIFRSBDPSA-N 2 0 346.393 2.908 20 10 EFCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NC1CC[NH+](Cc3ccccc3O)CC1)C2 ZINC001172114747 1286025171 /nfs/dbraw/zinc/02/51/71/1286025171.db2.gz PPGVATDOTAPHBS-OWZKRDHZSA-N 2 0 343.515 2.962 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC[C@H](C4CCC4)C3)cc2)CC1 ZINC000814178593 1286361105 /nfs/dbraw/zinc/36/11/05/1286361105.db2.gz WJBPRKJCILUOBY-HXUWFJFHSA-N 2 0 343.515 2.687 20 10 EFCDRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816556115 1288210544 /nfs/dbraw/zinc/21/05/44/1288210544.db2.gz AFPBUEIEOSRCMP-UHFFFAOYSA-N 2 0 328.456 2.870 20 10 EFCDRP CCC[N@H+](C)CC(=O)N[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135979024 1288702950 /nfs/dbraw/zinc/70/29/50/1288702950.db2.gz AXIQTWWPPFBFAL-IAGOWNOFSA-N 2 0 349.519 2.718 20 10 EFCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001206327751 1288776667 /nfs/dbraw/zinc/77/66/67/1288776667.db2.gz XAPHZKVAHKZCFG-OAHLLOKOSA-N 2 0 343.265 2.811 20 10 EFCDRP CC[NH+]1CCC([NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000873008240 1289516379 /nfs/dbraw/zinc/51/63/79/1289516379.db2.gz PWYFPADDZQNSQX-UHFFFAOYSA-N 2 0 328.460 2.514 20 10 EFCDRP COc1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1Cn1cccn1 ZINC000873013718 1289518971 /nfs/dbraw/zinc/51/89/71/1289518971.db2.gz GJBDVLFXHSYYCP-RTBURBONSA-N 2 0 340.471 2.656 20 10 EFCDRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1Cn1cccn1 ZINC000873061276 1289546710 /nfs/dbraw/zinc/54/67/10/1289546710.db2.gz RAELXANEGIQLPQ-QAPCUYQASA-N 2 0 328.460 2.512 20 10 EFCDRP COc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1Cn1cccn1 ZINC000873102519 1289569528 /nfs/dbraw/zinc/56/95/28/1289569528.db2.gz MCEBGOXVQHTSNE-UHFFFAOYSA-N 2 0 342.487 2.762 20 10 EFCDRP COc1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1Cn1cccn1 ZINC000873131246 1289586588 /nfs/dbraw/zinc/58/65/88/1289586588.db2.gz QCPAFBAONCHAOO-QGZVFWFLSA-N 2 0 342.487 2.762 20 10 EFCDRP C[C@H]1C[C@H](Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c2c1c(F)ccc2O ZINC000873243956 1289676463 /nfs/dbraw/zinc/67/64/63/1289676463.db2.gz DUUUQZYDRCIDBA-WFASDCNBSA-N 2 0 342.418 2.996 20 10 EFCDRP CC[C@@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc(F)cc1O ZINC000873244097 1289677033 /nfs/dbraw/zinc/67/70/33/1289677033.db2.gz FEBUKJXEYNXGCV-MRXNPFEDSA-N 2 0 330.407 2.899 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000873245487 1289677840 /nfs/dbraw/zinc/67/78/40/1289677840.db2.gz RCCJHAAIFXYOQW-ZOBUZTSGSA-N 2 0 335.467 2.830 20 10 EFCDRP Cc1ccc([C@H](C)Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c(O)c1C ZINC000873245958 1289678808 /nfs/dbraw/zinc/67/88/08/1289678808.db2.gz QJCPMKJBTVMOJB-HNNXBMFYSA-N 2 0 326.444 2.987 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1Cl ZINC000824554991 1289697536 /nfs/dbraw/zinc/69/75/36/1289697536.db2.gz ACNXCAYVWINZJV-UHFFFAOYSA-N 2 0 338.879 2.898 20 10 EFCDRP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000876631677 1290961042 /nfs/dbraw/zinc/96/10/42/1290961042.db2.gz MDRIMZFLUTWENO-UHFFFAOYSA-N 2 0 345.531 2.811 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCC(O)CC3)cc2)C[C@@H]1C ZINC000876757995 1291009776 /nfs/dbraw/zinc/00/97/76/1291009776.db2.gz HDALQXVNHGRJPP-PXNSSMCTSA-N 2 0 345.531 2.952 20 10 EFCDRP C[C@@H](C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C[NH+]1CCCCC1 ZINC000876948552 1291081542 /nfs/dbraw/zinc/08/15/42/1291081542.db2.gz NNDBJMLLCBLQQA-SFHVURJKSA-N 2 0 345.531 2.859 20 10 EFCDRP CC(C)(C)c1ccc(O)c(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)c1 ZINC001233286633 1312895566 /nfs/dbraw/zinc/89/55/66/1312895566.db2.gz CGFXWZROMSLQJI-UHFFFAOYSA-N 2 0 345.531 2.903 20 10 EFCDRP CC[C@H]([NH2+]CCCN1CCC(O)CC1)c1cc(Cl)ccc1O ZINC000775490335 1292707569 /nfs/dbraw/zinc/70/75/69/1292707569.db2.gz WDGLMRYCHCCPGN-INIZCTEOSA-N 2 0 326.868 2.933 20 10 EFCDRP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775500911 1292783295 /nfs/dbraw/zinc/78/32/95/1292783295.db2.gz AUMQZYBLTOLXNL-CZUORRHYSA-N 2 0 325.884 2.722 20 10 EFCDRP CCC[NH+](CCC)CCN1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC001203596898 1312966864 /nfs/dbraw/zinc/96/68/64/1312966864.db2.gz SPNNEZGZRBWSDH-UHFFFAOYSA-N 2 0 349.519 2.640 20 10 EFCDRP C[NH+]1CCC2(C[NH+](Cc3cc(Br)ccc3O)C2)CC1 ZINC001203650185 1312980768 /nfs/dbraw/zinc/98/07/68/1312980768.db2.gz LVAQJPAGOLMQQY-UHFFFAOYSA-N 2 0 325.250 2.682 20 10 EFCDRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3cccc(OC(F)(F)F)c3O)C2)C1 ZINC001233768155 1312987688 /nfs/dbraw/zinc/98/76/88/1312987688.db2.gz KZUQFKWZXFFDOY-HNNXBMFYSA-N 2 0 330.350 2.818 20 10 EFCDRP Cc1ncc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c(C)n1 ZINC000883289606 1293532731 /nfs/dbraw/zinc/53/27/31/1293532731.db2.gz UUWKEZFPJUAMLD-HNNXBMFYSA-N 2 0 339.487 2.696 20 10 EFCDRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883290015 1293533191 /nfs/dbraw/zinc/53/31/91/1293533191.db2.gz IHBMGLMGCXCTKY-ICSRJNTNSA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000883291043 1293534085 /nfs/dbraw/zinc/53/40/85/1293534085.db2.gz QEMHVTMZGGHBFU-LJQANCHMSA-N 2 0 337.467 2.921 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1cccc(O)c1 ZINC000775634674 1293794333 /nfs/dbraw/zinc/79/43/33/1293794333.db2.gz TXQVPGTXNCLIDU-UHFFFAOYSA-N 2 0 325.456 2.776 20 10 EFCDRP C[N@H+](CCC1CCOCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775713381 1294214591 /nfs/dbraw/zinc/21/45/91/1294214591.db2.gz LPQAGMIKVGYDOA-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775716690 1294232705 /nfs/dbraw/zinc/23/27/05/1294232705.db2.gz LBXJJCTXSKXGEN-FQEVSTJZSA-N 3 0 344.547 2.745 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000300403722 1295396131 /nfs/dbraw/zinc/39/61/31/1295396131.db2.gz ACIPFSYDNDRHIB-KGLIPLIRSA-N 2 0 325.250 2.871 20 10 EFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)CC1 ZINC000305300261 1296078900 /nfs/dbraw/zinc/07/89/00/1296078900.db2.gz HKRVFBYVUVYWTR-TZIWHRDSSA-N 2 0 343.515 2.612 20 10 EFCDRP c1c(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001234992385 1313219102 /nfs/dbraw/zinc/21/91/02/1313219102.db2.gz JAKLNVGWZICJMX-OAQYLSRUSA-N 2 0 325.500 2.961 20 10 EFCDRP c1c(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001234992375 1313219136 /nfs/dbraw/zinc/21/91/36/1313219136.db2.gz JAKLNVGWZICJMX-NRFANRHFSA-N 2 0 325.500 2.961 20 10 EFCDRP CCCCN(CCCC)c1ccc(CN2C[C@@H]([NH3+])C[C@H](O)C2)c(O)c1 ZINC001204954668 1313214907 /nfs/dbraw/zinc/21/49/07/1313214907.db2.gz HUMBNLSZWOLNOI-HKUYNNGSSA-N 2 0 349.519 2.693 20 10 EFCDRP Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CCO[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001234974806 1313215325 /nfs/dbraw/zinc/21/53/25/1313215325.db2.gz MVFNCACDQHDICU-YLJYHZDGSA-N 2 0 342.414 2.619 20 10 EFCDRP CC(C)(C)c1ccc(CN2CCOC[C@@]3(CCC[NH2+]C3)C2)c(O)c1 ZINC001235019488 1313225336 /nfs/dbraw/zinc/22/53/36/1313225336.db2.gz BJJWGCJBKPBEMS-HXUWFJFHSA-N 2 0 332.488 2.892 20 10 EFCDRP COCCOC[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccccc3O)(C1)CCC2 ZINC001275267597 1296246001 /nfs/dbraw/zinc/24/60/01/1296246001.db2.gz SLYVEPLXBZYZLK-MOPGFXCFSA-N 2 0 334.460 2.537 20 10 EFCDRP Cc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1O)CC2 ZINC001205164983 1313244083 /nfs/dbraw/zinc/24/40/83/1313244083.db2.gz ZCYNRUIUIYTPHY-UHFFFAOYSA-N 2 0 337.467 2.669 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001275802755 1296413312 /nfs/dbraw/zinc/41/33/12/1296413312.db2.gz NHSRJRAJKFQKOX-CALCHBBNSA-N 2 0 331.504 2.510 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCCC[C@H]3C3CC[NH2+]CC3)ccc21 ZINC001235158508 1313254653 /nfs/dbraw/zinc/25/46/53/1313254653.db2.gz KNJJNQNXZHHOGL-SFHVURJKSA-N 2 0 329.488 2.869 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCCC[C@]34CCC[NH2+]C4)cc2)CC1 ZINC001235167309 1313256053 /nfs/dbraw/zinc/25/60/53/1313256053.db2.gz HTBSZUBVSBNWEK-OAQYLSRUSA-N 3 0 342.531 2.547 20 10 EFCDRP CN1CCOc2cc(C[NH+]3CCC([C@H]4CCCC[NH2+]4)CC3)ccc21 ZINC001235231424 1313270413 /nfs/dbraw/zinc/27/04/13/1313270413.db2.gz YMWQPNQLDDRSTL-GOSISDBHSA-N 2 0 329.488 2.869 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C[C@@H]1C[NH3+] ZINC001205303364 1313267130 /nfs/dbraw/zinc/26/71/30/1313267130.db2.gz DAZNDWSHLIDHFH-PBHICJAKSA-N 2 0 329.488 2.508 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)cc1OC ZINC001235237228 1313271424 /nfs/dbraw/zinc/27/14/24/1313271424.db2.gz KMGCBHHQRVHWCY-INIZCTEOSA-N 2 0 334.460 2.764 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)c2ccccc2n1C ZINC001205581540 1313316927 /nfs/dbraw/zinc/31/69/27/1313316927.db2.gz VHTPNMNQTKNZKL-LJQANCHMSA-N 2 0 347.434 2.618 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc(O)c(Br)cc2O)CC[C@H]1C[NH3+] ZINC001205651127 1313330933 /nfs/dbraw/zinc/33/09/33/1313330933.db2.gz AIWFVKOZDFLMHE-QWRGUYRKSA-N 2 0 343.265 2.667 20 10 EFCDRP COc1ccc2ccc(O)c(C[N@@H+]3CCC(F)(F)[C@@H](C[NH3+])C3)c2c1 ZINC001205788673 1313356402 /nfs/dbraw/zinc/35/64/02/1313356402.db2.gz PQBBYNURGSLISD-ZDUSSCGKSA-N 2 0 336.382 2.970 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c2ccccc2n1C ZINC001206012260 1313391429 /nfs/dbraw/zinc/39/14/29/1313391429.db2.gz JIKFFQJTGRBZML-LSDHHAIUSA-N 2 0 343.471 2.772 20 10 EFCDRP COc1ccc(F)cc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000778186127 1297508563 /nfs/dbraw/zinc/50/85/63/1297508563.db2.gz PHXLSPCFPPYQNW-UHFFFAOYSA-N 2 0 343.446 2.876 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2cc(O)c(Br)cc2O)CCC[C@@H]1C[NH3+] ZINC001206024569 1313393466 /nfs/dbraw/zinc/39/34/66/1313393466.db2.gz KIEMZKPDMNCMIX-GHMZBOCLSA-N 2 0 343.265 2.667 20 10 EFCDRP C[N@H+](C/C=C/c1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001235961617 1313423775 /nfs/dbraw/zinc/42/37/75/1313423775.db2.gz HXEXMXALKNKQFO-VMPITWQZSA-N 2 0 337.467 2.947 20 10 EFCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)cc2F)CC1 ZINC001206311698 1313434384 /nfs/dbraw/zinc/43/43/84/1313434384.db2.gz SICUXXALDPZLBS-IBGZPJMESA-N 2 0 335.467 2.613 20 10 EFCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)cc2F)CC1 ZINC001206311699 1313434530 /nfs/dbraw/zinc/43/45/30/1313434530.db2.gz SICUXXALDPZLBS-LJQANCHMSA-N 2 0 335.467 2.613 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c2ccccc2n1C ZINC001206317218 1313434908 /nfs/dbraw/zinc/43/49/08/1313434908.db2.gz DBMCSFYFYDFIQR-FQEVSTJZSA-N 2 0 343.471 2.916 20 10 EFCDRP CCCC[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[NH2+]1 ZINC001236141773 1313446400 /nfs/dbraw/zinc/44/64/00/1313446400.db2.gz MCVCBADWZFXOPP-SFHVURJKSA-N 2 0 348.510 2.542 20 10 EFCDRP CN(C)c1ccc(C[N@H+](C)Cc2cccc(N3CC[NH2+]CC3)c2)cc1 ZINC001236189093 1313453799 /nfs/dbraw/zinc/45/37/99/1313453799.db2.gz JMFHYPQTNKWHHJ-UHFFFAOYSA-N 2 0 338.499 2.794 20 10 EFCDRP Oc1cccc(Br)c1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236320206 1313468469 /nfs/dbraw/zinc/46/84/69/1313468469.db2.gz MENKUEKNSVFLOQ-TXEJJXNPSA-N 2 0 325.250 2.586 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)cc(C)c1O)C[C@H]1CC[NH2+]C1 ZINC001236409165 1313476945 /nfs/dbraw/zinc/47/69/45/1313476945.db2.gz SJURGPZNUMZFRH-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP CC[N@@H+](Cc1cc(Br)c(C)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236410610 1313477205 /nfs/dbraw/zinc/47/72/05/1313477205.db2.gz HXSQDVRSDQFIBJ-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP CC1(C)CC([NH2+]Cc2ccc(N3CCOCC3)cc2)CC(C)(C)[NH2+]1 ZINC000078409715 1298271317 /nfs/dbraw/zinc/27/13/17/1298271317.db2.gz ZPVMIKBQXCSGHI-UHFFFAOYSA-N 2 0 331.504 2.922 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN([C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236653252 1313503335 /nfs/dbraw/zinc/50/33/35/1313503335.db2.gz QIRQPFCMBXJCFU-OAQYLSRUSA-N 2 0 342.531 2.593 20 10 EFCDRP COc1cc(O)c(CN([C@H]2CC[NH2+]C2)C2CCCCC2)c(OC)c1 ZINC001236653113 1313503576 /nfs/dbraw/zinc/50/35/76/1313503576.db2.gz OGFIDOHPUDCBNW-HNNXBMFYSA-N 2 0 334.460 2.906 20 10 EFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)C2CC[NH2+]CC2)cc1 ZINC001236912552 1313551215 /nfs/dbraw/zinc/55/12/15/1313551215.db2.gz VQLKCHAMNKVIFC-UHFFFAOYSA-N 2 0 332.536 2.648 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(C(C)(C)C)ccc1O)C1CC[NH2+]CC1 ZINC001236919514 1313552684 /nfs/dbraw/zinc/55/26/84/1313552684.db2.gz KSQDTEMBDLYYBS-UHFFFAOYSA-N 2 0 333.520 2.805 20 10 EFCDRP CN(C)c1ccc(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c(Cl)c1 ZINC001236930471 1313555197 /nfs/dbraw/zinc/55/51/97/1313555197.db2.gz AYYCKJIFUZHXFO-KRWDZBQOSA-N 2 0 338.927 2.522 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)C[C@]3(C)CO)c(F)c2)CC1 ZINC001236933131 1313556731 /nfs/dbraw/zinc/55/67/31/1313556731.db2.gz VGDUASVPIJYHNZ-HXUWFJFHSA-N 2 0 349.494 2.560 20 10 EFCDRP COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236935246 1313557453 /nfs/dbraw/zinc/55/74/53/1313557453.db2.gz FRVQLJSFIKVEPM-IBGZPJMESA-N 2 0 349.494 2.967 20 10 EFCDRP CCCO[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940912 1313558367 /nfs/dbraw/zinc/55/83/67/1313558367.db2.gz WJGYXADPELCZAT-GOSISDBHSA-N 2 0 335.467 2.578 20 10 EFCDRP CCOc1ccc(C[NH+]2CCN(CCC[NH+](CC)CC)CC2)c(O)c1 ZINC001237045104 1313574257 /nfs/dbraw/zinc/57/42/57/1313574257.db2.gz XBAVMCNSJUESRQ-UHFFFAOYSA-N 2 0 349.519 2.640 20 10 EFCDRP CCOc1ccc(CN2CCC([N@H+](C)C3CCOCC3)CC2)c(O)c1 ZINC001237042884 1313574666 /nfs/dbraw/zinc/57/46/66/1313574666.db2.gz LBVZMXIMRJSWJB-UHFFFAOYSA-N 2 0 348.487 2.866 20 10 EFCDRP C[NH+]1CCC2(C[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C2)CC1 ZINC001237059429 1313578511 /nfs/dbraw/zinc/57/85/11/1313578511.db2.gz NAJSZYKAIMFQOK-UHFFFAOYSA-N 2 0 344.377 2.861 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1c(O)cccc1OC(F)(F)F)CC2 ZINC001237114095 1313587950 /nfs/dbraw/zinc/58/79/50/1313587950.db2.gz HFBNXRDKLLIKSY-UHFFFAOYSA-N 2 0 330.350 2.818 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN(C3CCC3)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001237157150 1313594362 /nfs/dbraw/zinc/59/43/62/1313594362.db2.gz ZHALDIYQUVHCLY-NRFANRHFSA-N 2 0 342.531 2.545 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCNC4=CCCC[C@@H]43)cc2)CC1 ZINC001237224645 1313609409 /nfs/dbraw/zinc/60/94/09/1313609409.db2.gz HXXGUOGPBOUFNL-NRFANRHFSA-N 2 0 340.515 2.670 20 10 EFCDRP CO[C@@H]1[C@H](C)[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000776497810 1299317160 /nfs/dbraw/zinc/31/71/60/1299317160.db2.gz GBQYLOITEMGKNN-AYOQOUSVSA-N 2 0 331.504 2.588 20 10 EFCDRP c1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237405797 1313639061 /nfs/dbraw/zinc/63/90/61/1313639061.db2.gz RWCBVCUFEZVNJE-WOJBJXKFSA-N 2 0 325.500 2.959 20 10 EFCDRP FC(F)(F)Oc1ccc(N2CC[NH+](CC3CC[NH2+]CC3)CC2)cc1 ZINC001207443004 1313685321 /nfs/dbraw/zinc/68/53/21/1313685321.db2.gz KLMAQBLIJLQCCV-UHFFFAOYSA-N 2 0 343.393 2.707 20 10 EFCDRP COc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c(O)c(OC)c1 ZINC001237680470 1313690293 /nfs/dbraw/zinc/69/02/93/1313690293.db2.gz KGSPXMUNSQXHTK-UHFFFAOYSA-N 2 0 334.460 2.717 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CC3(C2)CC[NH+](C)CC3)cc1Br ZINC001237681077 1313690601 /nfs/dbraw/zinc/69/06/01/1313690601.db2.gz GYXWRBJXPSWPAH-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP COc1cc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c(O)c(OC)c1 ZINC001237676524 1313689313 /nfs/dbraw/zinc/68/93/13/1313689313.db2.gz PJANUVPKJQBUAW-UHFFFAOYSA-N 2 0 348.487 2.963 20 10 EFCDRP Cc1cc(O)c(CNc2cc(N3CC[NH+](C)CC3)cc[nH+]2)cc1C ZINC000865296119 1303211166 /nfs/dbraw/zinc/21/11/66/1303211166.db2.gz QXKROGOJFQJFBY-UHFFFAOYSA-N 2 0 326.444 2.768 20 10 EFCDRP C[N@@H+]1CCCC2(CC[NH+](Cc3ccc(N4CCOCC4)cc3)CC2)C1 ZINC001276635298 1314144749 /nfs/dbraw/zinc/14/47/49/1314144749.db2.gz FDJSOXFTLWPICA-UHFFFAOYSA-N 2 0 343.515 2.831 20 10 EFCDRP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3ccc(N4CCOCC4)cc3)C2)C1 ZINC001276635622 1314144852 /nfs/dbraw/zinc/14/48/52/1314144852.db2.gz RARCXLZURFEPEX-NRFANRHFSA-N 2 0 343.515 2.831 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)COC(C)C)cc2F)CC1 ZINC000800233523 1307597679 /nfs/dbraw/zinc/59/76/79/1307597679.db2.gz AMPLYTIXGHVPLQ-INIZCTEOSA-N 2 0 337.483 2.871 20 10 EFCDRP CCCC[N@H+](CC(=O)NC1CC[NH+](CC)CC1)Cc1ccccc1O ZINC000801595744 1310573173 /nfs/dbraw/zinc/57/31/73/1310573173.db2.gz RMYSTVLYTCWKQK-UHFFFAOYSA-N 2 0 347.503 2.595 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCC[NH2+]4)C3)cc2)CC1 ZINC001222354855 1311118276 /nfs/dbraw/zinc/11/82/76/1311118276.db2.gz OIDPWFIJXAQGGE-OAQYLSRUSA-N 3 0 342.531 2.547 20 10 EFCDRP Cc1cc(C[NH+]2CCC(F)(C[NH3+])CC2)c(O)cc1Br ZINC001222553271 1311151967 /nfs/dbraw/zinc/15/19/67/1311151967.db2.gz RNGIQCOFZIAAHL-UHFFFAOYSA-N 2 0 331.229 2.726 20 10 EFCDRP CCO[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000903087435 1312341665 /nfs/dbraw/zinc/34/16/65/1312341665.db2.gz GPXMFCQZOMDWJF-ICSRJNTNSA-N 2 0 331.504 2.876 20 10 EFCDRP Cc1cc(F)cc(C[NH2+][C@@]23CC[C@@](NCC[NH+](C)C)(C2)CCC3)c1O ZINC001277519993 1312500449 /nfs/dbraw/zinc/50/04/49/1312500449.db2.gz UHZLTAUCIBUZHV-UXHICEINSA-N 2 0 349.494 2.926 20 10 EFCDRP CCN(CCC[NH+](C)C)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001232201869 1312647572 /nfs/dbraw/zinc/64/75/72/1312647572.db2.gz NZQSUMNEVVXCPE-UHFFFAOYSA-N 2 0 339.911 2.950 20 10 EFCDRP C[NH+]1CCN(c2ccc(C3=CC[C@@H]([NH+]4CCOCC4)CC3)cc2)CC1 ZINC001245427085 1314489438 /nfs/dbraw/zinc/48/94/38/1314489438.db2.gz VQSBJUAFYODUFG-OAQYLSRUSA-N 2 0 341.499 2.707 20 10 EFCDRP c1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CS2 ZINC001246173334 1314593582 /nfs/dbraw/zinc/59/35/82/1314593582.db2.gz LJDBFWGVZVBYCA-GOSISDBHSA-N 2 0 339.508 2.903 20 10 EFCDRP CCCC[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[NH2+]1 ZINC001246184725 1314594957 /nfs/dbraw/zinc/59/49/57/1314594957.db2.gz OOXLKLXQHRVXFZ-VQTJNVASSA-N 3 0 344.547 2.839 20 10 EFCDRP c1ccn(-c2ccc(-c3nnc([C@H]4C[NH2+]CC45CC[NH2+]CC5)o3)cc2)c1 ZINC001217707316 1315104519 /nfs/dbraw/zinc/10/45/19/1315104519.db2.gz ZQKZPYSYGBLFAC-QGZVFWFLSA-N 2 0 349.438 2.584 20 10 EFCDRP Cc1cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c(O)cc1Br ZINC001250133976 1315177588 /nfs/dbraw/zinc/17/75/88/1315177588.db2.gz STDXREIPMPSTFK-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP Nc1ccc(N(Cc2ccccc2)C(=O)C[C@@H]([NH3+])CCCC[NH3+])cc1 ZINC001218955697 1315263757 /nfs/dbraw/zinc/26/37/57/1315263757.db2.gz ORUFTFOIZIRCDX-SFHVURJKSA-N 2 0 340.471 2.648 20 10 EFCDRP C[NH2+][C@@H](CCCC[NH3+])C(=O)N(Cc1ccccc1)c1ccc(N)cc1 ZINC001218955695 1315264036 /nfs/dbraw/zinc/26/40/36/1315264036.db2.gz OQVPISUBGDMFDB-IBGZPJMESA-N 2 0 340.471 2.519 20 10 EFCDRP [NH3+][C@H](CC(=O)Nc1ccc(C2([NH3+])CCC2)cc1)c1ccccc1O ZINC001218972009 1315266550 /nfs/dbraw/zinc/26/65/50/1315266550.db2.gz HGNKIHPWKBEAAB-MRXNPFEDSA-N 2 0 325.412 2.759 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](O)c2ccccc2)CC1 ZINC001252008574 1315403599 /nfs/dbraw/zinc/40/35/99/1315403599.db2.gz HJXPFWAHVFVVTR-HXUWFJFHSA-N 2 0 326.440 2.680 20 10 EFCDRP CC(C)c1ccc(C[N@@H+]2CCCC3(CN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001276815551 1315441879 /nfs/dbraw/zinc/44/18/79/1315441879.db2.gz VXBQOWQYTGORAN-UHFFFAOYSA-N 2 0 345.531 2.975 20 10 EFCDRP CC[NH+](CC)C[C@H](O)C[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001253216582 1315582394 /nfs/dbraw/zinc/58/23/94/1315582394.db2.gz OCFUZMFTUQWPGL-BEFAXECRSA-N 2 0 334.504 2.925 20 10 EFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C[C@H](O)C[NH2+]C(C)(C)C ZINC001253412400 1315601846 /nfs/dbraw/zinc/60/18/46/1315601846.db2.gz HABWCJYPNDROAB-KSSFIOAISA-N 2 0 334.504 2.971 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC001320245946 1329105513 /nfs/dbraw/zinc/10/55/13/1329105513.db2.gz KNUHNWLWMPXBMX-IRXDYDNUSA-N 2 0 331.504 2.866 20 10 EFCDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC001324543375 1329637868 /nfs/dbraw/zinc/63/78/68/1329637868.db2.gz SKMRANNBXYDJJW-SFHVURJKSA-N 2 0 337.467 2.921 20 10 EFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001324675678 1329650452 /nfs/dbraw/zinc/65/04/52/1329650452.db2.gz CDGDLXDYCSAMRC-UHFFFAOYSA-N 2 0 344.547 2.793 20 10 EFCDRP CN(CC[N@H+](C)Cc1ccc(N2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC001329771018 1330735195 /nfs/dbraw/zinc/73/51/95/1330735195.db2.gz MHKYFORKIYNTSK-UHFFFAOYSA-N 2 0 344.547 2.745 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccccc1N1CC[NH+](C)CC1)c1ccccc1O ZINC001337613491 1331587252 /nfs/dbraw/zinc/58/72/52/1331587252.db2.gz VOESTHSWTSAECJ-MRXNPFEDSA-N 2 0 325.456 2.995 20 10 EFCDRP CC[C@@H]1CO[C@H](C)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001341523430 1332264801 /nfs/dbraw/zinc/26/48/01/1332264801.db2.gz BFKPFFHVWVDNSB-NVXWUHKLSA-N 2 0 335.467 2.577 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC001344578239 1332464418 /nfs/dbraw/zinc/46/44/18/1332464418.db2.gz CSNFFZYQPOBLDD-HOTGVXAUSA-N 2 0 331.504 2.865 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCN4CCCC[C@@H]34)cc2)CC1 ZINC000848575716 1334803730 /nfs/dbraw/zinc/80/37/30/1334803730.db2.gz VYORRYHEQAVDGT-RTWAWAEBSA-N 3 0 342.531 2.545 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCN4CCCC[C@@H]34)cc2)CC1 ZINC000848575718 1334803868 /nfs/dbraw/zinc/80/38/68/1334803868.db2.gz VYORRYHEQAVDGT-SFTDATJTSA-N 3 0 342.531 2.545 20 10 EFCDRP Cc1cc(N2CC[NH+](Cc3ccc(N)cc3)CC2)nc(C(C)C)n1 ZINC001356082852 1334950088 /nfs/dbraw/zinc/95/00/88/1334950088.db2.gz FSFLXSSJLMLLAB-UHFFFAOYSA-N 2 0 325.460 2.813 20 10 EFCDRP CCc1cccc(C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)c1O ZINC000848895753 1334967647 /nfs/dbraw/zinc/96/76/47/1334967647.db2.gz WULGTUDQCSFSPT-UHFFFAOYSA-N 2 0 331.504 2.603 20 10 EFCDRP [NH2+]=C(NCc1ccccc1O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000849058164 1335063074 /nfs/dbraw/zinc/06/30/74/1335063074.db2.gz RGLYMHUTWWCCJQ-UHFFFAOYSA-N 2 0 338.455 2.671 20 10 EFCDRP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1ccc(N2CCOCC2)cc1Cl ZINC000925740839 716202508 /nfs/dbraw/zinc/20/25/08/716202508.db2.gz LYUKHKYMJWZHQF-CYBMUJFWSA-N 2 0 325.884 2.955 20 10 EFCDRP COc1ccc(C[NH2+][C@@H](Cn2ccnc2)C(C)(C)C)c(O)c1OC ZINC000892651527 718375507 /nfs/dbraw/zinc/37/55/07/718375507.db2.gz ZLOYVMWULPLDAG-HNNXBMFYSA-N 2 0 333.432 2.810 20 10 EFCDRP Cc1ccncc1CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895607728 724221843 /nfs/dbraw/zinc/22/18/43/724221843.db2.gz UWRYDTMJFVOXNY-UHFFFAOYSA-N 2 0 338.499 2.864 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CC3(Cl)Cl)cc2)CC1 ZINC000895608148 724221997 /nfs/dbraw/zinc/22/19/97/724221997.db2.gz YCXFGCNCJJSRFJ-AWEZNQCLSA-N 2 0 328.287 2.722 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895606799 724227854 /nfs/dbraw/zinc/22/78/54/724227854.db2.gz FYAUBXCLNABILA-UHFFFAOYSA-N 2 0 325.456 2.742 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)C1CC[NH+](C)CC1 ZINC000151550130 725644420 /nfs/dbraw/zinc/64/44/20/725644420.db2.gz JLWRZJLWUISIFE-HNNXBMFYSA-N 2 0 349.494 2.607 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3c[nH]nc3C)cc2F)CC1 ZINC000180498427 729751754 /nfs/dbraw/zinc/75/17/54/729751754.db2.gz LJYFSDUGYIZEHR-AWEZNQCLSA-N 2 0 345.466 2.850 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3CCC4(C3)CC[NH2+]CC4)cc2)CC1 ZINC001578941687 1090484055 /nfs/dbraw/zinc/48/40/55/1090484055.db2.gz WMZVHWWZGVZKJW-UHFFFAOYSA-N 2 0 343.515 2.877 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]Cc1cc(C(C)(C)[NH3+])no1 ZINC001579617008 1090643841 /nfs/dbraw/zinc/64/38/41/1090643841.db2.gz JWIFMLJEAFPZII-AWEZNQCLSA-N 2 0 330.476 2.964 20 10 EFCDRP C[NH+](C)C1CCC([NH2+]C2CCN(Cc3ccccc3O)CC2)CC1 ZINC001168305960 1106479174 /nfs/dbraw/zinc/47/91/74/1106479174.db2.gz WITWYOZXTFMJLK-UHFFFAOYSA-N 2 0 331.504 2.819 20 10 EFCDRP COc1ccc(N2CC[NH+](C3CCC([NH+](C)C)CC3)CC2)c(OC)c1 ZINC001168329424 1106939529 /nfs/dbraw/zinc/93/95/29/1106939529.db2.gz TVZKPBOEIKGYHP-UHFFFAOYSA-N 2 0 347.503 2.699 20 10 EFCDRP CC[N@@H+]1CC[C@H](NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)[C@@H](C)C1 ZINC000898450570 1108943899 /nfs/dbraw/zinc/94/38/99/1108943899.db2.gz RYWNBHHMYGVWML-VDGAXYAQSA-N 2 0 332.536 2.675 20 10 EFCDRP Cc1cc(Br)cc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c1O ZINC001235957050 1111932744 /nfs/dbraw/zinc/93/27/44/1111932744.db2.gz KCAGBAXQOGCZNG-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP CC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(N(C)C)cc1 ZINC000160218922 529602082 /nfs/dbraw/zinc/60/20/82/529602082.db2.gz BBKSADFQUKUVOV-FQEVSTJZSA-N 2 0 332.536 2.819 20 10 EFCDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)CC1 ZINC000367684879 242388199 /nfs/dbraw/zinc/38/81/99/242388199.db2.gz IZWOQQGJBXFUJR-HXUWFJFHSA-N 2 0 343.515 2.687 20 10 EFCDRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000184900154 473267511 /nfs/dbraw/zinc/26/75/11/473267511.db2.gz NJLNFCYENXHFAP-INIZCTEOSA-N 2 0 331.504 2.559 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000184900173 473267546 /nfs/dbraw/zinc/26/75/46/473267546.db2.gz NJLNFCYENXHFAP-MRXNPFEDSA-N 2 0 331.504 2.559 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c(O)c1 ZINC000184968965 473286811 /nfs/dbraw/zinc/28/68/11/473286811.db2.gz TVGCQVQDDLDFDT-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP C[N@@H+]1CCCC[C@H]1CN1CCN(Cc2c(O)cccc2Cl)CC1 ZINC000120052796 472622387 /nfs/dbraw/zinc/62/23/87/472622387.db2.gz MABZQGGHFOZMLO-HNNXBMFYSA-N 2 0 337.895 2.648 20 10 EFCDRP COc1cccc(C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1O ZINC000092587382 472943191 /nfs/dbraw/zinc/94/31/91/472943191.db2.gz OEGQGANRVRURCF-HZPDHXFCSA-N 2 0 348.487 2.722 20 10 EFCDRP C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)CN1CC[NH+](C)CC1 ZINC000185343671 473399751 /nfs/dbraw/zinc/39/97/51/473399751.db2.gz MBZPCXTXBGMPQL-KGLIPLIRSA-N 2 0 325.884 2.580 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185344939 473401216 /nfs/dbraw/zinc/40/12/16/473401216.db2.gz CZLMUFGOVUOHET-CABCVRRESA-N 2 0 339.911 2.970 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185392448 473414879 /nfs/dbraw/zinc/41/48/79/473414879.db2.gz MXVLQJVZBSXBOG-CVEARBPZSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1cc(Cl)ccc1O ZINC000185414282 473420460 /nfs/dbraw/zinc/42/04/60/473420460.db2.gz XRVGJXHHXROGRG-UKRRQHHQSA-N 2 0 326.868 2.933 20 10 EFCDRP C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127307625 473598075 /nfs/dbraw/zinc/59/80/75/473598075.db2.gz SZJRDBMGJNQJHA-MOPGFXCFSA-N 2 0 344.547 2.963 20 10 EFCDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1 ZINC000186197237 473613645 /nfs/dbraw/zinc/61/36/45/473613645.db2.gz LXFPSCKEKYXROP-OAHLLOKOSA-N 2 0 329.444 2.887 20 10 EFCDRP C[N@@H+]1CCN(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(C)C ZINC000282287615 474009486 /nfs/dbraw/zinc/00/94/86/474009486.db2.gz IRASCPMRRAENRY-UHFFFAOYSA-N 2 0 344.547 2.793 20 10 EFCDRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 ZINC000264930136 474162077 /nfs/dbraw/zinc/16/20/77/474162077.db2.gz AHCBOJFDNPFANG-IYBDPMFKSA-N 2 0 337.483 2.871 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1OC ZINC000271089467 474401675 /nfs/dbraw/zinc/40/16/75/474401675.db2.gz KHHJVYUNIKIMIB-OAHLLOKOSA-N 2 0 334.460 2.573 20 10 EFCDRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)CC1 ZINC000271199592 474439105 /nfs/dbraw/zinc/43/91/05/474439105.db2.gz INMILMVFPRAQBA-UHFFFAOYSA-N 2 0 344.547 2.743 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cn[nH]c3)cc2F)CC1 ZINC000283934162 474530276 /nfs/dbraw/zinc/53/02/76/474530276.db2.gz FERYOHNIJCMGJX-AWEZNQCLSA-N 2 0 331.439 2.542 20 10 EFCDRP Cc1cccc(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000271790751 474591880 /nfs/dbraw/zinc/59/18/80/474591880.db2.gz JAVDKTVLZAJUDP-UHFFFAOYSA-N 2 0 331.504 2.691 20 10 EFCDRP Cc1cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)ccc1N(C)C ZINC000293551409 475035300 /nfs/dbraw/zinc/03/53/00/475035300.db2.gz RFQHCDKOMBAMJT-UHFFFAOYSA-N 2 0 331.504 2.605 20 10 EFCDRP C[N@@H+]1CC[C@]2(CCN(Cc3cc(Br)ccc3O)C2)C1 ZINC000292777170 475192797 /nfs/dbraw/zinc/19/27/97/475192797.db2.gz LALDBUKAAOTCFA-HNNXBMFYSA-N 2 0 325.250 2.682 20 10 EFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423081378 476920701 /nfs/dbraw/zinc/92/07/01/476920701.db2.gz BMQHYYCRSVKDPP-OKZBNKHCSA-N 2 0 327.472 2.733 20 10 EFCDRP Oc1ccc(Cl)cc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000371416633 477307092 /nfs/dbraw/zinc/30/70/92/477307092.db2.gz MVDFSKJGKYTUFC-UHFFFAOYSA-N 2 0 338.879 2.980 20 10 EFCDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c1 ZINC000185491844 534202666 /nfs/dbraw/zinc/20/26/66/534202666.db2.gz WKWDLRJFTDYQGI-CABCVRRESA-N 2 0 334.460 2.552 20 10 EFCDRP CC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(N(C)C)cc1 ZINC000160219045 529164967 /nfs/dbraw/zinc/16/49/67/529164967.db2.gz BBKSADFQUKUVOV-HXUWFJFHSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756395905 575730294 /nfs/dbraw/zinc/73/02/94/575730294.db2.gz KUKKDQQHQICREU-CJNGLKHVSA-N 2 0 335.467 2.695 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)N1CC[NH+](C)CC1 ZINC000756398125 575730722 /nfs/dbraw/zinc/73/07/22/575730722.db2.gz BTLJORIXIJSWDI-HYVNUMGLSA-N 2 0 349.494 2.941 20 10 EFCDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Cl)ccc1O ZINC000756408490 575732646 /nfs/dbraw/zinc/73/26/46/575732646.db2.gz OPBKNMBFXQZAQA-CQSZACIVSA-N 2 0 325.884 2.724 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756548150 575759226 /nfs/dbraw/zinc/75/92/26/575759226.db2.gz IYMJZLBFUSCJMS-HOCLYGCPSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756636505 575771387 /nfs/dbraw/zinc/77/13/87/575771387.db2.gz DYDVAPBUUHRDFH-CJNGLKHVSA-N 2 0 335.467 2.695 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000765039196 576539679 /nfs/dbraw/zinc/53/96/79/576539679.db2.gz RGVIBFFSFLIBKC-HKUYNNGSSA-N 2 0 329.488 2.880 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000765039234 576539735 /nfs/dbraw/zinc/53/97/35/576539735.db2.gz SFYCCFAEDQBVQQ-HQRMLTQVSA-N 2 0 329.488 2.801 20 10 EFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)C1 ZINC000765473344 577044956 /nfs/dbraw/zinc/04/49/56/577044956.db2.gz XPHSBGHQBWYGOV-KRWDZBQOSA-N 2 0 331.504 2.986 20 10 EFCDRP CC[NH+]1CCC(C[NH2+]C2CCN(c3ccc(OC)cc3)CC2)CC1 ZINC000765772898 577075240 /nfs/dbraw/zinc/07/52/40/577075240.db2.gz XMEPGYQSZSQNPC-UHFFFAOYSA-N 2 0 331.504 2.986 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(C)CCO[C@H]3C3CC3)cc2)CC1 ZINC000767194207 577199443 /nfs/dbraw/zinc/19/94/43/577199443.db2.gz ASTYSYROZNTKCU-SFTDATJTSA-N 2 0 343.515 2.733 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000770006613 577397551 /nfs/dbraw/zinc/39/75/51/577397551.db2.gz YZQRXHCPLROPPV-SQWLQELKSA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@@H](CC1CCOCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771842604 581249509 /nfs/dbraw/zinc/24/95/09/581249509.db2.gz JHYBCAATGWRBEI-KRWDZBQOSA-N 2 0 331.504 2.733 20 10 EFCDRP CCC1(O)CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000771875306 581253612 /nfs/dbraw/zinc/25/36/12/581253612.db2.gz QPBSEZXHCRBRCT-UHFFFAOYSA-N 2 0 331.504 2.612 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4ccc(O)cc43)cc2)CC1 ZINC000850386763 1250458673 /nfs/dbraw/zinc/45/86/73/1250458673.db2.gz MEALKIMSHXHGGW-NRFANRHFSA-N 2 0 337.467 2.921 20 10 EFCDRP CO[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCC1 ZINC000850401362 1250467118 /nfs/dbraw/zinc/46/71/18/1250467118.db2.gz YEKIZLCQYUAWPA-FQEVSTJZSA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnn(C4CCC4)c3)cc2)CC1 ZINC000922333722 1265597771 /nfs/dbraw/zinc/59/77/71/1265597771.db2.gz XCEWKNXXJHUKHJ-UHFFFAOYSA-N 2 0 339.487 2.650 20 10 EFCDRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921860689 1262922766 /nfs/dbraw/zinc/92/27/66/1262922766.db2.gz UPDCPKODLOJQFK-UXHICEINSA-N 2 0 344.499 2.869 20 10 EFCDRP CCn1cc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cn1 ZINC000825129771 1278422524 /nfs/dbraw/zinc/42/25/24/1278422524.db2.gz DPIQZGSVBBTTSI-MRXNPFEDSA-N 2 0 327.476 2.506 20 10 EFCDRP C[C@H](CNCc1c(O)cccc1Br)C[NH+]1CCCC1 ZINC000706874961 1275065532 /nfs/dbraw/zinc/06/55/32/1275065532.db2.gz DANAYIRZJVPUBD-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1c(O)ccc2ccncc21 ZINC000746644223 1275682916 /nfs/dbraw/zinc/68/29/16/1275682916.db2.gz ASNXLNRPJWASJD-ZTNFWEORSA-N 2 0 341.455 2.624 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817897942 1276366497 /nfs/dbraw/zinc/36/64/97/1276366497.db2.gz AWAYZDQZAMFRJG-ZQIUZPCESA-N 2 0 339.430 2.974 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN[C@@H](C)[C@H]3CCCC[NH2+]3)cc2F)CC1 ZINC000817902369 1276366888 /nfs/dbraw/zinc/36/68/88/1276366888.db2.gz OXXJXSNAWRRHJD-QFBILLFUSA-N 2 0 348.510 2.588 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1F ZINC000817903260 1276367007 /nfs/dbraw/zinc/36/70/07/1276367007.db2.gz LOJLNNLZJGNQBV-BHIYHBOVSA-N 2 0 349.494 2.919 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN[C@@H](C)[C@@H]3CCCC[NH2+]3)cc2F)CC1 ZINC000817902368 1276367057 /nfs/dbraw/zinc/36/70/57/1276367057.db2.gz OXXJXSNAWRRHJD-LPHOPBHVSA-N 2 0 348.510 2.588 20 10 EFCDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903205 1276367667 /nfs/dbraw/zinc/36/76/67/1276367667.db2.gz KFCRUMRCQFRBKQ-OLZOCXBDSA-N 2 0 327.419 2.972 20 10 EFCDRP C[C@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(N2CCCCC2)cc1 ZINC000817937350 1276383790 /nfs/dbraw/zinc/38/37/90/1276383790.db2.gz WTKHUSCJPZIWMC-SFHVURJKSA-N 2 0 330.520 2.623 20 10 EFCDRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000817978024 1276416954 /nfs/dbraw/zinc/41/69/54/1276416954.db2.gz UCENUZGCLMCJAE-ZIAGYGMSSA-N 2 0 325.884 2.955 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000817976632 1276417093 /nfs/dbraw/zinc/41/70/93/1276417093.db2.gz PWOQKPHMLFRWQM-YGRLFVJLSA-N 2 0 325.250 2.947 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817985484 1276424221 /nfs/dbraw/zinc/42/42/21/1276424221.db2.gz KPPMAHZSMSDNKW-DZJNRPSUSA-N 2 0 347.478 2.701 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817987450 1276427892 /nfs/dbraw/zinc/42/78/92/1276427892.db2.gz ZLPBXLGGNZKYCT-DOTOQJQBSA-N 2 0 347.478 2.988 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000818221955 1276493635 /nfs/dbraw/zinc/49/36/35/1276493635.db2.gz PTXNUSGPRXGBQK-ZIFCJYIRSA-N 2 0 329.488 2.738 20 10 EFCDRP COc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000818343983 1276511587 /nfs/dbraw/zinc/51/15/87/1276511587.db2.gz GTLCUTLCVYBSEL-SFHVURJKSA-N 2 0 343.515 2.986 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CCCC[C@H]2[NH3+])c1O ZINC000818431434 1276516281 /nfs/dbraw/zinc/51/62/81/1276516281.db2.gz MDYPMHCMVLPCMN-VXGBXAGGSA-N 2 0 329.238 2.523 20 10 EFCDRP Cc1cc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)ccc1N(C)C ZINC000815029106 1287276172 /nfs/dbraw/zinc/27/61/72/1287276172.db2.gz NWRROLQRTUQQOL-UHFFFAOYSA-N 2 0 345.531 2.995 20 10 EFCDRP Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)ccc1N(C)C ZINC000815074260 1287300827 /nfs/dbraw/zinc/30/08/27/1287300827.db2.gz NMHVIFJRPRLKMO-YZGWKJHDSA-N 2 0 331.504 2.745 20 10 EFCDRP C[N@@H+](Cc1c(O)cc(O)cc1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001144514437 1279774820 /nfs/dbraw/zinc/77/48/20/1279774820.db2.gz DGGXIGVCCIHXPG-INIZCTEOSA-N 2 0 342.439 2.757 20 10 EFCDRP COc1ccc(C[NH2+][C@H](C)C[C@@H](C)NC(=O)C[N@H+](C)C(C)C)cc1C ZINC001146600032 1280947498 /nfs/dbraw/zinc/94/74/98/1280947498.db2.gz DSUSHHMOUBVLAQ-IAGOWNOFSA-N 2 0 349.519 2.717 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H](O)c1ccccc1 ZINC000808446912 1281715830 /nfs/dbraw/zinc/71/58/30/1281715830.db2.gz XLSUJIRPEMJJDE-DYESRHJHSA-N 2 0 339.483 2.650 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693301 1281847516 /nfs/dbraw/zinc/84/75/16/1281847516.db2.gz YOBCQLBAFBGGBQ-UKRRQHHQSA-N 2 0 339.911 2.888 20 10 EFCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000809767502 1282431098 /nfs/dbraw/zinc/43/10/98/1282431098.db2.gz MZORJKSBCHSRTH-MJGOQNOKSA-N 2 0 347.478 2.578 20 10 EFCDRP Cc1cccc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000809786879 1282486304 /nfs/dbraw/zinc/48/63/04/1282486304.db2.gz NPMHGTMNYQRIMI-UHFFFAOYSA-N 2 0 329.444 2.716 20 10 EFCDRP CC(C)COCC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001172454721 1286156523 /nfs/dbraw/zinc/15/65/23/1286156523.db2.gz BOVMHTXDPNCGJY-GOSISDBHSA-N 2 0 333.520 2.979 20 10 EFCDRP COC(=O)[C@@H]1CCC[C@@H]([NH2+]C2CCN(Cc3ccccc3O)CC2)C1 ZINC001172605467 1286199730 /nfs/dbraw/zinc/19/97/30/1286199730.db2.gz XQTUQZAURDSHIO-CRAIPNDOSA-N 2 0 346.471 2.678 20 10 EFCDRP CC(C)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(CO)CCC1 ZINC000814169505 1286372676 /nfs/dbraw/zinc/37/26/76/1286372676.db2.gz IZPQLKXOKXUIHH-HXUWFJFHSA-N 2 0 345.531 2.715 20 10 EFCDRP COc1ccc(C[NH2+][C@H](C)C[C@@H](C)NC(=O)CCC[NH+](C)C)cc1C ZINC001135314540 1287942933 /nfs/dbraw/zinc/94/29/33/1287942933.db2.gz CINRJHWQXNWRAA-IAGOWNOFSA-N 2 0 349.519 2.718 20 10 EFCDRP CC[NH+](CC)[C@@H](C(=O)NCC[NH2+]Cc1ccc(OC)c(C)c1)C(C)C ZINC001135474301 1288023948 /nfs/dbraw/zinc/02/39/48/1288023948.db2.gz MPQJTWYJFIDPDW-LJQANCHMSA-N 2 0 349.519 2.576 20 10 EFCDRP CC[C@H]1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC)O1 ZINC000817412072 1288590562 /nfs/dbraw/zinc/59/05/62/1288590562.db2.gz CLFLZYCRIVFEBC-PMACEKPBSA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001206327750 1288776938 /nfs/dbraw/zinc/77/69/38/1288776938.db2.gz XAPHZKVAHKZCFG-HNNXBMFYSA-N 2 0 343.265 2.811 20 10 EFCDRP COc1ccc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1Cn1cccn1 ZINC000873013713 1289520042 /nfs/dbraw/zinc/52/00/42/1289520042.db2.gz GJBDVLFXHSYYCP-OALUTQOASA-N 2 0 340.471 2.656 20 10 EFCDRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000873029535 1289529316 /nfs/dbraw/zinc/52/93/16/1289529316.db2.gz JWRJSRCGKYJAKE-SFHVURJKSA-N 2 0 342.487 2.762 20 10 EFCDRP COc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1Cn1cccn1 ZINC000873132681 1289587543 /nfs/dbraw/zinc/58/75/43/1289587543.db2.gz ZOWQZSWMXQTDQD-UHFFFAOYSA-N 2 0 342.487 2.902 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CC3(CO2)CC[NH2+]CC3)cc1 ZINC000873290197 1289704616 /nfs/dbraw/zinc/70/46/16/1289704616.db2.gz BIUFLPDIBNJDCP-VQIMIIECSA-N 2 0 331.504 2.952 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC3(CO2)CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000873291972 1289705968 /nfs/dbraw/zinc/70/59/68/1289705968.db2.gz JNDASXUSVRBJMS-UMVBOHGHSA-N 2 0 334.435 2.828 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC3(CO2)CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000873291971 1289706115 /nfs/dbraw/zinc/70/61/15/1289706115.db2.gz JNDASXUSVRBJMS-NFAWXSAZSA-N 2 0 334.435 2.828 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCC(O)CC3)cc2)C[C@@H]1C ZINC000876757993 1291009872 /nfs/dbraw/zinc/00/98/72/1291009872.db2.gz HDALQXVNHGRJPP-FXAWDEMLSA-N 2 0 345.531 2.952 20 10 EFCDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877073490 1291125803 /nfs/dbraw/zinc/12/58/03/1291125803.db2.gz LMFVSTBDJYQZAY-PKOBYXMFSA-N 2 0 331.504 2.610 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000877190433 1291160868 /nfs/dbraw/zinc/16/08/68/1291160868.db2.gz FJIHKDWJKGLXOL-IBGZPJMESA-N 2 0 340.467 2.947 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000877190434 1291160980 /nfs/dbraw/zinc/16/09/80/1291160980.db2.gz FJIHKDWJKGLXOL-LJQANCHMSA-N 2 0 340.467 2.947 20 10 EFCDRP Fc1cc(CN2CC[C@H](C[NH+]3CCCC3)C2)ccc1N1CCOCC1 ZINC000093597560 1291178227 /nfs/dbraw/zinc/17/82/27/1291178227.db2.gz OIXZMSHLLPQQHK-GOSISDBHSA-N 2 0 347.478 2.580 20 10 EFCDRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877532708 1291263986 /nfs/dbraw/zinc/26/39/86/1291263986.db2.gz WSPAQSIUBKQLNO-NQIIRXRSSA-N 2 0 343.515 2.564 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3ccc(C)cc3O)CC2)CC1 ZINC000877596047 1291285172 /nfs/dbraw/zinc/28/51/72/1291285172.db2.gz MLQYEYOSWCZJTM-UHFFFAOYSA-N 2 0 331.504 2.693 20 10 EFCDRP COc1cccc(C[NH+]2CCC(COCC[NH+]3CCCC3)CC2)c1O ZINC001203585519 1312962950 /nfs/dbraw/zinc/96/29/50/1312962950.db2.gz OIXWYGPAJWIDOK-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP CC[NH+]1C[C@H]2CN(Cc3cccc(OC(F)(F)F)c3O)C[C@@H]2C1 ZINC001233775730 1312989894 /nfs/dbraw/zinc/98/98/94/1312989894.db2.gz BIWUXTWCTWYMJP-STQMWFEESA-N 2 0 330.350 2.674 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(CO)c1 ZINC000883290059 1293533048 /nfs/dbraw/zinc/53/30/48/1293533048.db2.gz JOLIEHGCRSNJKN-KRWDZBQOSA-N 2 0 339.483 2.782 20 10 EFCDRP COC1([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000883291118 1293534274 /nfs/dbraw/zinc/53/42/74/1293534274.db2.gz SRBGCRYKCMHIBS-QGZVFWFLSA-N 2 0 331.504 2.876 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4cccc(O)c43)cc2)CC1 ZINC000883291042 1293534340 /nfs/dbraw/zinc/53/43/40/1293534340.db2.gz QEMHVTMZGGHBFU-IBGZPJMESA-N 2 0 337.467 2.921 20 10 EFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)cc1 ZINC001203939491 1313051439 /nfs/dbraw/zinc/05/14/39/1313051439.db2.gz OWJJCBYSZHYYQE-LEWJYISDSA-N 2 0 344.547 2.743 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000775715994 1294241503 /nfs/dbraw/zinc/24/15/03/1294241503.db2.gz OGLIXAWOQYKTLR-NQIIRXRSSA-N 3 0 344.547 2.743 20 10 EFCDRP C[NH+](C)CCN1CCC12C[NH+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001276445095 1313093589 /nfs/dbraw/zinc/09/35/89/1313093589.db2.gz KKSUVWODSQKJEL-UHFFFAOYSA-N 2 0 331.504 2.511 20 10 EFCDRP COc1ccc(N2CC[NH+](Cc3cc4c(s3)C[NH2+]CC4)CC2)cc1 ZINC001204621892 1313174298 /nfs/dbraw/zinc/17/42/98/1313174298.db2.gz QNTHAJRWVJJUQJ-UHFFFAOYSA-N 2 0 343.496 2.725 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCO[C@@H]3C[NH2+]CC[C@@H]3C2)cc1 ZINC001235039243 1313229692 /nfs/dbraw/zinc/22/96/92/1313229692.db2.gz WKGPBIGLBMXUIE-TZIWHRDSSA-N 2 0 339.483 2.904 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CCCC[C@@]34CC[NH2+]C4)cc2)CC1 ZINC001235117338 1313245278 /nfs/dbraw/zinc/24/52/78/1313245278.db2.gz AGVGMQIWEHLCTG-NRFANRHFSA-N 2 0 342.531 2.547 20 10 EFCDRP C[NH+](C)CCN1CCC2(C[NH+](Cc3cccc(C(C)(C)C)c3O)C2)C1 ZINC001275802808 1296413115 /nfs/dbraw/zinc/41/31/15/1296413115.db2.gz PAOLOWJCSDZLOJ-UHFFFAOYSA-N 2 0 345.531 2.759 20 10 EFCDRP CN1CCOc2cc(C[NH+]3CCC([C@@H]4CCCC[NH2+]4)CC3)ccc21 ZINC001235231429 1313270419 /nfs/dbraw/zinc/27/04/19/1313270419.db2.gz YMWQPNQLDDRSTL-SFHVURJKSA-N 2 0 329.488 2.869 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C[C@@H]1C[NH3+] ZINC001205303367 1313267182 /nfs/dbraw/zinc/26/71/82/1313267182.db2.gz DAZNDWSHLIDHFH-YOEHRIQHSA-N 2 0 329.488 2.508 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235408526 1313314612 /nfs/dbraw/zinc/31/46/12/1313314612.db2.gz UJVVMIJHNYBBCW-LSDHHAIUSA-N 2 0 332.341 2.935 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C[NH3+] ZINC001205602675 1313321170 /nfs/dbraw/zinc/32/11/70/1313321170.db2.gz LKTVYNSLWVMLQH-NWDGAFQWSA-N 2 0 327.266 2.962 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC[C@@H]1C[NH3+] ZINC001205617348 1313323783 /nfs/dbraw/zinc/32/37/83/1313323783.db2.gz JCRFOLFKHNSZAT-DOTOQJQBSA-N 2 0 343.515 2.898 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC[C@H]1C[NH3+] ZINC001205617351 1313324073 /nfs/dbraw/zinc/32/40/73/1313324073.db2.gz JCRFOLFKHNSZAT-WBVHZDCISA-N 2 0 343.515 2.898 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c2ccccc2n1C ZINC001205637889 1313328565 /nfs/dbraw/zinc/32/85/65/1313328565.db2.gz JTHOAGUCOJYASN-CABCVRRESA-N 2 0 343.471 2.772 20 10 EFCDRP CC(C)(C)c1ccc(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)c(O)c1 ZINC001235678652 1313373407 /nfs/dbraw/zinc/37/34/07/1313373407.db2.gz KCBXLOCMCOSHKF-UHFFFAOYSA-N 2 0 345.531 2.903 20 10 EFCDRP CCCCCC[NH+]1CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001235692172 1313376776 /nfs/dbraw/zinc/37/67/76/1313376776.db2.gz PFKYJNWLBKWIQH-UHFFFAOYSA-N 2 0 344.547 2.794 20 10 EFCDRP Cc1c(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c2ccccc2n1C ZINC001235814933 1313403402 /nfs/dbraw/zinc/40/34/02/1313403402.db2.gz HCSNGNHXGHUPJP-UHFFFAOYSA-N 2 0 340.515 2.746 20 10 EFCDRP Cc1cc(Cl)cc(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c1O ZINC001235821381 1313404435 /nfs/dbraw/zinc/40/44/35/1313404435.db2.gz GOMROZDGGVGEQJ-UHFFFAOYSA-N 2 0 337.895 2.614 20 10 EFCDRP COc1ccc(CC[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001235840264 1313407368 /nfs/dbraw/zinc/40/73/68/1313407368.db2.gz HCKVZYRBHVARRG-UHFFFAOYSA-N 2 0 339.483 2.779 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001235857367 1313411126 /nfs/dbraw/zinc/41/11/26/1313411126.db2.gz WFIBFANRGZIYHL-SJORKVTESA-N 2 0 329.488 2.814 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001235865484 1313412590 /nfs/dbraw/zinc/41/25/90/1313412590.db2.gz DTDVVVKJQWCGLW-QFBILLFUSA-N 2 0 329.488 2.956 20 10 EFCDRP [NH3+][C@H]1CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC[C@H]1F ZINC001206201065 1313420256 /nfs/dbraw/zinc/42/02/56/1313420256.db2.gz VKVMRRWRGPATNI-OLZOCXBDSA-N 2 0 336.329 2.595 20 10 EFCDRP [NH3+][C@H]1CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC[C@@H]1F ZINC001206201070 1313420451 /nfs/dbraw/zinc/42/04/51/1313420451.db2.gz VKVMRRWRGPATNI-STQMWFEESA-N 2 0 336.329 2.595 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@](C)(C[NH3+])CC3)cc2)CC1 ZINC001206311395 1313434219 /nfs/dbraw/zinc/43/42/19/1313434219.db2.gz NMCLJFURWNLFBE-OAQYLSRUSA-N 3 0 344.547 2.779 20 10 EFCDRP C[N@H+](CCc1cccc(F)c1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236267076 1313462336 /nfs/dbraw/zinc/46/23/36/1313462336.db2.gz XXXPDVKJPMRZMC-UHFFFAOYSA-N 2 0 327.447 2.910 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c2ccccc2n1C ZINC001206564528 1313477389 /nfs/dbraw/zinc/47/73/89/1313477389.db2.gz QDNJDUVTDFLYFF-FQEVSTJZSA-N 2 0 343.471 2.916 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@](C)(C[NH3+])C3)c(F)c2)CC1 ZINC001206572173 1313477874 /nfs/dbraw/zinc/47/78/74/1313477874.db2.gz BVGVTXDXMWTUNA-FQEVSTJZSA-N 3 0 348.510 2.528 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CCOC[C@H]1C1CCCCC1)C[NH2+]CCO2 ZINC001236433329 1313480263 /nfs/dbraw/zinc/48/02/63/1313480263.db2.gz GXDSJRHUYXOUAT-SFHVURJKSA-N 2 0 346.471 2.655 20 10 EFCDRP CCOc1ccc(N2CC[NH+](Cc3cccc(C[NH3+])c3)CC2)cc1 ZINC001236433721 1313480471 /nfs/dbraw/zinc/48/04/71/1313480471.db2.gz KQHUXAJIUHWMDG-UHFFFAOYSA-N 2 0 325.456 2.866 20 10 EFCDRP CC(C)N(Cc1ccc(N2CC[NH+](C)CC2)cc1F)[C@@H]1CCC[NH2+]C1 ZINC001236470946 1313485101 /nfs/dbraw/zinc/48/51/01/1313485101.db2.gz SLWDZWZANJXMNF-LJQANCHMSA-N 2 0 348.510 2.540 20 10 EFCDRP CC(C)N(Cc1cc2c3c(c1O)CCCN3CCC2)[C@@H]1CC[NH2+]C1 ZINC001236530440 1313489078 /nfs/dbraw/zinc/48/90/78/1313489078.db2.gz QCLSFPNYRYBABC-QGZVFWFLSA-N 2 0 329.488 2.663 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN([C@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236653251 1313503232 /nfs/dbraw/zinc/50/32/32/1313503232.db2.gz QIRQPFCMBXJCFU-NRFANRHFSA-N 2 0 342.531 2.593 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)cc1OC ZINC001236756771 1313523104 /nfs/dbraw/zinc/52/31/04/1313523104.db2.gz RXZIDDNFPZLEOZ-UHFFFAOYSA-N 2 0 348.487 2.963 20 10 EFCDRP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1cc2ccccc2cc1O ZINC001236834668 1313538577 /nfs/dbraw/zinc/53/85/77/1313538577.db2.gz AUBHWZPOTWUKNU-UHFFFAOYSA-N 2 0 344.455 2.862 20 10 EFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cc2ccccc2cc1O ZINC001236832497 1313538891 /nfs/dbraw/zinc/53/88/91/1313538891.db2.gz OBUQQJRWBBFCTF-VQTJNVASSA-N 2 0 339.483 2.756 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(C(C)(C)C)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001236932805 1313556547 /nfs/dbraw/zinc/55/65/47/1313556547.db2.gz NRLLVSYRYBOAMT-GOSISDBHSA-N 2 0 333.520 2.805 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc2ccccc2c1O)[C@@H]1CCC[NH2+]C1 ZINC001236933319 1313556786 /nfs/dbraw/zinc/55/67/86/1313556786.db2.gz RABRYDAFSJZLDL-GOSISDBHSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCCO4)CC3)c(F)c2)CC1 ZINC001236937438 1313557591 /nfs/dbraw/zinc/55/75/91/1313557591.db2.gz HNPQDRFHQOZOPG-UHFFFAOYSA-N 2 0 347.478 2.723 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(C(C)(C)C)cc1O)[C@H]1CCC[NH2+]C1 ZINC001236934764 1313557604 /nfs/dbraw/zinc/55/76/04/1313557604.db2.gz YQFHTWOBYCOWKE-SFHVURJKSA-N 2 0 333.520 2.805 20 10 EFCDRP CCO[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940866 1313557829 /nfs/dbraw/zinc/55/78/29/1313557829.db2.gz VKNVNVIVBSPLAQ-GOSISDBHSA-N 2 0 335.467 2.578 20 10 EFCDRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C2)C1 ZINC001237060639 1313579028 /nfs/dbraw/zinc/57/90/28/1313579028.db2.gz WLHZGYJGTDNTLV-INIZCTEOSA-N 2 0 344.377 2.861 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237390493 1313634464 /nfs/dbraw/zinc/63/44/64/1313634464.db2.gz IRXDQVSWMDNDEU-APWZRJJASA-N 2 0 341.499 2.665 20 10 EFCDRP c1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237405791 1313639045 /nfs/dbraw/zinc/63/90/45/1313639045.db2.gz RWCBVCUFEZVNJE-UXHICEINSA-N 2 0 325.500 2.959 20 10 EFCDRP COC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3c(C)cccc3O)CC2)C1 ZINC001237494431 1313655869 /nfs/dbraw/zinc/65/58/69/1313655869.db2.gz IRFOFSMNEPPSBI-MRXNPFEDSA-N 2 0 346.471 2.550 20 10 EFCDRP COCC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccco1 ZINC000779994641 1300175523 /nfs/dbraw/zinc/17/55/23/1300175523.db2.gz UIPWOQZCBIWIDN-IBGZPJMESA-N 2 0 343.471 2.899 20 10 EFCDRP COCCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000862436737 1302385324 /nfs/dbraw/zinc/38/53/24/1302385324.db2.gz JKQDBLDMKZQHMC-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP C[NH+]1CCN(c2cc[nH+]c(NCc3c(O)cccc3Cl)c2)CC1 ZINC000865295947 1303211579 /nfs/dbraw/zinc/21/15/79/1303211579.db2.gz OQEDAXQEYQCEGJ-UHFFFAOYSA-N 2 0 332.835 2.805 20 10 EFCDRP C[NH+]1CCN(c2cc[nH+]c(NCc3cc(Cl)ccc3O)c2)CC1 ZINC000865707995 1303373449 /nfs/dbraw/zinc/37/34/49/1303373449.db2.gz FLWOSXQYWSQQSR-UHFFFAOYSA-N 2 0 332.835 2.805 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000121177072 1303748220 /nfs/dbraw/zinc/74/82/20/1303748220.db2.gz BFBCRVDMCYEGHR-ROUUACIJSA-N 2 0 332.536 2.677 20 10 EFCDRP CN(C)c1ccc(CN2CCO[C@@]3(CCC[NH2+]C3)C2)c2ccccc21 ZINC001222360744 1311118908 /nfs/dbraw/zinc/11/89/08/1311118908.db2.gz UCOOYDIQPOKANJ-OAQYLSRUSA-N 2 0 339.483 2.860 20 10 EFCDRP Oc1cc(C[N@H+]2C[C@@H]3CC[NH+](C4CCCC4)CC[C@@H]3C2)cc(O)c1O ZINC001276833941 1311176427 /nfs/dbraw/zinc/17/64/27/1311176427.db2.gz VHRCLQIVBAWASF-IYBDPMFKSA-N 2 0 346.471 2.890 20 10 EFCDRP Cc1cc(F)cc(C[NH+]2CCC3(CC[N@@H+](CCN(C)C)C3)CC2)c1O ZINC001277519795 1312499874 /nfs/dbraw/zinc/49/98/74/1312499874.db2.gz LRWVPEYIXYYUKC-UHFFFAOYSA-N 2 0 349.494 2.689 20 10 EFCDRP COc1cc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c(O)cc1O ZINC001231636320 1312537052 /nfs/dbraw/zinc/53/70/52/1312537052.db2.gz SLGQJUXTYPUOBS-UHFFFAOYSA-N 2 0 334.460 2.660 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC001276373812 1314573825 /nfs/dbraw/zinc/57/38/25/1314573825.db2.gz KCTAXBRTKDMQFP-APWZRJJASA-N 2 0 339.483 2.613 20 10 EFCDRP C[C@@H](Cc1ccccc1F)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171796 1314592897 /nfs/dbraw/zinc/59/28/97/1314592897.db2.gz DNQVJBRXGXMMAC-INIZCTEOSA-N 2 0 327.447 2.956 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[NH2+][C@@H]1CCCN(C2CCCC2)C1 ZINC001246175581 1314593053 /nfs/dbraw/zinc/59/30/53/1314593053.db2.gz UGTPCXQAJQYTFC-LJQANCHMSA-N 2 0 342.531 2.593 20 10 EFCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(CC(=O)OC)cc2O)CC1 ZINC001249218484 1315034006 /nfs/dbraw/zinc/03/40/06/1315034006.db2.gz XKDURTWNYDNQBF-UHFFFAOYSA-N 2 0 348.487 2.804 20 10 EFCDRP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc4c(c3O)C=CC(C)(C)O4)C[C@@H]2C1 ZINC001249259085 1315040659 /nfs/dbraw/zinc/04/06/59/1315040659.db2.gz RFBIRFCMWGVLGK-IYBDPMFKSA-N 2 0 328.456 2.960 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@H]3CCC[C@@]34CC[NH2+]C4)cc2)CC1 ZINC001218095178 1315147545 /nfs/dbraw/zinc/14/75/45/1315147545.db2.gz GVFUUHAIQCJAAS-PMACEKPBSA-N 2 0 329.488 2.740 20 10 EFCDRP CC[N@H+]1C[C@H]2CN(Cc3cc(C)c(Br)cc3O)C[C@H]2C1 ZINC001250136231 1315178024 /nfs/dbraw/zinc/17/80/24/1315178024.db2.gz OQQRVLOSOZBHSR-OKILXGFUSA-N 2 0 339.277 2.847 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)cc1OC ZINC001276790306 1315218702 /nfs/dbraw/zinc/21/87/02/1315218702.db2.gz POAXTZJRQBVZDI-UHFFFAOYSA-N 2 0 334.460 2.717 20 10 EFCDRP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3cc4ccccc4cc3O)[C@@H]2C1 ZINC001276812765 1315404572 /nfs/dbraw/zinc/40/45/72/1315404572.db2.gz JHSAMTUWDFFJOQ-AZUAARDMSA-N 2 0 339.483 2.613 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3C[C@H]4CCC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC001255665917 1315854825 /nfs/dbraw/zinc/85/48/25/1315854825.db2.gz MGARBNNKXZKRDM-VCSGRIEYSA-N 3 0 342.531 2.543 20 10 EFCDRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001255942207 1315883146 /nfs/dbraw/zinc/88/31/46/1315883146.db2.gz CRLUZPRSDYTMGG-GOSISDBHSA-N 3 0 332.536 2.648 20 10 EFCDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000904405060 1324875750 /nfs/dbraw/zinc/87/57/50/1324875750.db2.gz ICLXJVHBLNBISS-OAHLLOKOSA-N 2 0 332.448 2.756 20 10 EFCDRP CN1CCN(c2ccc(CN3CCOC[C@H]3C3CCC3)cc2F)CC1 ZINC001329514623 1330713851 /nfs/dbraw/zinc/71/38/51/1330713851.db2.gz YOPRIDRWYUWECG-FQEVSTJZSA-N 2 0 347.478 2.578 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC001337785114 1331598725 /nfs/dbraw/zinc/59/87/25/1331598725.db2.gz JQGWZEWRBQKJPF-SJORKVTESA-N 2 0 331.504 2.866 20 10 EFCDRP CCc1cccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1O ZINC000848884171 1334959895 /nfs/dbraw/zinc/95/98/95/1334959895.db2.gz ZFPJIULSYWXHGO-ROUUACIJSA-N 2 0 345.531 2.945 20 10 EFCDRP CCc1cccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1O ZINC000848884170 1334959975 /nfs/dbraw/zinc/95/99/75/1334959975.db2.gz ZFPJIULSYWXHGO-QZTJIDSGSA-N 2 0 345.531 2.945 20 10 EFCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000849350188 1335596440 /nfs/dbraw/zinc/59/64/40/1335596440.db2.gz LVNRPGWJHCGHFN-YGWPLHOASA-N 2 0 329.488 2.784 20 10 EFCDRP COc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(O)c1OC ZINC000892121692 715263293 /nfs/dbraw/zinc/26/32/93/715263293.db2.gz OJJJOJBUASKHRT-UHFFFAOYSA-N 2 0 336.476 2.963 20 10 EFCDRP CC[NH2+]CC1CC[NH+](Cc2cc(Br)ccc2O)CC1 ZINC000220320353 720857211 /nfs/dbraw/zinc/85/72/11/720857211.db2.gz ZEZLAASHGKBVFH-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CC3(Cl)Cl)cc2)CC1 ZINC000895608150 724221970 /nfs/dbraw/zinc/22/19/70/724221970.db2.gz YCXFGCNCJJSRFJ-CQSZACIVSA-N 2 0 328.287 2.722 20 10 EFCDRP Cc1cc(CN(C)C2(C[NH3+])CCOCC2)ccc1N1CCCCC1 ZINC001579593288 1090638350 /nfs/dbraw/zinc/63/83/50/1090638350.db2.gz YTOSFQHJJKSMLI-UHFFFAOYSA-N 2 0 331.504 2.925 20 10 EFCDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC001580258735 1090836730 /nfs/dbraw/zinc/83/67/30/1090836730.db2.gz WNPWIYQLNIBVJU-DZGCQCFKSA-N 2 0 339.430 2.974 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H]4[NH2+]CCC[C@H]4C3)cc2)CC1 ZINC001580879773 1091032399 /nfs/dbraw/zinc/03/23/99/1091032399.db2.gz FIOYJTATWOFGFA-UEXGIBASSA-N 2 0 343.515 2.658 20 10 EFCDRP c1csc(SCCC[NH2+][C@H]2CCOC3(CC[NH2+]CC3)C2)n1 ZINC001580897314 1091039161 /nfs/dbraw/zinc/03/91/61/1091039161.db2.gz OGUTYJIJCUQQJK-ZDUSSCGKSA-N 2 0 327.519 2.516 20 10 EFCDRP [NH3+]CC1(N(Cc2ccccc2)c2ccc([C@H]3CCC[NH2+]3)cc2)COC1 ZINC001167374679 1102915859 /nfs/dbraw/zinc/91/58/59/1102915859.db2.gz RMUGOWOLJRSLDL-HXUWFJFHSA-N 2 0 337.467 2.845 20 10 EFCDRP Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H](O)C[NH+]1CCCC1 ZINC000263707670 240389231 /nfs/dbraw/zinc/38/92/31/240389231.db2.gz SSKFHSRZERQJQJ-LJQANCHMSA-N 2 0 326.440 2.606 20 10 EFCDRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185392602 274218946 /nfs/dbraw/zinc/21/89/46/274218946.db2.gz FFIXQNQELFHQOX-HOTGVXAUSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000186592563 278172239 /nfs/dbraw/zinc/17/22/39/278172239.db2.gz BPLQPCRVHXULMJ-ZIAGYGMSSA-N 2 0 325.884 2.722 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185392636 289604064 /nfs/dbraw/zinc/60/40/64/289604064.db2.gz FFIXQNQELFHQOX-CVEARBPZSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000124375126 473238957 /nfs/dbraw/zinc/23/89/57/473238957.db2.gz NEPWHFCERCNXED-QGZVFWFLSA-N 2 0 332.536 2.677 20 10 EFCDRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000184983026 473292285 /nfs/dbraw/zinc/29/22/85/473292285.db2.gz JEMZXXZYDXJCRZ-ZDUSSCGKSA-N 2 0 325.884 2.722 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185013696 473301760 /nfs/dbraw/zinc/30/17/60/473301760.db2.gz RUOMHXBUSLBMGN-AWEZNQCLSA-N 2 0 325.884 2.724 20 10 EFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c1 ZINC000185041963 473310130 /nfs/dbraw/zinc/31/01/30/473310130.db2.gz PUENMRTYVWJOEV-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP CC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(N(C)C)cc1 ZINC000128407930 472447463 /nfs/dbraw/zinc/44/74/63/472447463.db2.gz MBWJXWFWGOCTHK-FQEVSTJZSA-N 2 0 332.536 2.821 20 10 EFCDRP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000120929445 472770219 /nfs/dbraw/zinc/77/02/19/472770219.db2.gz SUYINZUWFRNHRP-PXNSSMCTSA-N 2 0 332.536 2.677 20 10 EFCDRP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](CC)CC3)C2)cc1 ZINC000093133346 473048128 /nfs/dbraw/zinc/04/81/28/473048128.db2.gz PFUVQAIZYLHKKJ-OAQYLSRUSA-N 2 0 344.547 2.745 20 10 EFCDRP C[NH+](C)CCOc1cc(C[NH2+]Cc2c(O)cccc2Cl)ccn1 ZINC000136224403 473145505 /nfs/dbraw/zinc/14/55/05/473145505.db2.gz QYHABYJGHQTAJO-UHFFFAOYSA-N 2 0 335.835 2.671 20 10 EFCDRP C[C@H](C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2)N1CC[NH+](C)CC1 ZINC000185365635 473406207 /nfs/dbraw/zinc/40/62/07/473406207.db2.gz ZRRYAPXZALVFHK-HZPDHXFCSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)N1CC[NH+](C)CC1 ZINC000185364558 473406613 /nfs/dbraw/zinc/40/66/13/473406613.db2.gz AIVOLFJFRGBWGR-HZPDHXFCSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185392667 473414600 /nfs/dbraw/zinc/41/46/00/473414600.db2.gz FFIXQNQELFHQOX-HZPDHXFCSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185392488 473414715 /nfs/dbraw/zinc/41/47/15/473414715.db2.gz MXVLQJVZBSXBOG-HZPDHXFCSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1O ZINC000186127705 473596630 /nfs/dbraw/zinc/59/66/30/473596630.db2.gz CFPSLZNNVZSFOR-XVSDVWIESA-N 2 0 336.451 2.950 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000186592542 473695539 /nfs/dbraw/zinc/69/55/39/473695539.db2.gz BPLQPCRVHXULMJ-UONOGXRCSA-N 2 0 325.884 2.722 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000282487589 474083722 /nfs/dbraw/zinc/08/37/22/474083722.db2.gz XHDJSZOIEDROLA-KRWDZBQOSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 ZINC000264930130 474161613 /nfs/dbraw/zinc/16/16/13/474161613.db2.gz AHCBOJFDNPFANG-HOTGVXAUSA-N 2 0 337.483 2.871 20 10 EFCDRP CC(C)[NH+]1CCC(N2CC[NH+](Cc3ccc(N(C)C)cc3)CC2)CC1 ZINC000271229683 474453287 /nfs/dbraw/zinc/45/32/87/474453287.db2.gz SYAZKETYKQLJCA-UHFFFAOYSA-N 2 0 344.547 2.743 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1C ZINC000273389257 474874887 /nfs/dbraw/zinc/87/48/87/474874887.db2.gz KIZBDRQAWKFXGP-HKUYNNGSSA-N 2 0 333.520 2.932 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000370625634 476901664 /nfs/dbraw/zinc/90/16/64/476901664.db2.gz ZHWJDQHHALYBOK-IEBWSBKVSA-N 2 0 344.547 2.962 20 10 EFCDRP CC[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(C)cc1O ZINC000375649207 476934927 /nfs/dbraw/zinc/93/49/27/476934927.db2.gz PPLATRLCANSRND-APWZRJJASA-N 2 0 331.504 2.910 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1C ZINC000368328316 477798494 /nfs/dbraw/zinc/79/84/94/477798494.db2.gz OTIOJDDOQRTZHL-IRXDYDNUSA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2c1c(F)ccc2O ZINC000756408417 575732513 /nfs/dbraw/zinc/73/25/13/575732513.db2.gz MHKZUIMKYIQGDV-GDBMZVCRSA-N 2 0 335.467 2.697 20 10 EFCDRP CC[NH+](CC)CCOCC[NH2+]Cc1cc(Br)ccc1O ZINC000757944889 575856525 /nfs/dbraw/zinc/85/65/25/575856525.db2.gz CJTZEQXMJZTYCM-UHFFFAOYSA-N 2 0 345.281 2.603 20 10 EFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000760286105 575999888 /nfs/dbraw/zinc/99/98/88/575999888.db2.gz HMLOIEBEKJWPDT-UHFFFAOYSA-N 2 0 345.531 2.999 20 10 EFCDRP CC[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000764841941 576510488 /nfs/dbraw/zinc/51/04/88/576510488.db2.gz VSVIPVAOHQWKQA-IBGZPJMESA-N 2 0 332.536 2.819 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769513493 577368925 /nfs/dbraw/zinc/36/89/25/577368925.db2.gz AUIUDKKUKOCIJC-KRWDZBQOSA-N 2 0 337.483 2.824 20 10 EFCDRP CCN(C)c1ccc(C[N@H+](C)CCN(C)C2CC[NH+](C)CC2)cc1 ZINC000773815682 581465827 /nfs/dbraw/zinc/46/58/27/581465827.db2.gz YTZDORPBDWYXHT-UHFFFAOYSA-N 2 0 332.536 2.601 20 10 EFCDRP C[C@@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)cc(F)c1[O-] ZINC000774381330 581490548 /nfs/dbraw/zinc/49/05/48/581490548.db2.gz LYDOYWIJRJTNFZ-SNVBAGLBSA-N 2 0 349.244 2.523 20 10 EFCDRP Cc1nc([C@@H]2CCC[NH2+]C2)cc(N2C[C@@H](CC[NH3+])c3ccccc32)n1 ZINC001168545440 1257059913 /nfs/dbraw/zinc/05/99/13/1257059913.db2.gz OUEHFWULECPOGG-HZPDHXFCSA-N 2 0 337.471 2.836 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)ccc1N(C)C ZINC000923386483 1261595020 /nfs/dbraw/zinc/59/50/20/1261595020.db2.gz BYTMMVSBJULZBG-CMKODMSKSA-N 2 0 331.504 2.779 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000186582414 1266786052 /nfs/dbraw/zinc/78/60/52/1266786052.db2.gz SOZAPVSEXPVEMC-DLBZAZTESA-N 2 0 345.531 2.948 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000824750248 1278282273 /nfs/dbraw/zinc/28/22/73/1278282273.db2.gz FRUCBIYNRAYQFX-LJQANCHMSA-N 2 0 343.515 2.877 20 10 EFCDRP CO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C12CCC2 ZINC000825104219 1278399369 /nfs/dbraw/zinc/39/93/69/1278399369.db2.gz RGMYYMVQTMHWCE-UXHICEINSA-N 2 0 343.515 2.828 20 10 EFCDRP Cc1cc(O)c(C[NH2+]CC2CC[NH+](CCN(C)C)CC2)cc1Cl ZINC000825247563 1278484875 /nfs/dbraw/zinc/48/48/75/1278484875.db2.gz UYWVKMPXQLKCGK-UHFFFAOYSA-N 2 0 339.911 2.717 20 10 EFCDRP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000700809915 1269550503 /nfs/dbraw/zinc/55/05/03/1269550503.db2.gz VZBAZKAWDGSONK-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H](C[NH2+]Cc1ccc(Br)cc1O)C[NH+]1CCCC1 ZINC000691487367 1274711911 /nfs/dbraw/zinc/71/19/11/1274711911.db2.gz FCILTXBKDVURIG-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C(C)(C)C3CCOCC3)cc2)CC1 ZINC000785606536 1275128319 /nfs/dbraw/zinc/12/83/19/1275128319.db2.gz KUUNYMIRZANWTI-UHFFFAOYSA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CC(C)(C)OC(C)(C)C3)cc2)CC1 ZINC000785993354 1275267204 /nfs/dbraw/zinc/26/72/04/1275267204.db2.gz VSZGWOVMDCFUED-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3C[NH3+])cc2F)C[C@@H](C)O1 ZINC000817890439 1276347855 /nfs/dbraw/zinc/34/78/55/1276347855.db2.gz XPGMJPLSVXLNBM-GZOSKZMVSA-N 2 0 335.467 2.656 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@H]3C)cc2F)C[C@H](C)O1 ZINC000817888835 1276348369 /nfs/dbraw/zinc/34/83/69/1276348369.db2.gz PTPNBDLGIBWUTN-OAFZBRQQSA-N 2 0 349.494 2.917 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000817894737 1276363451 /nfs/dbraw/zinc/36/34/51/1276363451.db2.gz NQWDIAQCYJSQEY-PCCBWWKXSA-N 2 0 343.515 2.924 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000817894918 1276363991 /nfs/dbraw/zinc/36/39/91/1276363991.db2.gz OXGCZCRYQAYMGA-SLFFLAALSA-N 2 0 329.488 2.534 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000817894920 1276364046 /nfs/dbraw/zinc/36/40/46/1276364046.db2.gz OXGCZCRYQAYMGA-XUVXKRRUSA-N 2 0 329.488 2.534 20 10 EFCDRP [NH3+]CC1CCC([NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)CC1 ZINC000817894957 1276364580 /nfs/dbraw/zinc/36/45/80/1276364580.db2.gz PPEIRESKTLFBDQ-UHFFFAOYSA-N 2 0 331.504 2.502 20 10 EFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817901809 1276365916 /nfs/dbraw/zinc/36/59/16/1276365916.db2.gz XSNJVVXBQJVAEI-BFHYXJOUSA-N 2 0 327.419 2.972 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000817898534 1276366355 /nfs/dbraw/zinc/36/63/55/1276366355.db2.gz IHQWMDAECVTVQD-VAMGGRTRSA-N 2 0 329.488 2.534 20 10 EFCDRP C[C@@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000817902471 1276367560 /nfs/dbraw/zinc/36/75/60/1276367560.db2.gz RCOYPMDSYAUVDI-LSTHTHJFSA-N 2 0 331.504 2.765 20 10 EFCDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817954790 1276397694 /nfs/dbraw/zinc/39/76/94/1276397694.db2.gz JZGNXNWEHJITCT-GJZGRUSLSA-N 2 0 337.895 2.827 20 10 EFCDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817954791 1276397778 /nfs/dbraw/zinc/39/77/78/1276397778.db2.gz JZGNXNWEHJITCT-HUUCEWRRSA-N 2 0 337.895 2.827 20 10 EFCDRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1Cl ZINC000817978022 1276416903 /nfs/dbraw/zinc/41/69/03/1276416903.db2.gz UCENUZGCLMCJAE-KGLIPLIRSA-N 2 0 325.884 2.955 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(N2CCOCC2)cc1Cl ZINC000817976838 1276417121 /nfs/dbraw/zinc/41/71/21/1276417121.db2.gz VKQWKJBQJXLLRN-KDOFPFPSSA-N 2 0 349.906 2.969 20 10 EFCDRP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000817980348 1276420168 /nfs/dbraw/zinc/42/01/68/1276420168.db2.gz AHBVYPOBJJXYKS-OCCSQVGLSA-N 2 0 332.366 2.830 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817985487 1276424653 /nfs/dbraw/zinc/42/46/53/1276424653.db2.gz KPPMAHZSMSDNKW-XOYOTBSWSA-N 2 0 347.478 2.701 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000817987152 1276429514 /nfs/dbraw/zinc/42/95/14/1276429514.db2.gz WTERELRAOXZWPY-JCHJZTRSSA-N 2 0 329.488 2.562 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000818221953 1276493753 /nfs/dbraw/zinc/49/37/53/1276493753.db2.gz PTXNUSGPRXGBQK-LMMKCTJWSA-N 2 0 329.488 2.738 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c1 ZINC000844902491 1279323567 /nfs/dbraw/zinc/32/35/67/1279323567.db2.gz NZGWKQMLZFJZKP-QOKNQOGYSA-N 2 0 334.460 2.509 20 10 EFCDRP CCc1noc(C)c1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000815145627 1287346998 /nfs/dbraw/zinc/34/69/98/1287346998.db2.gz AHDZHSSEXRNONA-UHFFFAOYSA-N 2 0 328.460 2.587 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3[C@H]3CCCO3)cc2)CC1 ZINC000793609689 1279772581 /nfs/dbraw/zinc/77/25/81/1279772581.db2.gz REFUQLMYSPVKKI-VQTJNVASSA-N 2 0 329.488 2.582 20 10 EFCDRP CC(C)O[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000846016503 1279979885 /nfs/dbraw/zinc/97/98/85/1279979885.db2.gz UWTTVBZXIIXIHY-HXUWFJFHSA-N 2 0 331.504 2.828 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c1O ZINC000846148420 1280036970 /nfs/dbraw/zinc/03/69/70/1280036970.db2.gz ZEEVXESFBITPAG-LSDHHAIUSA-N 2 0 334.460 2.552 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1O ZINC000846156066 1280039208 /nfs/dbraw/zinc/03/92/08/1280039208.db2.gz RWOZXJLXCXSSQD-XHSDSOJGSA-N 2 0 336.476 2.941 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c1O ZINC000846155530 1280040406 /nfs/dbraw/zinc/04/04/06/1280040406.db2.gz HACBROKJOJPOSD-JCGIZDLHSA-N 2 0 348.487 2.819 20 10 EFCDRP CCCCN(C)C[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000808455289 1281718013 /nfs/dbraw/zinc/71/80/13/1281718013.db2.gz ZSVZHJIDBNHWNZ-SFHVURJKSA-N 2 0 332.536 2.648 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693339 1281847303 /nfs/dbraw/zinc/84/73/03/1281847303.db2.gz GJUKYNSHSBAHES-ZIAGYGMSSA-N 2 0 325.884 2.641 20 10 EFCDRP C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809700358 1282384942 /nfs/dbraw/zinc/38/49/42/1282384942.db2.gz FBCIMHLYMZATRW-RXVVDRJESA-N 2 0 345.531 2.954 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@H]3CC[N@@H+](C(C)C)C3)CC2)cc1 ZINC000809735743 1282436423 /nfs/dbraw/zinc/43/64/23/1282436423.db2.gz QTUAPKWDVBMTTA-QGZVFWFLSA-N 2 0 331.504 2.984 20 10 EFCDRP C[NH+](C)CCN(CC[NH+](C)C)Cc1ccc(N2CCCCC2)cc1 ZINC000809741626 1282441928 /nfs/dbraw/zinc/44/19/28/1282441928.db2.gz QHMYSAXMIMYZAS-UHFFFAOYSA-N 2 0 332.536 2.602 20 10 EFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809757688 1282458259 /nfs/dbraw/zinc/45/82/59/1282458259.db2.gz VLNCCMXEYDCYLB-UHFFFAOYSA-N 3 0 332.536 2.602 20 10 EFCDRP CN(CCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1)CC[NH+](C)C ZINC000809788832 1282488860 /nfs/dbraw/zinc/48/88/60/1282488860.db2.gz WRFOPTVJNDDVKN-UHFFFAOYSA-N 2 0 346.563 2.992 20 10 EFCDRP Cc1ccc2nc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cn2c1 ZINC000811628045 1284443629 /nfs/dbraw/zinc/44/36/29/1284443629.db2.gz LYHQIKNHJCVIFR-UHFFFAOYSA-N 2 0 349.482 2.684 20 10 EFCDRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC1CC[NH+](Cc3ccccc3O)CC1)C2 ZINC001172114745 1286025820 /nfs/dbraw/zinc/02/58/20/1286025820.db2.gz PPGVATDOTAPHBS-ACDBMABISA-N 2 0 343.515 2.962 20 10 EFCDRP COC(=O)[C@H]1CCC[C@H]([NH2+]C2CCN(Cc3ccccc3O)CC2)C1 ZINC001172605470 1286199959 /nfs/dbraw/zinc/19/99/59/1286199959.db2.gz XQTUQZAURDSHIO-YJBOKZPZSA-N 2 0 346.471 2.678 20 10 EFCDRP Oc1c(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816482701 1288153554 /nfs/dbraw/zinc/15/35/54/1288153554.db2.gz PNWSAPQPPNOFOI-UHFFFAOYSA-N 2 0 339.483 2.759 20 10 EFCDRP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816534894 1288193922 /nfs/dbraw/zinc/19/39/22/1288193922.db2.gz YJCUNBUPMDSPGI-UHFFFAOYSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@]4(CCCO4)[C@H]3C3CC3)cc2)CC1 ZINC000816666293 1288235383 /nfs/dbraw/zinc/23/53/83/1288235383.db2.gz JLXQTSPBEXLLCR-RTWAWAEBSA-N 2 0 341.499 2.582 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc(C)ccc3O)CC2)CC1 ZINC000817413952 1288592040 /nfs/dbraw/zinc/59/20/40/1288592040.db2.gz NJORHUSEPOJVII-UHFFFAOYSA-N 2 0 331.504 2.693 20 10 EFCDRP CCCOc1ccc(C[NH2+]CCCC[NH+]2CCN(C)CC2)cc1C ZINC000873012373 1289518903 /nfs/dbraw/zinc/51/89/03/1289518903.db2.gz RLGDNXYHXMBBTC-UHFFFAOYSA-N 2 0 333.520 2.901 20 10 EFCDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N2CCOCC2)c(F)c1 ZINC000873259675 1289687375 /nfs/dbraw/zinc/68/73/75/1289687375.db2.gz JIABAXKJNSARQC-ONIAQPFYSA-N 2 0 347.478 2.844 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H]1CC2(CO1)CC[NH2+]CC2)c1ccc(N(C)C)cc1 ZINC000873290737 1289706162 /nfs/dbraw/zinc/70/61/62/1289706162.db2.gz GUEBKDRQXMULPU-RTBURBONSA-N 2 0 331.504 2.952 20 10 EFCDRP CC[C@@H](C(=O)NCCC[NH2+]Cc1ccc(OC)c(C)c1)[NH+](CC)CC ZINC001166447498 1312777482 /nfs/dbraw/zinc/77/74/82/1312777482.db2.gz KNYKPDLTRPGINW-SFHVURJKSA-N 2 0 349.519 2.720 20 10 EFCDRP CC[C@H](C(=O)NCCC[NH2+]Cc1ccc(OC)c(C)c1)[NH+](CC)CC ZINC001166447497 1312777737 /nfs/dbraw/zinc/77/77/37/1312777737.db2.gz KNYKPDLTRPGINW-GOSISDBHSA-N 2 0 349.519 2.720 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1C ZINC000092665086 1290801938 /nfs/dbraw/zinc/80/19/38/1290801938.db2.gz RHHOMXJOULZJCT-OALUTQOASA-N 2 0 345.531 2.999 20 10 EFCDRP Cc1ccc([C@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000775022226 1290964851 /nfs/dbraw/zinc/96/48/51/1290964851.db2.gz UIFDKDAKRLUCAE-OAQYLSRUSA-N 2 0 339.483 2.570 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCC(O)CC3)cc2)C[C@H]1C ZINC000876758007 1291008269 /nfs/dbraw/zinc/00/82/69/1291008269.db2.gz HDALQXVNHGRJPP-YLJYHZDGSA-N 2 0 345.531 2.952 20 10 EFCDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000877063242 1291122481 /nfs/dbraw/zinc/12/24/81/1291122481.db2.gz GXABHKQFAHWGRS-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877532704 1291264252 /nfs/dbraw/zinc/26/42/52/1291264252.db2.gz WSPAQSIUBKQLNO-GHTZIAJQSA-N 2 0 343.515 2.564 20 10 EFCDRP Cc1cc(Br)cc(C[NH+]2CCC3(C[NH+](C)C3)CC2)c1O ZINC001233109619 1312856069 /nfs/dbraw/zinc/85/60/69/1312856069.db2.gz DIJLBECIFRVPHH-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP Cc1cc(Br)cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c1O ZINC001233110189 1312856359 /nfs/dbraw/zinc/85/63/59/1312856359.db2.gz YRFRBFLOEURYLV-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP COc1ccc(N2CCN(CC[C@H]3CCCC[N@@H+]3C)CC2)c(OC)c1 ZINC000879463707 1292146153 /nfs/dbraw/zinc/14/61/53/1292146153.db2.gz NGSKLRKBGCAFBT-QGZVFWFLSA-N 2 0 347.503 2.700 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000775715996 1294241534 /nfs/dbraw/zinc/24/15/34/1294241534.db2.gz OGLIXAWOQYKTLR-WIYYLYMNSA-N 3 0 344.547 2.743 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOCC34CCCC4)cc2)CC1 ZINC000775734112 1294304392 /nfs/dbraw/zinc/30/43/92/1294304392.db2.gz KXYRLAUSBISXKU-UHFFFAOYSA-N 2 0 329.488 2.583 20 10 EFCDRP C[NH+](C)CCN1C[C@@H]2CC[N@H+](Cc3cc(C(C)(C)C)ccc3O)[C@@H]2C1 ZINC001276446183 1313096573 /nfs/dbraw/zinc/09/65/73/1313096573.db2.gz SGZQUNVNMYTNGK-QFBILLFUSA-N 2 0 345.531 2.757 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)c1O ZINC000841054358 1294818634 /nfs/dbraw/zinc/81/86/34/1294818634.db2.gz CFJFLQQAYBNOBB-NEPJUHHUSA-N 2 0 329.238 2.523 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCN(CC[NH+](C)C)CC2)c2ccccc21 ZINC001204233228 1313105556 /nfs/dbraw/zinc/10/55/56/1313105556.db2.gz OZJVBVYDWCNVCE-UHFFFAOYSA-N 2 0 340.515 2.585 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](O)CN(C)Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000775830927 1294920735 /nfs/dbraw/zinc/92/07/35/1294920735.db2.gz NKJRLJWYUHPATJ-UTKZUKDTSA-N 2 0 341.499 2.896 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOCC4(CCCC4)C3)cc2)CC1 ZINC000776010104 1295676461 /nfs/dbraw/zinc/67/64/61/1295676461.db2.gz YHKCFXJUBNOLJP-UHFFFAOYSA-N 2 0 343.515 2.831 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)CC1 ZINC001234657820 1313179338 /nfs/dbraw/zinc/17/93/38/1313179338.db2.gz JETJYEVYHTYIOF-OPVJXMOQSA-N 2 0 329.488 2.833 20 10 EFCDRP Cc1cc(CN2CCO[C@@H]3C[NH2+]C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001234970829 1313214831 /nfs/dbraw/zinc/21/48/31/1313214831.db2.gz LATHUAYKGUJBQH-UYAOXDASSA-N 2 0 325.456 2.514 20 10 EFCDRP CCCCN(CCCC)c1ccc(CN2C[C@H]([NH3+])C[C@H](O)C2)c(O)c1 ZINC001204954670 1313214968 /nfs/dbraw/zinc/21/49/68/1313214968.db2.gz HUMBNLSZWOLNOI-MJGOQNOKSA-N 2 0 349.519 2.693 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+]CCCN2CCC[N@H+](C)CC2)cc1 ZINC000105476849 1296111203 /nfs/dbraw/zinc/11/12/03/1296111203.db2.gz PLMNUMAYWDQAMD-UHFFFAOYSA-N 2 0 332.536 2.650 20 10 EFCDRP CC(C)(C)c1ccc(O)c(CN2CCOC[C@]3(CCC[NH2+]C3)C2)c1 ZINC001235021933 1313226058 /nfs/dbraw/zinc/22/60/58/1313226058.db2.gz KYBSMVARGONGNZ-FQEVSTJZSA-N 2 0 332.488 2.892 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1CN1CCOC[C@]2(CCC[NH2+]C2)C1 ZINC001235023722 1313226881 /nfs/dbraw/zinc/22/68/81/1313226881.db2.gz WGSMFUYCVAUMMX-INIZCTEOSA-N 2 0 344.377 2.613 20 10 EFCDRP Oc1ccc(O)c(C[NH+]2CCC3(C[NH+](Cc4ccc[nH]4)C3)CC2)c1 ZINC001275419119 1296277243 /nfs/dbraw/zinc/27/72/43/1296277243.db2.gz QUNCPMBVXZWEFJ-UHFFFAOYSA-N 2 0 327.428 2.524 20 10 EFCDRP COc1cccc2c1C[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001205164697 1313244032 /nfs/dbraw/zinc/24/40/32/1313244032.db2.gz OPDDXBXQILIWLG-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@@](O)(C[NH3+])CC2)c(C)n1-c1ccccc1 ZINC001205219439 1313253124 /nfs/dbraw/zinc/25/31/24/1313253124.db2.gz DBERONIAPXGYAV-FQEVSTJZSA-N 2 0 327.472 2.770 20 10 EFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccc(C(C)(C)C)c1O ZINC001275802747 1296413240 /nfs/dbraw/zinc/41/32/40/1296413240.db2.gz MYNMQHRMIXHUCC-OALUTQOASA-N 2 0 345.531 2.900 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)ccc21 ZINC001235158505 1313254567 /nfs/dbraw/zinc/25/45/67/1313254567.db2.gz KNJJNQNXZHHOGL-GOSISDBHSA-N 2 0 329.488 2.869 20 10 EFCDRP COc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001205340696 1313271859 /nfs/dbraw/zinc/27/18/59/1313271859.db2.gz ZFTTZOKMCXRUCI-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP Cc1cccc(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c1O ZINC001276080267 1296594734 /nfs/dbraw/zinc/59/47/34/1296594734.db2.gz MZHZESYLNHLMDF-HXUWFJFHSA-N 2 0 331.504 2.550 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)ccc21 ZINC001235424346 1313318344 /nfs/dbraw/zinc/31/83/44/1313318344.db2.gz HBSLPTUWVQGGAF-QZTJIDSGSA-N 2 0 329.488 2.727 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C[NH3+] ZINC001205602677 1313321277 /nfs/dbraw/zinc/32/12/77/1313321277.db2.gz LKTVYNSLWVMLQH-VXGBXAGGSA-N 2 0 327.266 2.962 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@@H]1C[NH3+] ZINC001205626716 1313325528 /nfs/dbraw/zinc/32/55/28/1313325528.db2.gz IJOGNDCUEKQBAN-VXGBXAGGSA-N 2 0 327.266 2.962 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCCC[C@@](O)(C[NH3+])C2)c2ccccc21 ZINC001205665626 1313334188 /nfs/dbraw/zinc/33/41/88/1313334188.db2.gz SWRSZAMMLKERRS-HXUWFJFHSA-N 2 0 327.472 2.582 20 10 EFCDRP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001205726633 1313345658 /nfs/dbraw/zinc/34/56/58/1313345658.db2.gz VZEWCGXMPJGYQM-HXUWFJFHSA-N 2 0 326.440 2.735 20 10 EFCDRP C[N@H+](CCOc1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235675139 1313372538 /nfs/dbraw/zinc/37/25/38/1313372538.db2.gz JTXKRVHCEYHEBJ-UHFFFAOYSA-N 2 0 325.456 2.607 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1CN1CCCC[C@@H]1C[NH+]1CCCC1 ZINC001235677810 1313372762 /nfs/dbraw/zinc/37/27/62/1313372762.db2.gz IPRAJBKVGKZKOW-OAQYLSRUSA-N 2 0 342.531 2.547 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC[C@H]1C[NH3+] ZINC001205991411 1313388482 /nfs/dbraw/zinc/38/84/82/1313388482.db2.gz AOJALUVMGXOSMN-WBVHZDCISA-N 2 0 343.515 2.898 20 10 EFCDRP Cc1cccc(CC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2O)c1 ZINC001235838880 1313406874 /nfs/dbraw/zinc/40/68/74/1313406874.db2.gz DGFYEFZUTZODBC-UHFFFAOYSA-N 2 0 339.483 2.785 20 10 EFCDRP Cc1cc(O)c(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1Br ZINC001235956469 1313422951 /nfs/dbraw/zinc/42/29/51/1313422951.db2.gz DSUDIZMWYMUBHS-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP Cc1cc(O)c(C[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1Br ZINC001235956470 1313423284 /nfs/dbraw/zinc/42/32/84/1313423284.db2.gz DSUDIZMWYMUBHS-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C1 ZINC001206344679 1313439182 /nfs/dbraw/zinc/43/91/82/1313439182.db2.gz WOMSKMGQHXINJF-FQEVSTJZSA-N 2 0 347.478 2.744 20 10 EFCDRP [NH3+]C1CN([C@@H]2CCC[N@H+](Cc3cccc(-c4ccccc4)c3O)C2)C1 ZINC001236076542 1313438536 /nfs/dbraw/zinc/43/85/36/1313438536.db2.gz BGYDDAHORBLEGU-LJQANCHMSA-N 2 0 337.467 2.667 20 10 EFCDRP COc1cccc2c1CC[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001236239700 1313459468 /nfs/dbraw/zinc/45/94/68/1313459468.db2.gz IAWGDAQUTNQARX-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC001206554034 1313474579 /nfs/dbraw/zinc/47/45/79/1313474579.db2.gz AKMVCNOJCBOLFJ-HXUWFJFHSA-N 2 0 331.504 2.599 20 10 EFCDRP CCOC(=O)c1c(CN2C[C@H](C[NH3+])CC[C@H]2C)c2ccccc2n1C ZINC001206810918 1313514594 /nfs/dbraw/zinc/51/45/94/1313514594.db2.gz QYXDJNTVEZVKLV-CABCVRRESA-N 2 0 343.471 2.914 20 10 EFCDRP CCOC(=O)c1c(CN2C[C@@H](C[NH3+])CC[C@@H]2C)c2ccccc2n1C ZINC001206811154 1313514757 /nfs/dbraw/zinc/51/47/57/1313514757.db2.gz QYXDJNTVEZVKLV-LSDHHAIUSA-N 2 0 343.471 2.914 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(N3CCOCC3)cc1Cl)CC2 ZINC001236918353 1313553021 /nfs/dbraw/zinc/55/30/21/1313553021.db2.gz GEFPDFYMFUFHOC-UHFFFAOYSA-N 2 0 349.906 2.704 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236925016 1313554407 /nfs/dbraw/zinc/55/44/07/1313554407.db2.gz VREMCJMNUFKEIU-OAQYLSRUSA-N 2 0 344.547 2.793 20 10 EFCDRP CCN(CC)c1ccc(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)cc1 ZINC001236925292 1313554684 /nfs/dbraw/zinc/55/46/84/1313554684.db2.gz XGGFXAXCNXLFPF-HXUWFJFHSA-N 2 0 332.536 2.648 20 10 EFCDRP CN(Cc1ccncc1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236929181 1313555289 /nfs/dbraw/zinc/55/52/89/1313555289.db2.gz AKEWWDTVIHPWGQ-UHFFFAOYSA-N 2 0 328.435 2.605 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[C@]1(C)O ZINC001236932442 1313556186 /nfs/dbraw/zinc/55/61/86/1313556186.db2.gz OSMPFZAHXBCEIH-UZLBHIALSA-N 2 0 349.494 2.560 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc2ccccc2c1O)[C@H]1CCC[NH2+]C1 ZINC001236933321 1313556569 /nfs/dbraw/zinc/55/65/69/1313556569.db2.gz RABRYDAFSJZLDL-SFHVURJKSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCOC4)CC3)c(F)c2)CC1 ZINC001236933036 1313556722 /nfs/dbraw/zinc/55/67/22/1313556722.db2.gz SUWXVIUXWOPUGV-UHFFFAOYSA-N 2 0 347.478 2.580 20 10 EFCDRP CO[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236934000 1313556833 /nfs/dbraw/zinc/55/68/33/1313556833.db2.gz BMKFEEUBTWCPMT-GOSISDBHSA-N 2 0 335.467 2.578 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)(CO)CC3)c(F)c2)CC1 ZINC001236933056 1313556919 /nfs/dbraw/zinc/55/69/19/1313556919.db2.gz UAROOQOPOMSZIR-FQEVSTJZSA-N 2 0 349.494 2.562 20 10 EFCDRP CSC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236938773 1313557282 /nfs/dbraw/zinc/55/72/82/1313557282.db2.gz MRZBIVNKFCEATO-UHFFFAOYSA-N 2 0 337.508 2.905 20 10 EFCDRP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C[C@H]1CCCCO1 ZINC001236938056 1313557680 /nfs/dbraw/zinc/55/76/80/1313557680.db2.gz IXDHDZFUMUFLOX-GOSISDBHSA-N 2 0 335.467 2.578 20 10 EFCDRP CCCO[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236940913 1313557939 /nfs/dbraw/zinc/55/79/39/1313557939.db2.gz WJGYXADPELCZAT-SFHVURJKSA-N 2 0 335.467 2.578 20 10 EFCDRP CO[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H](C)C1 ZINC001236944806 1313558837 /nfs/dbraw/zinc/55/88/37/1313558837.db2.gz GEOIFUZTXBYONK-CRAIPNDOSA-N 2 0 335.467 2.577 20 10 EFCDRP CCOc1ccc(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c(O)c1 ZINC001237046969 1313574931 /nfs/dbraw/zinc/57/49/31/1313574931.db2.gz IRYJAIUISILQJM-UHFFFAOYSA-N 2 0 327.428 2.817 20 10 EFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C[C@@H]2C1 ZINC001237051137 1313576824 /nfs/dbraw/zinc/57/68/24/1313576824.db2.gz CZDPVYHNTLEXDH-OCCSQVGLSA-N 2 0 344.377 2.717 20 10 EFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3c(O)cccc3OC(F)(F)F)C[C@@H]2C1 ZINC001237118118 1313589487 /nfs/dbraw/zinc/58/94/87/1313589487.db2.gz VGGHFLMXRGRLNA-NEPJUHHUSA-N 2 0 330.350 2.674 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001237390499 1313635099 /nfs/dbraw/zinc/63/50/99/1313635099.db2.gz IRXDQVSWMDNDEU-VQIMIIECSA-N 2 0 341.499 2.665 20 10 EFCDRP COc1cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(O)c(OC)c1 ZINC001237677151 1313690163 /nfs/dbraw/zinc/69/01/63/1313690163.db2.gz XNQNSEKTXAINLV-UHFFFAOYSA-N 2 0 336.476 2.962 20 10 EFCDRP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)c1O ZINC001237687105 1313692420 /nfs/dbraw/zinc/69/24/20/1313692420.db2.gz WMEJZQCUQBEQKA-DLBZAZTESA-N 2 0 337.895 2.564 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)CC1(C)CC[NH+](C)CC1 ZINC001208107530 1313848555 /nfs/dbraw/zinc/84/85/55/1313848555.db2.gz VKTUILYZECDXTI-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP COc1ccc(N2CC[NH+](CC3(C)CC[NH+](C)CC3)CC2)c(C)c1 ZINC001208111277 1313849638 /nfs/dbraw/zinc/84/96/38/1313849638.db2.gz JHUZPZGGUWRLCF-UHFFFAOYSA-N 2 0 331.504 2.858 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645892 1302667695 /nfs/dbraw/zinc/66/76/95/1302667695.db2.gz DQKGBCIBOOSDBZ-STQMWFEESA-N 2 0 332.366 2.750 20 10 EFCDRP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc(N4CCOCC4)cc3)C2)C1 ZINC001276635623 1314144673 /nfs/dbraw/zinc/14/46/73/1314144673.db2.gz RARCXLZURFEPEX-OAQYLSRUSA-N 2 0 343.515 2.831 20 10 EFCDRP Cc1cc(=O)oc2c1ccc([O-])c2C[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001276826842 1311070632 /nfs/dbraw/zinc/07/06/32/1311070632.db2.gz ZGOZMWKQIWYSBM-HXUWFJFHSA-N 2 0 342.439 2.725 20 10 EFCDRP COC(=O)c1c(CN2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc2n1C ZINC001222147842 1311092010 /nfs/dbraw/zinc/09/20/10/1311092010.db2.gz BVDGJSKMUVIGAC-HXUWFJFHSA-N 2 0 341.455 2.540 20 10 EFCDRP CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000903087438 1312341273 /nfs/dbraw/zinc/34/12/73/1312341273.db2.gz GPXMFCQZOMDWJF-QUCCMNQESA-N 2 0 331.504 2.876 20 10 EFCDRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000903087441 1312341300 /nfs/dbraw/zinc/34/13/00/1312341300.db2.gz GPXMFCQZOMDWJF-UYAOXDASSA-N 2 0 331.504 2.876 20 10 EFCDRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1cccc(C)c1O)C2 ZINC001231591399 1312528406 /nfs/dbraw/zinc/52/84/06/1312528406.db2.gz BSUXPTURGCLUMJ-CTNGQTDRSA-N 2 0 344.499 2.881 20 10 EFCDRP Cc1cc(C)c(C[N@@H+]2CCc3onc(Cn4ccnc4)c3C2)c(O)c1 ZINC001231844746 1312573213 /nfs/dbraw/zinc/57/32/13/1312573213.db2.gz OYPANTPFTQZHBB-UHFFFAOYSA-N 2 0 338.411 2.800 20 10 EFCDRP C[N@@H+]1CC[C@]2(CCN(Cc3ccc(N4CCOCC4)c(Cl)c3)C2)C1 ZINC001232199063 1312647241 /nfs/dbraw/zinc/64/72/41/1312647241.db2.gz BCKSZNAOXKCRQZ-IBGZPJMESA-N 2 0 349.906 2.704 20 10 EFCDRP C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246177158 1314593990 /nfs/dbraw/zinc/59/39/90/1314593990.db2.gz ZNOOVERHUSPSGN-INIZCTEOSA-N 2 0 327.447 2.956 20 10 EFCDRP COc1ccccc1C[C@@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246177062 1314594368 /nfs/dbraw/zinc/59/43/68/1314594368.db2.gz YQQYRFGFBBMHFF-QGZVFWFLSA-N 2 0 339.483 2.826 20 10 EFCDRP COC(=O)Cc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(O)c1 ZINC001249201150 1315032761 /nfs/dbraw/zinc/03/27/61/1315032761.db2.gz HNLOERVQTOEEGE-UHFFFAOYSA-N 2 0 348.487 2.660 20 10 EFCDRP c1ccn(-c2ccc(-c3nnc(C[NH2+]CC4CC[NH2+]CC4)o3)cc2)c1 ZINC001217758008 1315110580 /nfs/dbraw/zinc/11/05/80/1315110580.db2.gz VKIDAMPTMDHNKU-UHFFFAOYSA-N 2 0 337.427 2.617 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3CC[NH2+]C4(CCC4)C3)cc2)CC1 ZINC001218310677 1315177620 /nfs/dbraw/zinc/17/76/20/1315177620.db2.gz JKCMCUVXMCRKLY-LJQANCHMSA-N 2 0 329.488 2.882 20 10 EFCDRP CC[NH+](CC)C[C@@H](O)C[NH2+][C@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001253216585 1315582410 /nfs/dbraw/zinc/58/24/10/1315582410.db2.gz OCFUZMFTUQWPGL-KXBFYZLASA-N 2 0 334.504 2.925 20 10 EFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@@H]1CC[NH3+] ZINC001328644444 1330611550 /nfs/dbraw/zinc/61/15/50/1330611550.db2.gz ZDRKVGHUTNWBHN-QFBILLFUSA-N 2 0 348.510 2.527 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc4c[nH]nc43)cc2)CC1 ZINC001333161012 1331086201 /nfs/dbraw/zinc/08/62/01/1331086201.db2.gz HZSIVPJKSPZWTD-UHFFFAOYSA-N 2 0 335.455 2.605 20 10 EFCDRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001333854691 1331228520 /nfs/dbraw/zinc/22/85/20/1331228520.db2.gz NYUBUPGUAZVMHF-UHFFFAOYSA-N 2 0 328.435 2.571 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC001337785112 1331598680 /nfs/dbraw/zinc/59/86/80/1331598680.db2.gz JQGWZEWRBQKJPF-IRXDYDNUSA-N 2 0 331.504 2.866 20 10 EFCDRP CCc1cccc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c1O ZINC000848911979 1334981450 /nfs/dbraw/zinc/98/14/50/1334981450.db2.gz LKSQIELWWQNBAA-UHFFFAOYSA-N 2 0 343.471 2.970 20 10 EFCDRP CCOC(=O)CC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)C ZINC000848927555 1334991844 /nfs/dbraw/zinc/99/18/44/1334991844.db2.gz HQVCWMGNMYCRRN-UHFFFAOYSA-N 2 0 347.503 2.602 20 10 EFCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000849350172 1335596675 /nfs/dbraw/zinc/59/66/75/1335596675.db2.gz LVNRPGWJHCGHFN-JOCLIGHLSA-N 2 0 329.488 2.784 20 10 EFCDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OC)c(OC)c2O)CC1 ZINC000891611895 714858363 /nfs/dbraw/zinc/85/83/63/714858363.db2.gz XROYATVUYHBKJW-UHFFFAOYSA-N 2 0 336.476 2.963 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1 ZINC000178440039 715911820 /nfs/dbraw/zinc/91/18/20/715911820.db2.gz NSIPILWVXRHIAS-JLYLLQBASA-N 2 0 329.488 2.879 20 10 EFCDRP COc1cc(Br)cc(CN2CC[C@@H](C[NH+](C)C)C2)c1O ZINC000179631764 717815715 /nfs/dbraw/zinc/81/57/15/717815715.db2.gz RYCVEPYKRWUHJT-NSHDSACASA-N 2 0 343.265 2.547 20 10 EFCDRP COc1ccc(C[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(O)c1OC ZINC000892591757 718318373 /nfs/dbraw/zinc/31/83/73/718318373.db2.gz JIUYZJDSTFDWTC-GASCZTMLSA-N 2 0 336.476 2.867 20 10 EFCDRP COc1ccc(C[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(O)c1OC ZINC000892591761 718318416 /nfs/dbraw/zinc/31/84/16/718318416.db2.gz JIUYZJDSTFDWTC-HUUCEWRRSA-N 2 0 336.476 2.867 20 10 EFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000186582380 720471975 /nfs/dbraw/zinc/47/19/75/720471975.db2.gz SOZAPVSEXPVEMC-IRXDYDNUSA-N 2 0 345.531 2.948 20 10 EFCDRP COc1cc(C)cc(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1O ZINC000894190779 721189329 /nfs/dbraw/zinc/18/93/29/721189329.db2.gz YBJZJFSVWVNXMM-UHFFFAOYSA-N 2 0 344.455 2.939 20 10 EFCDRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000154470827 728769600 /nfs/dbraw/zinc/76/96/00/728769600.db2.gz XEYYAELZDIMXTQ-GOSISDBHSA-N 2 0 332.536 2.821 20 10 EFCDRP COc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c(O)c1OC ZINC000895473986 724151810 /nfs/dbraw/zinc/15/18/10/724151810.db2.gz SCWQMVZYKLMTRN-UHFFFAOYSA-N 2 0 334.460 2.621 20 10 EFCDRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c(O)c1OC ZINC000895479793 724155214 /nfs/dbraw/zinc/15/52/14/724155214.db2.gz VNKBVPSEUURJOQ-HNNXBMFYSA-N 2 0 334.460 2.621 20 10 EFCDRP Cc1cccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1O ZINC000895607071 724221619 /nfs/dbraw/zinc/22/16/19/724221619.db2.gz KPUUOPVIMVGYGQ-UHFFFAOYSA-N 2 0 325.456 2.742 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CCC(CO)CC2)cc1)C1CC[NH+](C)CC1 ZINC000151593127 725786046 /nfs/dbraw/zinc/78/60/46/725786046.db2.gz CLJSKVQWBXGDSM-KRWDZBQOSA-N 2 0 345.531 2.715 20 10 EFCDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000158256934 728326073 /nfs/dbraw/zinc/32/60/73/728326073.db2.gz JCZMEXBCGTYKEH-CVEARBPZSA-N 2 0 335.467 2.655 20 10 EFCDRP C[C@@H](C[NH2+]Cc1cc(Br)ccc1O)C[NH+]1CCCC1 ZINC000227438304 728333161 /nfs/dbraw/zinc/33/31/61/728333161.db2.gz HJVVPZTUDRBBHU-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP COc1cc(C)c(C[NH2+][C@H]2C[C@@](C[NH3+])(c3ccccc3)C2)c(O)c1 ZINC001579144684 1090525985 /nfs/dbraw/zinc/52/59/85/1090525985.db2.gz LZBZTCWEVKEZCX-MOBUCQHHSA-N 2 0 326.440 2.858 20 10 EFCDRP [NH3+]C[C@H]1CCCC12CC[NH+](Cc1ccc(N3CCOCC3)cc1)CC2 ZINC001580260781 1090838902 /nfs/dbraw/zinc/83/89/02/1090838902.db2.gz RPWUAERUYZQZDV-LJQANCHMSA-N 2 0 343.515 2.864 20 10 EFCDRP C[NH+](C)Cc1cccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC001167431111 1101612585 /nfs/dbraw/zinc/61/25/85/1101612585.db2.gz HSQQKAFUTZCBMR-UHFFFAOYSA-N 2 0 339.487 2.507 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031486 1102838261 /nfs/dbraw/zinc/83/82/61/1102838261.db2.gz SOEGMBBYBAMGAE-GWCFXTLKSA-N 2 0 343.265 2.770 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088726 1102956864 /nfs/dbraw/zinc/95/68/64/1102956864.db2.gz AQLYLXMMDPEGAY-ZDUSSCGKSA-N 2 0 325.250 2.919 20 10 EFCDRP COc1ccc(N2CC[NH+](C3CCC([NH+](C)C)CC3)CC2)c(C)c1 ZINC001168329221 1106957912 /nfs/dbraw/zinc/95/79/12/1106957912.db2.gz QNVPPTDTPVNXKX-UHFFFAOYSA-N 2 0 331.504 2.998 20 10 EFCDRP CCC[N@@H+](Cc1cc(Br)ccc1O)C[C@@H]1CC[NH2+]C1 ZINC001236834338 1118164321 /nfs/dbraw/zinc/16/43/21/1118164321.db2.gz HRZNFHZMDQRQIW-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000183433488 1118725770 /nfs/dbraw/zinc/72/57/70/1118725770.db2.gz DNZFOKOQZZLDBX-QGZVFWFLSA-N 2 0 339.483 2.990 20 10 EFCDRP Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H](O)C[NH+]1CCCC1 ZINC000263707667 240389523 /nfs/dbraw/zinc/38/95/23/240389523.db2.gz SSKFHSRZERQJQJ-IBGZPJMESA-N 2 0 326.440 2.606 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@H](CN3CCOCC3)C2)ccc1N(C)C ZINC000294362494 241044919 /nfs/dbraw/zinc/04/49/19/241044919.db2.gz ZZAFUTJFHMEPPZ-LJQANCHMSA-N 2 0 331.504 2.605 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cc(F)ccc1O ZINC000184969149 473287876 /nfs/dbraw/zinc/28/78/76/473287876.db2.gz FDGPWYDSMWHFOV-AWEZNQCLSA-N 2 0 344.434 2.529 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000185206625 473362647 /nfs/dbraw/zinc/36/26/47/473362647.db2.gz VVBVJGSWWMHANQ-OAGGEKHMSA-N 2 0 336.476 2.941 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000154885519 472483573 /nfs/dbraw/zinc/48/35/73/472483573.db2.gz PSRXLAYUXQADLY-RTBURBONSA-N 2 0 344.547 2.963 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)N1CC[NH+](C)CC1 ZINC000132371179 472730059 /nfs/dbraw/zinc/73/00/59/472730059.db2.gz JYEZUULOSHHJKG-PXNSSMCTSA-N 2 0 332.536 2.675 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000120929598 472769987 /nfs/dbraw/zinc/76/99/87/472769987.db2.gz SUYINZUWFRNHRP-FXAWDEMLSA-N 2 0 332.536 2.677 20 10 EFCDRP COc1cccc(C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1O ZINC000092587380 472943110 /nfs/dbraw/zinc/94/31/10/472943110.db2.gz OEGQGANRVRURCF-IYBDPMFKSA-N 2 0 348.487 2.722 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000093734883 473136170 /nfs/dbraw/zinc/13/61/70/473136170.db2.gz LNFBTSWHVZWCKC-UHFFFAOYSA-N 2 0 331.504 2.829 20 10 EFCDRP COc1ccc(N2CCC([NH2+]CCC3CC[NH+](C)CC3)CC2)cc1 ZINC000125373217 473400548 /nfs/dbraw/zinc/40/05/48/473400548.db2.gz MCCDPPAZXJXPGZ-UHFFFAOYSA-N 2 0 331.504 2.986 20 10 EFCDRP C[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127308085 473598354 /nfs/dbraw/zinc/59/83/54/473598354.db2.gz SZJRDBMGJNQJHA-RTBURBONSA-N 2 0 344.547 2.963 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c(O)c1 ZINC000186197463 473613860 /nfs/dbraw/zinc/61/38/60/473613860.db2.gz RNDDIBFWBOLEGB-HNNXBMFYSA-N 2 0 329.444 2.887 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000227437242 474246500 /nfs/dbraw/zinc/24/65/00/474246500.db2.gz GFUJDVMTBJUZKB-LLVKDONJSA-N 2 0 325.250 2.729 20 10 EFCDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)c(O)c1 ZINC000284279397 474608978 /nfs/dbraw/zinc/60/89/78/474608978.db2.gz XHNXNCSDKMMCCQ-QZTJIDSGSA-N 2 0 333.520 2.932 20 10 EFCDRP C[C@@H]([NH2+]C[C@H]1CN(C)CCN1C)c1ccc(N2CCCCC2)cc1 ZINC000268879914 475048054 /nfs/dbraw/zinc/04/80/54/475048054.db2.gz HQCJMEJAVPBHOB-XLIONFOSSA-N 2 0 330.520 2.573 20 10 EFCDRP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000268998042 475118139 /nfs/dbraw/zinc/11/81/39/475118139.db2.gz OGCVTVMOOPNYDF-MRXNPFEDSA-N 2 0 349.494 2.923 20 10 EFCDRP Cc1cc(O)c(C[N@@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1C ZINC000367722782 477656158 /nfs/dbraw/zinc/65/61/58/477656158.db2.gz RLJJYBDRYLCPLW-IBGZPJMESA-N 2 0 331.504 2.609 20 10 EFCDRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000162559889 533850279 /nfs/dbraw/zinc/85/02/79/533850279.db2.gz ULRRRYPZIIFFPT-IBGZPJMESA-N 2 0 344.547 2.965 20 10 EFCDRP Oc1cc2c(cc1C[N@@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)OCO2 ZINC000157931651 534449469 /nfs/dbraw/zinc/44/94/69/534449469.db2.gz WVFJGNIEIAKBED-CZUORRHYSA-N 2 0 330.428 2.570 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@H](C)CCN2CC[NH+](C)CC2)cc1 ZINC000185881803 528306955 /nfs/dbraw/zinc/30/69/55/528306955.db2.gz SGUXPUOGSOQJNS-GOSISDBHSA-N 2 0 332.536 2.648 20 10 EFCDRP Cc1cc(C)c(O)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1 ZINC000754732979 575479990 /nfs/dbraw/zinc/47/99/90/575479990.db2.gz YULBZOQWAIDWIH-UHFFFAOYSA-N 2 0 332.488 2.943 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]CC(C)(C)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756400027 575731092 /nfs/dbraw/zinc/73/10/92/575731092.db2.gz UHHYGYUYNVYSRC-DZGCQCFKSA-N 2 0 335.467 2.695 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756408619 575732504 /nfs/dbraw/zinc/73/25/04/575732504.db2.gz QDSYHLLYMQQEHM-HOCLYGCPSA-N 2 0 335.467 2.697 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756412927 575733804 /nfs/dbraw/zinc/73/38/04/575733804.db2.gz WKQAPNILJMEGFB-FMKPAKJESA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2c1c(F)ccc2O ZINC000756533533 575756131 /nfs/dbraw/zinc/75/61/31/575756131.db2.gz IOLMWLIGAJZRRC-YOEHRIQHSA-N 2 0 349.494 2.943 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756534788 575756466 /nfs/dbraw/zinc/75/64/66/575756466.db2.gz OQYIGFOJHVFLIS-INMHGKMJSA-N 2 0 349.494 2.943 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2c1c(F)ccc2O ZINC000756565119 575763246 /nfs/dbraw/zinc/76/32/46/575763246.db2.gz VONBHCCLYSBNJI-IIAWOOMASA-N 2 0 336.451 2.906 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(C)CCO[C@@H]3C3CC3)cc2)CC1 ZINC000767194203 577199507 /nfs/dbraw/zinc/19/95/07/577199507.db2.gz ASTYSYROZNTKCU-NHCUHLMSSA-N 2 0 343.515 2.733 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc2c(cc1O)CCCC2 ZINC000768461438 577275759 /nfs/dbraw/zinc/27/57/59/577275759.db2.gz CWNRPXBBYYEAGG-SVFBPWRDSA-N 2 0 344.499 2.955 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C ZINC000769471338 577365036 /nfs/dbraw/zinc/36/50/36/577365036.db2.gz SSAQJWCBMNXSNK-PXNSSMCTSA-N 2 0 331.504 2.828 20 10 EFCDRP Cc1cccn2cc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)nc12 ZINC000771841765 581249443 /nfs/dbraw/zinc/24/94/43/581249443.db2.gz KETVYWVKJZNTRV-UHFFFAOYSA-N 2 0 349.482 2.684 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@](C)(CO)C3CCCCC3)cc2)CC1 ZINC000771842287 581249691 /nfs/dbraw/zinc/24/96/91/581249691.db2.gz MEPDOZGGXORLQQ-NRFANRHFSA-N 2 0 345.531 2.859 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc4c(c3)COC4)cc2)CC1 ZINC000771844761 581250022 /nfs/dbraw/zinc/25/00/22/581250022.db2.gz CGKJMTDKNQHMDA-UHFFFAOYSA-N 2 0 337.467 2.758 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000771847942 581250336 /nfs/dbraw/zinc/25/03/36/581250336.db2.gz SCJHSQYUNAJJBK-SFHVURJKSA-N 2 0 329.488 2.630 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)ccc1N(C)C ZINC000923381034 1261580290 /nfs/dbraw/zinc/58/02/90/1261580290.db2.gz ZKVUXSBALNQPEP-UYAOXDASSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)ccc1N(C)C ZINC000923381030 1261580515 /nfs/dbraw/zinc/58/05/15/1261580515.db2.gz ZKVUXSBALNQPEP-AZUAARDMSA-N 2 0 331.504 2.779 20 10 EFCDRP CO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C12CCC2 ZINC000825104221 1278400157 /nfs/dbraw/zinc/40/01/57/1278400157.db2.gz RGMYYMVQTMHWCE-WOJBJXKFSA-N 2 0 343.515 2.828 20 10 EFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000825275680 1278502300 /nfs/dbraw/zinc/50/23/00/1278502300.db2.gz XYXZDIWEEASBTK-UHFFFAOYSA-N 2 0 325.884 2.551 20 10 EFCDRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cc(Br)ccc1O)C2 ZINC001169107495 1272700065 /nfs/dbraw/zinc/70/00/65/1272700065.db2.gz IBFUFJFCFLVKOX-ZSOGYDGISA-N 2 0 325.250 2.870 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CC[NH2+]CC[C@@H]3C)cc2F)C[C@H](C)O1 ZINC000817888837 1276348502 /nfs/dbraw/zinc/34/85/02/1276348502.db2.gz PTPNBDLGIBWUTN-YIOZNXECSA-N 2 0 349.494 2.917 20 10 EFCDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817895431 1276364848 /nfs/dbraw/zinc/36/48/48/1276364848.db2.gz UWUJPMMKSGCOJN-IEBWSBKVSA-N 2 0 331.504 2.924 20 10 EFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817901811 1276366260 /nfs/dbraw/zinc/36/62/60/1276366260.db2.gz XSNJVVXBQJVAEI-MELADBBJSA-N 2 0 327.419 2.972 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1 ZINC000817898535 1276366683 /nfs/dbraw/zinc/36/66/83/1276366683.db2.gz IHQWMDAECVTVQD-XUVXKRRUSA-N 2 0 329.488 2.534 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC[C@H]3C[NH3+])cc2F)CC1 ZINC000817902644 1276367604 /nfs/dbraw/zinc/36/76/04/1276367604.db2.gz VVKUIMFIBWJEAN-PKOBYXMFSA-N 3 0 348.510 2.575 20 10 EFCDRP C[C@H]([NH2+]CCCN1CC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817937557 1276383096 /nfs/dbraw/zinc/38/30/96/1276383096.db2.gz XUFBRUYZXHCQEX-KRWDZBQOSA-N 2 0 348.510 2.762 20 10 EFCDRP COc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1O ZINC000817940331 1276385546 /nfs/dbraw/zinc/38/55/46/1276385546.db2.gz GBBQOKSYEXIJOD-SUMWQHHRSA-N 2 0 329.444 2.817 20 10 EFCDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817954789 1276397015 /nfs/dbraw/zinc/39/70/15/1276397015.db2.gz JZGNXNWEHJITCT-CABCVRRESA-N 2 0 337.895 2.827 20 10 EFCDRP CC[C@@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(C)cc1O ZINC000817971545 1276414659 /nfs/dbraw/zinc/41/46/59/1276414659.db2.gz FAYCJWHYLYPECT-GDBMZVCRSA-N 2 0 345.409 2.577 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(C)cc1O ZINC000817971558 1276414933 /nfs/dbraw/zinc/41/49/33/1276414933.db2.gz FAYCJWHYLYPECT-ZBFHGGJFSA-N 2 0 345.409 2.577 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCCO1)c1ccc(C(F)(F)F)cc1O ZINC000817980350 1276419555 /nfs/dbraw/zinc/41/95/55/1276419555.db2.gz AHBVYPOBJJXYKS-TZMCWYRMSA-N 2 0 332.366 2.830 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCCO1)c1cc(Br)ccc1O ZINC000817981954 1276419840 /nfs/dbraw/zinc/41/98/40/1276419840.db2.gz OVRBXLMTFWMMKW-JSGCOSHPSA-N 2 0 343.265 2.574 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817987454 1276427853 /nfs/dbraw/zinc/42/78/53/1276427853.db2.gz ZLPBXLGGNZKYCT-RDJZCZTQSA-N 2 0 347.478 2.988 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCOCC2)cc1 ZINC000817987150 1276429664 /nfs/dbraw/zinc/42/96/64/1276429664.db2.gz WTERELRAOXZWPY-DSLXNQLJSA-N 2 0 329.488 2.562 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCc3ccc4c[nH]nc4c3)cc2)CC1 ZINC000790620118 1277700098 /nfs/dbraw/zinc/70/00/98/1277700098.db2.gz WCUVZNBJUBNXBZ-UHFFFAOYSA-N 2 0 349.482 2.647 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)cc2)CC1 ZINC000791010721 1277905191 /nfs/dbraw/zinc/90/51/91/1277905191.db2.gz IUANQVNOFDZMKU-UHFFFAOYSA-N 3 0 344.547 2.650 20 10 EFCDRP C[C@@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1CC[NH3+] ZINC000844900648 1279322570 /nfs/dbraw/zinc/32/25/70/1279322570.db2.gz CAOWEBXQLYLTQZ-QAPCUYQASA-N 2 0 335.467 2.612 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c(O)c1 ZINC000844902542 1279323730 /nfs/dbraw/zinc/32/37/30/1279323730.db2.gz OWKBGZLTGCPXIB-FRQCXROJSA-N 2 0 334.460 2.509 20 10 EFCDRP COc1cc(Br)cc(C[NH+]2CCC(CC[NH3+])CC2)c1O ZINC000844911552 1279360168 /nfs/dbraw/zinc/36/01/68/1279360168.db2.gz OTETWLSSWWSOQI-UHFFFAOYSA-N 2 0 343.265 2.724 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000845991701 1279961707 /nfs/dbraw/zinc/96/17/07/1279961707.db2.gz VUXNLNRKASCMDV-INIZCTEOSA-N 2 0 325.456 2.995 20 10 EFCDRP CCN(CC)c1ccc(C[N@H+](C)CCN(C)C2CC[NH+](C)CC2)cc1 ZINC000809734186 1282412992 /nfs/dbraw/zinc/41/29/92/1282412992.db2.gz AXAKSVAUESQTAG-UHFFFAOYSA-N 2 0 346.563 2.991 20 10 EFCDRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)Cc1cc(C)c(C)cc1O ZINC000809737779 1282437224 /nfs/dbraw/zinc/43/72/24/1282437224.db2.gz KQEPWPJEGODYIZ-LJQANCHMSA-N 2 0 333.520 2.857 20 10 EFCDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc3c(cc2O)OCO3)cc1 ZINC000809738747 1282439068 /nfs/dbraw/zinc/43/90/68/1282439068.db2.gz HTUOTMUJESZBAV-UHFFFAOYSA-N 2 0 328.412 2.815 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@]3(C)CCCO)cc2)CC1 ZINC000809756126 1282458321 /nfs/dbraw/zinc/45/83/21/1282458321.db2.gz DGZLEJQRPXGRST-HXUWFJFHSA-N 2 0 331.504 2.565 20 10 EFCDRP Cn1ncc2ccc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)cc21 ZINC000812770746 1285424990 /nfs/dbraw/zinc/42/49/90/1285424990.db2.gz RCGFPWKNXUHJRX-UHFFFAOYSA-N 2 0 349.482 2.615 20 10 EFCDRP CCc1nc(C)c(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)o1 ZINC000813795092 1286122000 /nfs/dbraw/zinc/12/20/00/1286122000.db2.gz DVCZLXVQCDONNK-UHFFFAOYSA-N 2 0 328.460 2.587 20 10 EFCDRP COC(=O)[C@H]1CCC[C@@H]([NH2+]C2CCN(Cc3ccccc3O)CC2)C1 ZINC001172605468 1286199900 /nfs/dbraw/zinc/19/99/00/1286199900.db2.gz XQTUQZAURDSHIO-MAUKXSAKSA-N 2 0 346.471 2.678 20 10 EFCDRP COc1ccc(C[NH2+][C@H](C)C[C@H](C)NC(=O)CCC[NH+](C)C)cc1C ZINC001135314542 1287943120 /nfs/dbraw/zinc/94/31/20/1287943120.db2.gz CINRJHWQXNWRAA-SJORKVTESA-N 2 0 349.519 2.718 20 10 EFCDRP CC[NH+](CC)[C@H](C(=O)NCC[NH2+]Cc1ccc(OC)c(C)c1)C(C)C ZINC001135474300 1288024081 /nfs/dbraw/zinc/02/40/81/1288024081.db2.gz MPQJTWYJFIDPDW-IBGZPJMESA-N 2 0 349.519 2.576 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@]4(CCCO4)[C@H]3C3CC3)cc2)CC1 ZINC000816666292 1288235471 /nfs/dbraw/zinc/23/54/71/1288235471.db2.gz JLXQTSPBEXLLCR-NHCUHLMSSA-N 2 0 341.499 2.582 20 10 EFCDRP CCC[N@H+](C)CC(=O)N[C@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135979023 1288703006 /nfs/dbraw/zinc/70/30/06/1288703006.db2.gz AXIQTWWPPFBFAL-DLBZAZTESA-N 2 0 349.519 2.718 20 10 EFCDRP CCC[N@H+](C)CC(=O)N[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135979026 1288703058 /nfs/dbraw/zinc/70/30/58/1288703058.db2.gz AXIQTWWPPFBFAL-SJORKVTESA-N 2 0 349.519 2.718 20 10 EFCDRP C[C@H]([NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C)C1CC[NH+](C)CC1 ZINC000903448359 1312694957 /nfs/dbraw/zinc/69/49/57/1312694957.db2.gz NSVKSCGUYQCJDN-JXFKEZNVSA-N 2 0 332.536 2.675 20 10 EFCDRP COc1ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc1Cn1cccn1 ZINC000873006285 1289514709 /nfs/dbraw/zinc/51/47/09/1289514709.db2.gz DHBWWYLPHFCFQO-UHFFFAOYSA-N 2 0 330.476 2.617 20 10 EFCDRP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1Cn1cccn1 ZINC000873029347 1289529606 /nfs/dbraw/zinc/52/96/06/1289529606.db2.gz DCHWSSMQBNAYDV-SFHVURJKSA-N 2 0 342.487 2.760 20 10 EFCDRP COc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cn1cccn1 ZINC000873061277 1289546924 /nfs/dbraw/zinc/54/69/24/1289546924.db2.gz RAELXANEGIQLPQ-YJBOKZPZSA-N 2 0 328.460 2.512 20 10 EFCDRP CCCOc1ccc(C[NH2+]CCN2CCC([NH+](C)C)CC2)cc1C ZINC000873069365 1289551363 /nfs/dbraw/zinc/55/13/63/1289551363.db2.gz FDUWJLKYMHRAKV-UHFFFAOYSA-N 2 0 333.520 2.899 20 10 EFCDRP CCCOc1ccc(C[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cc1C ZINC000873122538 1289579910 /nfs/dbraw/zinc/57/99/10/1289579910.db2.gz SSGMVLAUMODNRC-UHFFFAOYSA-N 2 0 333.520 2.899 20 10 EFCDRP C[C@H](Nc1cc(N2CC[NH2+]CC2)cc[nH+]1)c1ccc(N(C)C)cc1 ZINC000873242880 1289675863 /nfs/dbraw/zinc/67/58/63/1289675863.db2.gz SOAGLVWCVMGZPU-HNNXBMFYSA-N 2 0 325.460 2.730 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000873245486 1289678328 /nfs/dbraw/zinc/67/83/28/1289678328.db2.gz RCCJHAAIFXYOQW-BFYDXBDKSA-N 2 0 335.467 2.830 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CC3(CO2)CC[NH2+]CC3)cc1 ZINC000873290155 1289704556 /nfs/dbraw/zinc/70/45/56/1289704556.db2.gz BIUFLPDIBNJDCP-APWZRJJASA-N 2 0 331.504 2.952 20 10 EFCDRP OC1CCN(c2ccc(C[NH2+]CCC[NH+]3CCCCC3)cc2)CC1 ZINC000876900970 1291065101 /nfs/dbraw/zinc/06/51/01/1291065101.db2.gz VQSBJUUKVDSSHU-UHFFFAOYSA-N 2 0 331.504 2.613 20 10 EFCDRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877073487 1291125316 /nfs/dbraw/zinc/12/53/16/1291125316.db2.gz LMFVSTBDJYQZAY-HKUYNNGSSA-N 2 0 331.504 2.610 20 10 EFCDRP C[NH+](C)CC1(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CCCC1 ZINC000877348130 1291203652 /nfs/dbraw/zinc/20/36/52/1291203652.db2.gz CKOFBRRGLWPELO-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP CC(C)(C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C[NH+]1CCCC1 ZINC000877474671 1291242785 /nfs/dbraw/zinc/24/27/85/1291242785.db2.gz ZGKUQEHVBKXSGA-UHFFFAOYSA-N 2 0 345.531 2.859 20 10 EFCDRP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877528147 1291259827 /nfs/dbraw/zinc/25/98/27/1291259827.db2.gz UMNCDEQJHJAXQM-UHFFFAOYSA-N 2 0 333.520 2.811 20 10 EFCDRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877532711 1291264319 /nfs/dbraw/zinc/26/43/19/1291264319.db2.gz WSPAQSIUBKQLNO-RXVVDRJESA-N 2 0 343.515 2.564 20 10 EFCDRP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000826099577 1292016295 /nfs/dbraw/zinc/01/62/95/1292016295.db2.gz DUPKDYLOSDOIJK-UHFFFAOYSA-N 2 0 339.911 2.860 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775498099 1292752178 /nfs/dbraw/zinc/75/21/78/1292752178.db2.gz HDMNJNUIWLACTE-WMLDXEAASA-N 2 0 339.911 2.970 20 10 EFCDRP COc1cccc(C[NH+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1O ZINC001203595822 1312966466 /nfs/dbraw/zinc/96/64/66/1312966466.db2.gz PMQXVJLHVMKTTB-RTBURBONSA-N 2 0 338.451 2.965 20 10 EFCDRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883290017 1293533022 /nfs/dbraw/zinc/53/30/22/1293533022.db2.gz IHBMGLMGCXCTKY-UYAOXDASSA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC(c4cn[nH]c4)CC3)cc2)CC1 ZINC000775663249 1293957731 /nfs/dbraw/zinc/95/77/31/1293957731.db2.gz LNRUBXHUDGQAMF-UHFFFAOYSA-N 2 0 339.487 2.541 20 10 EFCDRP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775664500 1293967050 /nfs/dbraw/zinc/96/70/50/1293967050.db2.gz WTHVUDSFEJXPOJ-UHFFFAOYSA-N 3 0 344.547 2.602 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@H+](CCCO)CC(C)(C)C)cc2)CC1 ZINC000775681849 1294105830 /nfs/dbraw/zinc/10/58/30/1294105830.db2.gz UQLMMHMWORUCMH-UHFFFAOYSA-N 2 0 333.520 2.669 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)OCC3(C)C)cc2)CC1 ZINC000775703792 1294173768 /nfs/dbraw/zinc/17/37/68/1294173768.db2.gz YLVRTSQEVLWCOC-UHFFFAOYSA-N 2 0 331.504 2.828 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC4(CCCC4)C3)cc2)CC1 ZINC000775714666 1294240616 /nfs/dbraw/zinc/24/06/16/1294240616.db2.gz VISQOISEMAFUML-UHFFFAOYSA-N 2 0 329.488 2.583 20 10 EFCDRP COc1ccc(N2CC[NH+](CC3CC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001204621353 1313174121 /nfs/dbraw/zinc/17/41/21/1313174121.db2.gz DNVMUCOCNHGUSJ-UHFFFAOYSA-N 2 0 329.488 2.597 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@](O)(C[NH3+])CC2)c2ccccc21 ZINC001205209695 1313251204 /nfs/dbraw/zinc/25/12/04/1313251204.db2.gz JZHPSDBWSKDGCB-HXUWFJFHSA-N 2 0 327.472 2.582 20 10 EFCDRP COc1cc(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(O)c(OC)c1 ZINC001235237451 1313271454 /nfs/dbraw/zinc/27/14/54/1313271454.db2.gz LLWCYBSJPWENNB-KRWDZBQOSA-N 2 0 334.460 2.764 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001205578615 1313316258 /nfs/dbraw/zinc/31/62/58/1313316258.db2.gz GYUNYPJGERWOAG-CQSZACIVSA-N 2 0 347.228 2.513 20 10 EFCDRP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235424390 1313318527 /nfs/dbraw/zinc/31/85/27/1313318527.db2.gz HSOJBOQBSBVCLZ-DLBZAZTESA-N 2 0 331.504 2.973 20 10 EFCDRP CN1CCOc2cc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)ccc21 ZINC001235424350 1313318758 /nfs/dbraw/zinc/31/87/58/1313318758.db2.gz HBSLPTUWVQGGAF-ROUUACIJSA-N 2 0 329.488 2.727 20 10 EFCDRP COc1ccccc1C[N@H+](C)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235660923 1313369266 /nfs/dbraw/zinc/36/92/66/1313369266.db2.gz IUNMHZTXGHGTKB-UHFFFAOYSA-N 2 0 325.456 2.737 20 10 EFCDRP Cc1cc(C)c(C[NH+]2C[C@@H]3CC[N@H+](CCN(C)C)CC[C@@H]3C2)c(O)c1 ZINC001276364623 1297336815 /nfs/dbraw/zinc/33/68/15/1297336815.db2.gz ACWZRKROWBXNBG-KDURUIRLSA-N 2 0 345.531 2.714 20 10 EFCDRP c1ccc(O[C@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235674805 1313372632 /nfs/dbraw/zinc/37/26/32/1313372632.db2.gz PQUJISGJPMSWEA-NRFANRHFSA-N 2 0 337.467 2.750 20 10 EFCDRP CCCCCC[NH+]1CCN(Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235692254 1313376588 /nfs/dbraw/zinc/37/65/88/1313376588.db2.gz RRCBWCWWRZMAMX-UHFFFAOYSA-N 2 0 347.503 2.572 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C[NH3+])[C@@H](C)C3)cc2)CC1 ZINC001206005515 1313389945 /nfs/dbraw/zinc/38/99/45/1313389945.db2.gz YJUPBSJYWJIDIX-ICSRJNTNSA-N 3 0 344.547 2.635 20 10 EFCDRP CCN(CC)c1ccc(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)cc1 ZINC001235816699 1313403739 /nfs/dbraw/zinc/40/37/39/1313403739.db2.gz WGWLXVAJYKMQDE-UHFFFAOYSA-N 2 0 344.547 2.793 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCc2ccccc2C1 ZINC001235834985 1313405910 /nfs/dbraw/zinc/40/59/10/1313405910.db2.gz SPHWMFRHQBZPBS-UHFFFAOYSA-N 2 0 337.467 2.750 20 10 EFCDRP C[N@H+](CCC(=O)c1ccccc1)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001235838840 1313406825 /nfs/dbraw/zinc/40/68/25/1313406825.db2.gz CRBOIOOXERTPKC-UHFFFAOYSA-N 2 0 337.467 2.801 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001235865488 1313412276 /nfs/dbraw/zinc/41/22/76/1313412276.db2.gz DTDVVVKJQWCGLW-VQIMIIECSA-N 2 0 329.488 2.956 20 10 EFCDRP Cc1cc(CN2CC[C@@H]([NH3+])[C@H](F)CC2)c(O)cc1Br ZINC001206209970 1313421014 /nfs/dbraw/zinc/42/10/14/1313421014.db2.gz JEGXLWWLNNIJKV-CHWSQXEVSA-N 2 0 331.229 2.724 20 10 EFCDRP Cc1cc(C[N@H+](C)C[C@H]2CCC[NH2+]C2)c(O)cc1Br ZINC001235959343 1313422999 /nfs/dbraw/zinc/42/29/99/1313422999.db2.gz OFFGGAVQAOTOKC-LBPRGKRZSA-N 2 0 327.266 2.895 20 10 EFCDRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC001206311646 1313434334 /nfs/dbraw/zinc/43/43/34/1313434334.db2.gz RWGCDYSNVRXVMH-HXUWFJFHSA-N 2 0 331.504 2.599 20 10 EFCDRP Cc1cc(C[N@@H+]2CCC[C@@H](N3CC([NH3+])C3)C2)c(C)n1-c1ccccc1 ZINC001236071867 1313436793 /nfs/dbraw/zinc/43/67/93/1313436793.db2.gz BKSASUZCCGWSRY-OAQYLSRUSA-N 2 0 338.499 2.701 20 10 EFCDRP CCCC[C@H]1CN(Cc2ccc(N3CC[NH+](CC)CC3)cc2)CC[NH2+]1 ZINC001236138066 1313445867 /nfs/dbraw/zinc/44/58/67/1313445867.db2.gz OPCGNLJIJVMQFD-FQEVSTJZSA-N 2 0 344.547 2.793 20 10 EFCDRP Cc1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c(O)cc1Br ZINC001236322005 1313469412 /nfs/dbraw/zinc/46/94/12/1313469412.db2.gz RDPIDDBNCIHREV-BETUJISGSA-N 2 0 339.277 2.895 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@@](C)(C[NH3+])C3)cc2)CC1 ZINC001206556266 1313475612 /nfs/dbraw/zinc/47/56/12/1313475612.db2.gz PXIPTIDURDHBOS-NRFANRHFSA-N 3 0 344.547 2.779 20 10 EFCDRP [NH3+]C[C@H]1CCCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C1 ZINC001206615527 1313484488 /nfs/dbraw/zinc/48/44/88/1313484488.db2.gz HIFQCCGDANORLU-OAHLLOKOSA-N 2 0 329.488 2.652 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(C(C)(C)C)cc1O)C1CC[NH2+]CC1 ZINC001236919837 1313552691 /nfs/dbraw/zinc/55/26/91/1313552691.db2.gz OFCOGIWBRZKXGJ-UHFFFAOYSA-N 2 0 333.520 2.805 20 10 EFCDRP C[NH+](C)CCN(Cc1cc2ccccc2cc1O)[C@H]1CCC[NH2+]C1 ZINC001236933521 1313556703 /nfs/dbraw/zinc/55/67/03/1313556703.db2.gz UKKHFFLUTLRQOI-IBGZPJMESA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]4(C3)CCCOC4)c(F)c2)CC1 ZINC001236941787 1313558279 /nfs/dbraw/zinc/55/82/79/1313558279.db2.gz FPNQJQMYNSTFQH-HXUWFJFHSA-N 2 0 347.478 2.580 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1ccc(OCC(F)(F)F)cc1O)CC2 ZINC001237058981 1313578626 /nfs/dbraw/zinc/57/86/26/1313578626.db2.gz MCQFCVYWFGGSNI-UHFFFAOYSA-N 2 0 344.377 2.861 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCNC4=CCCC[C@H]43)cc2)CC1 ZINC001237224646 1313609470 /nfs/dbraw/zinc/60/94/70/1313609470.db2.gz HXXGUOGPBOUFNL-OAQYLSRUSA-N 2 0 340.515 2.670 20 10 EFCDRP [NH3+]CCCC[NH+]1CCN(c2ccc(OCc3cccnc3)cc2)CC1 ZINC001237259828 1313613897 /nfs/dbraw/zinc/61/38/97/1313613897.db2.gz YXDHWJMQKUYYHV-UHFFFAOYSA-N 2 0 340.471 2.522 20 10 EFCDRP CO[C@@H]1[C@@H](C)[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000776497813 1299316490 /nfs/dbraw/zinc/31/64/90/1299316490.db2.gz GBQYLOITEMGKNN-ZYSHUDEJSA-N 2 0 331.504 2.588 20 10 EFCDRP COCC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccco1 ZINC000779994643 1300175610 /nfs/dbraw/zinc/17/56/10/1300175610.db2.gz UIPWOQZCBIWIDN-LJQANCHMSA-N 2 0 343.471 2.899 20 10 EFCDRP Cc1cc(O)c(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)cc1Br ZINC001237678772 1313690251 /nfs/dbraw/zinc/69/02/51/1313690251.db2.gz BVSZHIAOXFSRMD-OCCSQVGLSA-N 2 0 339.277 2.847 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000121177519 1303748005 /nfs/dbraw/zinc/74/80/05/1303748005.db2.gz BFBCRVDMCYEGHR-QZTJIDSGSA-N 2 0 332.536 2.677 20 10 EFCDRP CC[NH+]1CCC(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC001208599462 1313972751 /nfs/dbraw/zinc/97/27/51/1313972751.db2.gz IJTJJLDXGHGFGX-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000800374687 1307767641 /nfs/dbraw/zinc/76/76/41/1307767641.db2.gz OCGNPTYLMTYOOU-GOSISDBHSA-N 2 0 332.536 2.819 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCC[C@]4(CCCC[NH2+]4)C3)cc2)CC1 ZINC001222391165 1311123721 /nfs/dbraw/zinc/12/37/21/1311123721.db2.gz YVWVKJWIIOROMZ-OAQYLSRUSA-N 2 0 342.531 2.547 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)[NH+](C)C)cc1 ZINC000902518335 1311827909 /nfs/dbraw/zinc/82/79/09/1311827909.db2.gz PDQKPDULGHVMBV-NCYKPQTJSA-N 2 0 344.547 2.866 20 10 EFCDRP CC[NH+](CC)CCCN1CC[NH+](Cc2c(C)cc(C)cc2O)CC1 ZINC001231845585 1312573273 /nfs/dbraw/zinc/57/32/73/1312573273.db2.gz BRRURLKNWCEMPJ-UHFFFAOYSA-N 2 0 333.520 2.859 20 10 EFCDRP COCC[N@H+](Cc1cc(Cl)c(C)cc1O)C1CCN(C)CC1 ZINC001231869406 1312578169 /nfs/dbraw/zinc/57/81/69/1312578169.db2.gz OKVDWFKFQKLUFU-UHFFFAOYSA-N 2 0 326.868 2.897 20 10 EFCDRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1ccc2ccccc2c1O ZINC001231880895 1312579682 /nfs/dbraw/zinc/57/96/82/1312579682.db2.gz SKADMUZNEUIGBG-VQTJNVASSA-N 2 0 339.483 2.756 20 10 EFCDRP C[C@H](Cc1ccccc1F)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246171798 1314593452 /nfs/dbraw/zinc/59/34/52/1314593452.db2.gz DNQVJBRXGXMMAC-MRXNPFEDSA-N 2 0 327.447 2.956 20 10 EFCDRP COc1ccccc1C[C@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246177059 1314593756 /nfs/dbraw/zinc/59/37/56/1314593756.db2.gz YQQYRFGFBBMHFF-KRWDZBQOSA-N 2 0 339.483 2.826 20 10 EFCDRP C[C@H]1CC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C[NH2+]1 ZINC001246339622 1314612923 /nfs/dbraw/zinc/61/29/23/1314612923.db2.gz GJRDXSMHOABYBI-TUGJPZLJSA-N 2 0 341.455 2.569 20 10 EFCDRP C[NH2+][C@@H](CCCC[NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217704729 1315103594 /nfs/dbraw/zinc/10/35/94/1315103594.db2.gz XLIGMTIMMGUCCW-INIZCTEOSA-N 2 0 325.416 2.917 20 10 EFCDRP Cc1cc(C[NH+]2CC3(C2)CC[NH+](C)CC3)c(O)cc1Br ZINC001250132688 1315177199 /nfs/dbraw/zinc/17/71/99/1315177199.db2.gz CVXNKZFVCGSDPG-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@H]3CN(CC[NH+](C)C)C[C@H]32)c(O)c1 ZINC001276814006 1315422191 /nfs/dbraw/zinc/42/21/91/1315422191.db2.gz AFBLVYNSFKPLCA-PKOBYXMFSA-N 2 0 331.504 2.583 20 10 EFCDRP C[C@](O)(C[NH2+]C1CC[NH+](Cc2ccccc2O)CC1)c1ccccc1 ZINC001253122127 1315572369 /nfs/dbraw/zinc/57/23/69/1315572369.db2.gz JPYAKOIUARKBRC-NRFANRHFSA-N 2 0 340.467 2.854 20 10 EFCDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+]C[C@H](O)C[NH2+]C(C)(C)C ZINC001253412399 1315601699 /nfs/dbraw/zinc/60/16/99/1315601699.db2.gz HABWCJYPNDROAB-KBXCAEBGSA-N 2 0 334.504 2.971 20 10 EFCDRP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001326519454 1330309373 /nfs/dbraw/zinc/30/93/73/1330309373.db2.gz OOFUCFPYYLHKMG-UXHICEINSA-N 2 0 329.488 2.615 20 10 EFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@H]1CC[NH3+] ZINC001328644443 1330611362 /nfs/dbraw/zinc/61/13/62/1330611362.db2.gz ZDRKVGHUTNWBHN-LPHOPBHVSA-N 2 0 348.510 2.527 20 10 EFCDRP CN(CCC[N@H+](C)Cc1ccc(N2CCCC2)cc1)CC[NH+](C)C ZINC001329834601 1330741336 /nfs/dbraw/zinc/74/13/36/1330741336.db2.gz NSOUTURWUMYAEH-UHFFFAOYSA-N 2 0 332.536 2.602 20 10 EFCDRP CN1CCN(c2ccc(C[NH2+]CCCc3nccs3)cc2F)CC1 ZINC001343500863 1332351431 /nfs/dbraw/zinc/35/14/31/1332351431.db2.gz FBCRQGBCSAQCBP-UHFFFAOYSA-N 2 0 348.491 2.756 20 10 EFCDRP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(=O)OC(C)(C)C ZINC000848565954 1334797820 /nfs/dbraw/zinc/79/78/20/1334797820.db2.gz OGLHGJYYCYLIQJ-MRXNPFEDSA-N 2 0 347.503 2.506 20 10 EFCDRP CCc1cccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1O ZINC000848884328 1334960246 /nfs/dbraw/zinc/96/02/46/1334960246.db2.gz HIPQLYQBHFABRY-UHFFFAOYSA-N 2 0 332.488 2.889 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cc1OC ZINC000849349495 1335596834 /nfs/dbraw/zinc/59/68/34/1335596834.db2.gz BGTHCYMJLZEVDK-HNNXBMFYSA-N 2 0 334.460 2.621 20 10 EFCDRP COc1ccc(C[NH2+][C@H](Cn2ccnc2)C(C)(C)C)c(O)c1OC ZINC000892651528 718375655 /nfs/dbraw/zinc/37/56/55/718375655.db2.gz ZLOYVMWULPLDAG-OAHLLOKOSA-N 2 0 333.432 2.810 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c(O)c1OC ZINC000894479414 722752206 /nfs/dbraw/zinc/75/22/06/722752206.db2.gz PFOQVYSQBNQMSW-OAHLLOKOSA-N 2 0 334.460 2.573 20 10 EFCDRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000154470704 728769609 /nfs/dbraw/zinc/76/96/09/728769609.db2.gz XEYYAELZDIMXTQ-SFHVURJKSA-N 2 0 332.536 2.821 20 10 EFCDRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c(O)c1OC ZINC000895479797 724155346 /nfs/dbraw/zinc/15/53/46/724155346.db2.gz VNKBVPSEUURJOQ-OAHLLOKOSA-N 2 0 334.460 2.621 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(F)ccc3O)cc2)CC1 ZINC000895607332 724221855 /nfs/dbraw/zinc/22/18/55/724221855.db2.gz MRAFCFJQKXLHOW-UHFFFAOYSA-N 2 0 329.419 2.573 20 10 EFCDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000227441917 728333113 /nfs/dbraw/zinc/33/31/13/728333113.db2.gz INDXNPUOACMHCY-LBPRGKRZSA-N 2 0 327.266 2.975 20 10 EFCDRP C[C@H](C[NH2+]Cc1cc(Br)ccc1O)C[NH+]1CCCC1 ZINC000227438316 728333211 /nfs/dbraw/zinc/33/32/11/728333211.db2.gz HJVVPZTUDRBBHU-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[C@H]([NH3+])[C@@H]4C3)cc2)CC1 ZINC001578940867 1090484113 /nfs/dbraw/zinc/48/41/13/1090484113.db2.gz LJWJMCMVJNMGRN-WMQCIHAUSA-N 2 0 343.515 2.861 20 10 EFCDRP COc1cc(C[N@@H+]2CCOC3(CC[NH2+]CC3)C2)c(O)c(C(C)(C)C)c1 ZINC001579148852 1090527212 /nfs/dbraw/zinc/52/72/12/1090527212.db2.gz GOIWQCLBIKEDSY-UHFFFAOYSA-N 2 0 348.487 2.653 20 10 EFCDRP Cc1cc(Br)cc(C[NH2+]C2CC3(CC([NH3+])C3)C2)c1O ZINC001579551341 1090631752 /nfs/dbraw/zinc/63/17/52/1090631752.db2.gz JAVOMLVGLOCOKL-UHFFFAOYSA-N 2 0 325.250 2.823 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]Cc1cc(C(C)(C)[NH3+])no1 ZINC001579617010 1090644130 /nfs/dbraw/zinc/64/41/30/1090644130.db2.gz JWIFMLJEAFPZII-CQSZACIVSA-N 2 0 330.476 2.964 20 10 EFCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)cc1 ZINC001580339425 1090869081 /nfs/dbraw/zinc/86/90/81/1090869081.db2.gz LPZKGTJGCKTGES-UHFFFAOYSA-N 2 0 343.446 2.535 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC001580888746 1091035422 /nfs/dbraw/zinc/03/54/22/1091035422.db2.gz XVZLFMFUXZVUTJ-VHRBIJSZSA-N 2 0 325.250 2.632 20 10 EFCDRP Oc1ccc(Cl)cc1CN1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC001580888507 1091035439 /nfs/dbraw/zinc/03/54/39/1091035439.db2.gz NKKHVFFDRZIIEC-KTGAGVNESA-N 2 0 349.906 2.883 20 10 EFCDRP [NH3+]CCc1ccc(C[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000841032196 1102839642 /nfs/dbraw/zinc/83/96/42/1102839642.db2.gz OTNMHLIKVPSMSE-UHFFFAOYSA-N 2 0 335.245 2.946 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168390975 1104184700 /nfs/dbraw/zinc/18/47/00/1104184700.db2.gz JQXCYJITJMSJIZ-UHFFFAOYSA-N 2 0 343.515 2.829 20 10 EFCDRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185022238 1119685066 /nfs/dbraw/zinc/68/50/66/1119685066.db2.gz UWMDKVXKIZDNOT-SJORKVTESA-N 2 0 345.531 2.948 20 10 EFCDRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185022217 1119685179 /nfs/dbraw/zinc/68/51/79/1119685179.db2.gz UWMDKVXKIZDNOT-IRXDYDNUSA-N 2 0 345.531 2.948 20 10 EFCDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185648025 1120409978 /nfs/dbraw/zinc/40/99/78/1120409978.db2.gz PVYUYGAFGQCSPZ-INIZCTEOSA-N 2 0 345.531 2.948 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1OC ZINC000160527235 239052366 /nfs/dbraw/zinc/05/23/66/239052366.db2.gz RQQXCWFWZGMFLV-UHFFFAOYSA-N 2 0 336.476 2.963 20 10 EFCDRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000288542286 241016605 /nfs/dbraw/zinc/01/66/05/241016605.db2.gz KZUAJPOXFFYZAI-UHFFFAOYSA-N 2 0 341.455 2.637 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CC2 ZINC000296490624 241088593 /nfs/dbraw/zinc/08/85/93/241088593.db2.gz POHIGHPVPFTFBH-RBUKOAKNSA-N 2 0 338.451 2.736 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000364452033 242298962 /nfs/dbraw/zinc/29/89/62/242298962.db2.gz WBCRJDMCGQRUEN-JQHSSLGASA-N 2 0 347.478 2.940 20 10 EFCDRP C[NH+]1CCC(N2CCC([NH2+]Cc3c(O)cccc3Cl)CC2)CC1 ZINC000113331408 544569919 /nfs/dbraw/zinc/56/99/19/544569919.db2.gz SAVQNWIEQNHDNH-UHFFFAOYSA-N 2 0 337.895 2.694 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c(O)c1 ZINC000184968945 473286496 /nfs/dbraw/zinc/28/64/96/473286496.db2.gz TVGCQVQDDLDFDT-MRXNPFEDSA-N 2 0 340.471 2.698 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)N1CC[NH+](C)CC1 ZINC000184976961 473289200 /nfs/dbraw/zinc/28/92/00/473289200.db2.gz MSDMICLADWHTOF-YOEHRIQHSA-N 2 0 339.911 2.968 20 10 EFCDRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000184983361 473291305 /nfs/dbraw/zinc/29/13/05/473291305.db2.gz YNJHBJYKMCBWHC-INIZCTEOSA-N 2 0 345.531 2.948 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCN2CC[NH+](CC)CC2)cc1 ZINC000154242659 472406195 /nfs/dbraw/zinc/40/61/95/472406195.db2.gz PVOSLPYLUKDPIN-SFHVURJKSA-N 2 0 332.536 2.821 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCCN2CCC[N@H+](C)CC2)cc1 ZINC000128281621 472428292 /nfs/dbraw/zinc/42/82/92/472428292.db2.gz YAOZGIOZSDUPBF-GOSISDBHSA-N 2 0 332.536 2.821 20 10 EFCDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000154885274 472483718 /nfs/dbraw/zinc/48/37/18/472483718.db2.gz PSRXLAYUXQADLY-MOPGFXCFSA-N 2 0 344.547 2.963 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185344959 473401304 /nfs/dbraw/zinc/40/13/04/473401304.db2.gz CZLMUFGOVUOHET-LSDHHAIUSA-N 2 0 339.911 2.970 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)C1 ZINC000151526447 473469485 /nfs/dbraw/zinc/46/94/85/473469485.db2.gz SYDRMKTWWMPPLN-BEFAXECRSA-N 2 0 349.494 2.607 20 10 EFCDRP C[N@H+](Cc1ccccc1O)C1CCN(CCc2ccccn2)CC1 ZINC000179564807 473694712 /nfs/dbraw/zinc/69/47/12/473694712.db2.gz KHEABANPMFKFGK-UHFFFAOYSA-N 2 0 325.456 2.926 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000179884126 473748782 /nfs/dbraw/zinc/74/87/82/473748782.db2.gz DCYGSLQEOLWNNP-HZPDHXFCSA-N 2 0 348.487 2.722 20 10 EFCDRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3cc(Cl)cc(C)c3O)C2)CC1 ZINC000180069520 473790926 /nfs/dbraw/zinc/79/09/26/473790926.db2.gz COFSVPPOWABZII-KRWDZBQOSA-N 2 0 337.895 2.566 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000282487593 474083673 /nfs/dbraw/zinc/08/36/73/474083673.db2.gz XHDJSZOIEDROLA-QGZVFWFLSA-N 2 0 332.536 2.819 20 10 EFCDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](CCCC(=O)OC)CC1 ZINC000291092576 474594186 /nfs/dbraw/zinc/59/41/86/474594186.db2.gz XYSSITSIQQOVDW-UHFFFAOYSA-N 2 0 347.503 2.779 20 10 EFCDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)c(O)c1C ZINC000273605172 474986312 /nfs/dbraw/zinc/98/63/12/474986312.db2.gz TWXJXSSJZUUCMT-QGZVFWFLSA-N 2 0 333.520 2.933 20 10 EFCDRP C[C@@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1ccc(N2CCCCC2)cc1 ZINC000268879915 475047272 /nfs/dbraw/zinc/04/72/72/475047272.db2.gz HQCJMEJAVPBHOB-YLJYHZDGSA-N 2 0 330.520 2.573 20 10 EFCDRP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000269076050 475163331 /nfs/dbraw/zinc/16/33/31/475163331.db2.gz YNFQLZMMPFGXFJ-KRWDZBQOSA-N 2 0 331.504 2.784 20 10 EFCDRP CC[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(C)cc1O ZINC000375649210 476934316 /nfs/dbraw/zinc/93/43/16/476934316.db2.gz PPLATRLCANSRND-VQIMIIECSA-N 2 0 331.504 2.910 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)cc1 ZINC000268401603 535686676 /nfs/dbraw/zinc/68/66/76/535686676.db2.gz CSILYDPDYIICMJ-UHFFFAOYSA-N 2 0 333.520 2.858 20 10 EFCDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)CC1 ZINC000367684878 536345955 /nfs/dbraw/zinc/34/59/55/536345955.db2.gz IZWOQQGJBXFUJR-FQEVSTJZSA-N 2 0 343.515 2.687 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)N1CC[NH+](C)CC1 ZINC000756398128 575730847 /nfs/dbraw/zinc/73/08/47/575730847.db2.gz BTLJORIXIJSWDI-PVAVHDDUSA-N 2 0 349.494 2.941 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756400030 575731161 /nfs/dbraw/zinc/73/11/61/575731161.db2.gz UHHYGYUYNVYSRC-UKRRQHHQSA-N 2 0 335.467 2.695 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000756408623 575732367 /nfs/dbraw/zinc/73/23/67/575732367.db2.gz QDSYHLLYMQQEHM-ZBFHGGJFSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2c1c(F)ccc2O ZINC000756408419 575732458 /nfs/dbraw/zinc/73/24/58/575732458.db2.gz MHKZUIMKYIQGDV-HOCLYGCPSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2c1c(F)ccc2O ZINC000756548153 575759304 /nfs/dbraw/zinc/75/93/04/575759304.db2.gz IYMJZLBFUSCJMS-ZBFHGGJFSA-N 2 0 335.467 2.697 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)c2c1c(F)ccc2O ZINC000756578916 575765035 /nfs/dbraw/zinc/76/50/35/575765035.db2.gz XQJOJYJJEPXOOE-JKIFEVAISA-N 2 0 347.478 2.838 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756636510 575771574 /nfs/dbraw/zinc/77/15/74/575771574.db2.gz DYDVAPBUUHRDFH-CZUORRHYSA-N 2 0 335.467 2.695 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@H](OCC[NH+](CC)CC)C2)c1O ZINC000769515459 577369220 /nfs/dbraw/zinc/36/92/20/577369220.db2.gz QTVRWFDYFSNIFO-KRWDZBQOSA-N 2 0 336.476 2.724 20 10 EFCDRP C[C@H](CC(=O)OC(C)(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771842389 581249641 /nfs/dbraw/zinc/24/96/41/581249641.db2.gz GRDYBCBQFJFYGF-MRXNPFEDSA-N 2 0 347.503 2.648 20 10 EFCDRP CCC(CC)(CC(=O)OC)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771840948 581249679 /nfs/dbraw/zinc/24/96/79/581249679.db2.gz BJBJXBSHQHKWJI-UHFFFAOYSA-N 2 0 347.503 2.650 20 10 EFCDRP CO[C@@]1(C)C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000771841076 581249701 /nfs/dbraw/zinc/24/97/01/581249701.db2.gz DEQWKVOHURPVPN-QUCCMNQESA-N 2 0 331.504 2.732 20 10 EFCDRP C[C@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771864201 581252438 /nfs/dbraw/zinc/25/24/38/581252438.db2.gz KIAAKVGCBMBWMP-VQIMIIECSA-N 2 0 343.471 2.633 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCSCC(F)(F)F)cc2)CC1 ZINC000771867717 581252831 /nfs/dbraw/zinc/25/28/31/581252831.db2.gz IFZSCPLMHJPVGC-UHFFFAOYSA-N 2 0 347.450 2.824 20 10 EFCDRP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000771888376 581255066 /nfs/dbraw/zinc/25/50/66/581255066.db2.gz OLQHXRCCKZCPBX-UYAOXDASSA-N 2 0 331.504 2.732 20 10 EFCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@H](C)C2)cc1 ZINC000773823593 581466387 /nfs/dbraw/zinc/46/63/87/581466387.db2.gz UWLMHUKZQQIGCL-NQIIRXRSSA-N 2 0 344.547 2.601 20 10 EFCDRP COc1cc(C[NH2+]C[C@H]2CN3CCC[C@@H]3CO2)c(O)c(C(C)(C)C)c1 ZINC000850118479 1250291203 /nfs/dbraw/zinc/29/12/03/1250291203.db2.gz HJKLAUKOETVIMP-WBVHZDCISA-N 2 0 348.487 2.651 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4ccc(O)cc43)cc2)CC1 ZINC000850386765 1250457898 /nfs/dbraw/zinc/45/78/98/1250457898.db2.gz MEALKIMSHXHGGW-OAQYLSRUSA-N 2 0 337.467 2.921 20 10 EFCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)ccc1N(C)C ZINC000923393764 1261599747 /nfs/dbraw/zinc/59/97/47/1261599747.db2.gz XNAJVZWSNOJISK-DFQSSKMNSA-N 2 0 331.504 2.922 20 10 EFCDRP Cc1cc(O)c(C[NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)cc1Cl ZINC000825097736 1278409736 /nfs/dbraw/zinc/40/97/36/1278409736.db2.gz XZXXRDSTWSHIOU-QGZVFWFLSA-N 2 0 339.911 2.716 20 10 EFCDRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000825167484 1278432240 /nfs/dbraw/zinc/43/22/40/1278432240.db2.gz MXERMKAWCLWIAG-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000701073955 1269868752 /nfs/dbraw/zinc/86/87/52/1269868752.db2.gz GJALGVRLRQPOIH-GFCCVEGCSA-N 2 0 327.266 2.975 20 10 EFCDRP C[C@@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000702603463 1271554616 /nfs/dbraw/zinc/55/46/16/1271554616.db2.gz NDVGXCUEBIAPDZ-UZLBHIALSA-N 2 0 326.440 2.680 20 10 EFCDRP C[N@@H+](Cc1c(O)cccc1Br)CC1CC[NH+](C)CC1 ZINC000707137334 1275337965 /nfs/dbraw/zinc/33/79/65/1275337965.db2.gz YXDFAJRVKWLQNP-UHFFFAOYSA-N 2 0 327.266 2.928 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(O)ccc2ccncc21 ZINC000746644219 1275683254 /nfs/dbraw/zinc/68/32/54/1275683254.db2.gz ASNXLNRPJWASJD-MOXGXCLJSA-N 2 0 341.455 2.624 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817897937 1276366833 /nfs/dbraw/zinc/36/68/33/1276366833.db2.gz AWAYZDQZAMFRJG-GRDNDAEWSA-N 2 0 339.430 2.974 20 10 EFCDRP C[C@@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000817902472 1276366925 /nfs/dbraw/zinc/36/69/25/1276366925.db2.gz RCOYPMDSYAUVDI-NSISKUIASA-N 2 0 331.504 2.765 20 10 EFCDRP C[C@H]([NH3+])[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000817902470 1276367503 /nfs/dbraw/zinc/36/75/03/1276367503.db2.gz RCOYPMDSYAUVDI-FFZOFVMBSA-N 2 0 331.504 2.765 20 10 EFCDRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817940484 1276386099 /nfs/dbraw/zinc/38/60/99/1276386099.db2.gz IDEYBGKNETVALP-AWEZNQCLSA-N 2 0 337.895 2.827 20 10 EFCDRP CN(C)c1ccc([C@H]([NH3+])CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000817942760 1276387894 /nfs/dbraw/zinc/38/78/94/1276387894.db2.gz QVLHLRIVLZOQDM-YSTOQKLRSA-N 2 0 330.520 2.653 20 10 EFCDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817947759 1276390876 /nfs/dbraw/zinc/39/08/76/1276390876.db2.gz QJUZCNWYSPGXCK-YQQAZPJKSA-N 2 0 335.467 2.701 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1)[C@H]1CCC[NH2+]C1 ZINC000817947758 1276390906 /nfs/dbraw/zinc/39/09/06/1276390906.db2.gz QJUZCNWYSPGXCK-UXLLHSPISA-N 2 0 335.467 2.701 20 10 EFCDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccc(N2CCOCC2)c(F)c1 ZINC000817959539 1276398806 /nfs/dbraw/zinc/39/88/06/1276398806.db2.gz GXWXFEZYHWBSOI-LESCRADOSA-N 2 0 335.467 2.830 20 10 EFCDRP CC[C@H]([NH2+]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc(C)cc1O ZINC000817971553 1276414846 /nfs/dbraw/zinc/41/48/46/1276414846.db2.gz FAYCJWHYLYPECT-GOEBONIOSA-N 2 0 345.409 2.577 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000817976931 1276415445 /nfs/dbraw/zinc/41/54/45/1276415445.db2.gz XDEQEMRTHFGREJ-YGRLFVJLSA-N 2 0 325.250 2.947 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000817976930 1276416029 /nfs/dbraw/zinc/41/60/29/1276416029.db2.gz XDEQEMRTHFGREJ-QMTHXVAHSA-N 2 0 325.250 2.947 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(Br)cc1O ZINC000817976630 1276417378 /nfs/dbraw/zinc/41/73/78/1276417378.db2.gz PWOQKPHMLFRWQM-IINYFYTJSA-N 2 0 325.250 2.947 20 10 EFCDRP CCOC1CC(CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000788969577 1276419360 /nfs/dbraw/zinc/41/93/60/1276419360.db2.gz JZLZPKKRXVEPKU-UHFFFAOYSA-N 2 0 331.504 2.733 20 10 EFCDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817981632 1276419871 /nfs/dbraw/zinc/41/98/71/1276419871.db2.gz UCEYDTUUYFEPEK-WBVHZDCISA-N 2 0 335.467 2.845 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)CC2)cc1 ZINC000817986898 1276424628 /nfs/dbraw/zinc/42/46/28/1276424628.db2.gz VPQJFESMMJSJQV-LZLYRXPVSA-N 2 0 329.488 2.642 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)CC2)cc1 ZINC000817986897 1276424781 /nfs/dbraw/zinc/42/47/81/1276424781.db2.gz VPQJFESMMJSJQV-JFIYKMOQSA-N 2 0 329.488 2.642 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000818221952 1276493418 /nfs/dbraw/zinc/49/34/18/1276493418.db2.gz PTXNUSGPRXGBQK-AOIWGVFYSA-N 2 0 329.488 2.738 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3ccc(OC)cc3)C2)[C@H](C)C1 ZINC000818344141 1276510826 /nfs/dbraw/zinc/51/08/26/1276510826.db2.gz JUARENPNVBUMOD-UWVAXJGDSA-N 2 0 331.504 2.841 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000818343982 1276511013 /nfs/dbraw/zinc/51/10/13/1276511013.db2.gz GTLCUTLCVYBSEL-GOSISDBHSA-N 2 0 343.515 2.986 20 10 EFCDRP Cc1cc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@@H](C)C2)ccc1N(C)C ZINC000815078042 1287301671 /nfs/dbraw/zinc/30/16/71/1287301671.db2.gz LZPUSWSABYUTGG-RXVVDRJESA-N 2 0 344.547 2.519 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)cc1F ZINC000844902230 1279325196 /nfs/dbraw/zinc/32/51/96/1279325196.db2.gz MDVVQSBKIUVQOV-FCEWJHQRSA-N 2 0 335.467 2.610 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH+]3CCC4(CCOCC4)CC3)cc2)CC1 ZINC000793626019 1279781088 /nfs/dbraw/zinc/78/10/88/1279781088.db2.gz XXQNIHBMNFRLBE-UHFFFAOYSA-N 2 0 343.515 2.831 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693297 1281846935 /nfs/dbraw/zinc/84/69/35/1281846935.db2.gz YOBCQLBAFBGGBQ-HIFRSBDPSA-N 2 0 339.911 2.888 20 10 EFCDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)N2CC[NH+](C)CC2)c1O ZINC000808690921 1281847004 /nfs/dbraw/zinc/84/70/04/1281847004.db2.gz GZHMBLUDVLXDHT-UONOGXRCSA-N 2 0 325.884 2.641 20 10 EFCDRP C[N@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1O ZINC000809694624 1282382102 /nfs/dbraw/zinc/38/21/02/1282382102.db2.gz QRKCYUAOTUEFCO-UHFFFAOYSA-N 2 0 339.483 2.642 20 10 EFCDRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cc(C)c(C)cc1O ZINC000809737778 1282437040 /nfs/dbraw/zinc/43/70/40/1282437040.db2.gz KQEPWPJEGODYIZ-IBGZPJMESA-N 2 0 333.520 2.857 20 10 EFCDRP CCOc1ccc(CN(CC[NH+](C)C)C[C@H]2CCC[N@@H+]2CC)c(O)c1 ZINC000809738396 1282437713 /nfs/dbraw/zinc/43/77/13/1282437713.db2.gz XEMGZFMRCADSCT-GOSISDBHSA-N 2 0 349.519 2.639 20 10 EFCDRP CCOc1cccc(CN(CC[NH+](C)C)C[C@H]2CCC[N@@H+]2CC)c1O ZINC000809737047 1282437971 /nfs/dbraw/zinc/43/79/71/1282437971.db2.gz CFJNXTNMLNGSOP-GOSISDBHSA-N 2 0 349.519 2.639 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3Cc4cccc(F)c4C3)cc2)CC1 ZINC001171774453 1285779416 /nfs/dbraw/zinc/77/94/16/1285779416.db2.gz AEBYMTPRMOPVFL-SFHVURJKSA-N 2 0 339.458 2.835 20 10 EFCDRP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3ccc4ccccc4c3O)CC2)C1 ZINC000816507185 1288177218 /nfs/dbraw/zinc/17/72/18/1288177218.db2.gz YPHYBEOUVOJSCZ-IBGZPJMESA-N 2 0 339.483 2.757 20 10 EFCDRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816551126 1288199224 /nfs/dbraw/zinc/19/92/24/1288199224.db2.gz PVESJCPEUYYSBJ-SFHVURJKSA-N 2 0 328.456 2.872 20 10 EFCDRP C[NH+]1CCC(N2CC[C@@H]([NH2+]Cc3ccc4ccccc4c3O)C2)CC1 ZINC000816549657 1288199319 /nfs/dbraw/zinc/19/93/19/1288199319.db2.gz VFFJZULXTBVEGW-GOSISDBHSA-N 2 0 339.483 2.804 20 10 EFCDRP CC(C)[C@@]1(CO)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000816662282 1288234954 /nfs/dbraw/zinc/23/49/54/1288234954.db2.gz LQDZOWGIZPCPSQ-NRFANRHFSA-N 2 0 345.531 2.669 20 10 EFCDRP CC[N@H+](Cc1c2ccccc2n(C)c1C(=O)OC)C1CCN(C)CC1 ZINC001232408225 1312695482 /nfs/dbraw/zinc/69/54/82/1312695482.db2.gz YGLNARFAMPGGTE-UHFFFAOYSA-N 2 0 343.471 2.881 20 10 EFCDRP COc1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1Cn1cccn1 ZINC000873013711 1289519908 /nfs/dbraw/zinc/51/99/08/1289519908.db2.gz GJBDVLFXHSYYCP-MOPGFXCFSA-N 2 0 340.471 2.656 20 10 EFCDRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1Cn1cccn1 ZINC000873069466 1289551659 /nfs/dbraw/zinc/55/16/59/1289551659.db2.gz GCEWZUAATGRAEC-RTBURBONSA-N 2 0 342.487 2.902 20 10 EFCDRP COc1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1Cn1cccn1 ZINC000873131245 1289585862 /nfs/dbraw/zinc/58/58/62/1289585862.db2.gz QCPAFBAONCHAOO-KRWDZBQOSA-N 2 0 342.487 2.762 20 10 EFCDRP OCCCN1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000824559386 1289698298 /nfs/dbraw/zinc/69/82/98/1289698298.db2.gz RZKGEVTXAOIKJQ-HXUWFJFHSA-N 2 0 331.504 2.613 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4c3cccc4O)cc2)CC1 ZINC000824565434 1289701788 /nfs/dbraw/zinc/70/17/88/1289701788.db2.gz UYXWKMYYHKPPJE-FQEVSTJZSA-N 2 0 337.467 2.921 20 10 EFCDRP Fc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc1N1CCOCC1 ZINC000775023848 1290968988 /nfs/dbraw/zinc/96/89/88/1290968988.db2.gz MMRMYLVFEDKKDS-UHFFFAOYSA-N 2 0 347.478 2.626 20 10 EFCDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876775023 1291017902 /nfs/dbraw/zinc/01/79/02/1291017902.db2.gz MJYMOXDVQUQDFU-IBGZPJMESA-N 2 0 345.531 2.811 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000877191480 1291160853 /nfs/dbraw/zinc/16/08/53/1291160853.db2.gz WRQFJSBVANBGIP-GOSISDBHSA-N 2 0 326.440 2.557 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c(O)c1 ZINC000877191468 1291161183 /nfs/dbraw/zinc/16/11/83/1291161183.db2.gz WIJMFOKNFPXXJJ-IBGZPJMESA-N 2 0 326.440 2.557 20 10 EFCDRP CCC[C@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775174996 1291406893 /nfs/dbraw/zinc/40/68/93/1291406893.db2.gz DWDQMINPSFVPIX-HXUWFJFHSA-N 2 0 331.504 2.565 20 10 EFCDRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](Cc1ccccc1O)C2 ZINC001203551986 1312954080 /nfs/dbraw/zinc/95/40/80/1312954080.db2.gz WFABVZBLMMIZLN-ICSRJNTNSA-N 2 0 330.472 2.573 20 10 EFCDRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3cccc(OC(F)(F)F)c3O)C2)C1 ZINC001233768157 1312987388 /nfs/dbraw/zinc/98/73/88/1312987388.db2.gz KZUQFKWZXFFDOY-OAHLLOKOSA-N 2 0 330.350 2.818 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)CC1 ZINC000883289715 1293532902 /nfs/dbraw/zinc/53/29/02/1293532902.db2.gz YABUYFTYJALIFQ-UHFFFAOYSA-N 3 0 344.547 2.791 20 10 EFCDRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775647998 1293858412 /nfs/dbraw/zinc/85/84/12/1293858412.db2.gz LNHNVOQCGRIWMW-UHFFFAOYSA-N 3 0 344.547 2.743 20 10 EFCDRP CC[NH+](CC)C[C@H]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775724890 1294286893 /nfs/dbraw/zinc/28/68/93/1294286893.db2.gz OJCBFBXTJOWXPN-HXUWFJFHSA-N 2 0 344.547 2.602 20 10 EFCDRP CN(C)c1ccc(CN(CC[NH+](C)C)CC[NH+](C)C)c2ccccc21 ZINC001204241421 1313106910 /nfs/dbraw/zinc/10/69/10/1313106910.db2.gz GSNPMLGPXKLTOR-UHFFFAOYSA-N 2 0 342.531 2.831 20 10 EFCDRP C[C@H]([NH2+]C[C@@H](O)CN(C)Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000775830926 1294920265 /nfs/dbraw/zinc/92/02/65/1294920265.db2.gz NKJRLJWYUHPATJ-LAUBAEHRSA-N 2 0 341.499 2.896 20 10 EFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3c(O)ccc4ccc(OC)cc43)C[C@@H]2C1 ZINC001234570276 1313160189 /nfs/dbraw/zinc/16/01/89/1313160189.db2.gz XUHXWAXYTVGMTP-HOTGVXAUSA-N 2 0 326.440 2.938 20 10 EFCDRP OCC1CCN(c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)CC1 ZINC000305300258 1296078750 /nfs/dbraw/zinc/07/87/50/1296078750.db2.gz HKRVFBYVUVYWTR-CTNGQTDRSA-N 2 0 343.515 2.612 20 10 EFCDRP c1c(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc2c3c1CCCN3CCC2 ZINC001235104441 1313242959 /nfs/dbraw/zinc/24/29/59/1313242959.db2.gz REVFXUAITWEWAG-UHFFFAOYSA-N 2 0 325.500 2.961 20 10 EFCDRP C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001205164747 1313244206 /nfs/dbraw/zinc/24/42/06/1313244206.db2.gz RUYPICZKAJJDMY-INIZCTEOSA-N 2 0 337.467 2.921 20 10 EFCDRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205280966 1313263742 /nfs/dbraw/zinc/26/37/42/1313263742.db2.gz NDIZNHUEKKSESK-SFHVURJKSA-N 2 0 337.895 2.880 20 10 EFCDRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2c(O)cccc2Br)CC1 ZINC001205560072 1313313511 /nfs/dbraw/zinc/31/35/11/1313313511.db2.gz ZCFAKTXUGZVUNQ-AWEZNQCLSA-N 2 0 331.229 2.808 20 10 EFCDRP Cc1cc(O)c(C[N@H+](C)CC2CC[NH2+]CC2)cc1Br ZINC001235432600 1313319617 /nfs/dbraw/zinc/31/96/17/1313319617.db2.gz NBXLIWNYNTYVGE-UHFFFAOYSA-N 2 0 327.266 2.895 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)CC[C@H]1C[NH3+] ZINC001205626713 1313325590 /nfs/dbraw/zinc/32/55/90/1313325590.db2.gz IJOGNDCUEKQBAN-NEPJUHHUSA-N 2 0 327.266 2.962 20 10 EFCDRP Nc1ccc(CN2C[C@@H]3C[N@H+](CC4CCCC4)CCO[C@@H]3C2)cc1 ZINC001235636258 1313364614 /nfs/dbraw/zinc/36/46/14/1313364614.db2.gz OGSCOCOCFFGZII-AZUAARDMSA-N 2 0 329.488 2.592 20 10 EFCDRP C[NH+]1CCN(C2CC[NH+](Cc3ccc(C(C)(C)C)cc3O)CC2)CC1 ZINC001235684723 1313374547 /nfs/dbraw/zinc/37/45/47/1313374547.db2.gz ITAHSUDFJNTPNR-UHFFFAOYSA-N 2 0 345.531 2.902 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CCC[C@@H]1C[NH3+] ZINC001205991404 1313387506 /nfs/dbraw/zinc/38/75/06/1313387506.db2.gz AOJALUVMGXOSMN-NVXWUHKLSA-N 2 0 343.515 2.898 20 10 EFCDRP Cc1ccc(CC[N@@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2O)cc1 ZINC001235839882 1313407404 /nfs/dbraw/zinc/40/74/04/1313407404.db2.gz BWFMCBMWWVJDID-UHFFFAOYSA-N 2 0 339.483 2.785 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC001235865466 1313412613 /nfs/dbraw/zinc/41/26/13/1313412613.db2.gz DTDVVVKJQWCGLW-APWZRJJASA-N 2 0 329.488 2.956 20 10 EFCDRP [NH3+][C@@H]1CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC[C@H]1F ZINC001206201063 1313419626 /nfs/dbraw/zinc/41/96/26/1313419626.db2.gz VKVMRRWRGPATNI-CHWSQXEVSA-N 2 0 336.329 2.595 20 10 EFCDRP [NH3+][C@@H]1CC[N@H+](Cc2ccc(OCC(F)(F)F)cc2O)CC[C@@H]1F ZINC001206201068 1313420316 /nfs/dbraw/zinc/42/03/16/1313420316.db2.gz VKVMRRWRGPATNI-QWHCGFSZSA-N 2 0 336.329 2.595 20 10 EFCDRP Cc1cc(F)cc(C[N@@H+]2C[C@H]3C[NH2+]C[C@@]3(c3ccccc3)C2)c1O ZINC001236011145 1313431734 /nfs/dbraw/zinc/43/17/34/1313431734.db2.gz STXFBBJRBPJSSA-XLIONFOSSA-N 2 0 326.415 2.813 20 10 EFCDRP CN(C)c1ccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001236190895 1313454300 /nfs/dbraw/zinc/45/43/00/1313454300.db2.gz ZSFSORCBIXDANQ-UHFFFAOYSA-N 2 0 338.499 2.794 20 10 EFCDRP C[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@H]1CCCC[C@H]1[NH3+] ZINC001236216883 1313457109 /nfs/dbraw/zinc/45/71/09/1313457109.db2.gz LVWDKMYYUFAVEI-MSOLQXFVSA-N 2 0 329.488 2.793 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001236308668 1313467694 /nfs/dbraw/zinc/46/76/94/1313467694.db2.gz WFIBFANRGZIYHL-IAGOWNOFSA-N 2 0 329.488 2.814 20 10 EFCDRP C[N@H+](Cc1c(O)ccc2cc(Br)ccc21)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001236411001 1313477110 /nfs/dbraw/zinc/47/71/10/1313477110.db2.gz DUNOXUXMWIOQJY-HALDLXJZSA-N 2 0 347.256 2.958 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CC3CC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001236434437 1313480877 /nfs/dbraw/zinc/48/08/77/1313480877.db2.gz TXVFXRUQKCYMMV-UHFFFAOYSA-N 2 0 343.515 2.987 20 10 EFCDRP CC(C)(C)C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)C1CC[NH2+]CC1 ZINC001236456683 1313482564 /nfs/dbraw/zinc/48/25/64/1313482564.db2.gz DQOAOSSAJJIMCP-UHFFFAOYSA-N 3 0 344.547 2.696 20 10 EFCDRP CN(CCC[NH+]1CCCC1)Cc1cc(O)c(Br)cc1O ZINC001236775501 1313527055 /nfs/dbraw/zinc/52/70/55/1313527055.db2.gz NBNODCWZEXNIIZ-UHFFFAOYSA-N 2 0 343.265 2.778 20 10 EFCDRP CC[NH+](CC)CCCN1CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001236810384 1313534524 /nfs/dbraw/zinc/53/45/24/1313534524.db2.gz FGAXANWYENZPRU-UHFFFAOYSA-N 2 0 349.519 2.559 20 10 EFCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](CC)CC2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236834925 1313538316 /nfs/dbraw/zinc/53/83/16/1313538316.db2.gz KQHXJNMDBZHCNG-HXUWFJFHSA-N 3 0 344.547 2.650 20 10 EFCDRP CCC[N@@H+](Cc1ccc(N2CC[NH+](CC)CC2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236834923 1313538750 /nfs/dbraw/zinc/53/87/50/1313538750.db2.gz KQHXJNMDBZHCNG-FQEVSTJZSA-N 3 0 344.547 2.650 20 10 EFCDRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)CC1 ZINC001236847007 1313541366 /nfs/dbraw/zinc/54/13/66/1313541366.db2.gz GUSORSHZRCTIKU-UHFFFAOYSA-N 3 0 344.547 2.793 20 10 EFCDRP Cc1c(CN(CC[NH+](C)C)[C@H]2CCC[NH2+]C2)c2ccccc2n1C ZINC001236922191 1313553823 /nfs/dbraw/zinc/55/38/23/1313553823.db2.gz FBXNHKBDUIURMC-KRWDZBQOSA-N 2 0 328.504 2.602 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC[C@@]1(C)O ZINC001236932439 1313556064 /nfs/dbraw/zinc/55/60/64/1313556064.db2.gz OSMPFZAHXBCEIH-OXQOHEQNSA-N 2 0 349.494 2.560 20 10 EFCDRP C[NH+](C)CCN(Cc1cc2ccccc2cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236933522 1313556441 /nfs/dbraw/zinc/55/64/41/1313556441.db2.gz UKKHFFLUTLRQOI-LJQANCHMSA-N 2 0 327.472 2.661 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(Cl)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236932965 1313556473 /nfs/dbraw/zinc/55/64/73/1313556473.db2.gz PZRPIKMCUCPHHU-CYBMUJFWSA-N 2 0 346.302 2.815 20 10 EFCDRP CCN(Cc1cccnc1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236934123 1313556883 /nfs/dbraw/zinc/55/68/83/1313556883.db2.gz CZBDSJBGTVLFSD-UHFFFAOYSA-N 2 0 342.462 2.995 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CCC[C@]1(C)O ZINC001236937201 1313557571 /nfs/dbraw/zinc/55/75/71/1313557571.db2.gz XJUBZLGNNPBBQL-UZLBHIALSA-N 2 0 349.494 2.560 20 10 EFCDRP COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236941779 1313558146 /nfs/dbraw/zinc/55/81/46/1313558146.db2.gz FKFZGXWUENOGPW-DFNIBXOVSA-N 2 0 347.478 2.719 20 10 EFCDRP CC(C)O[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236941594 1313558208 /nfs/dbraw/zinc/55/82/08/1313558208.db2.gz CXURQOUSIWICMS-SFHVURJKSA-N 2 0 335.467 2.577 20 10 EFCDRP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1ccc(C(C)C)cc1O ZINC001237054343 1313578255 /nfs/dbraw/zinc/57/82/55/1313578255.db2.gz WHOCKSSFVWZGRE-UHFFFAOYSA-N 2 0 336.476 2.832 20 10 EFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(OCC(F)(F)F)cc3O)C[C@H]2C1 ZINC001237062038 1313579456 /nfs/dbraw/zinc/57/94/56/1313579456.db2.gz JAVPKSKPWYENKX-ZIAGYGMSSA-N 2 0 344.377 2.717 20 10 EFCDRP C[C@H]1C(=O)CC[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)C12CCCC2 ZINC001237190182 1313602427 /nfs/dbraw/zinc/60/24/27/1313602427.db2.gz DEHWAMOOXLMFOP-KRWDZBQOSA-N 2 0 341.499 2.820 20 10 EFCDRP [NH3+]CCCCC[NH+]1CCN(c2ccc(OC(F)(F)F)cc2)CC1 ZINC001237206064 1313606128 /nfs/dbraw/zinc/60/61/28/1313606128.db2.gz PURFZPNZJGTDAL-UHFFFAOYSA-N 2 0 331.382 2.836 20 10 EFCDRP Oc1c(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cccc1OC(F)(F)F ZINC001237415861 1313641695 /nfs/dbraw/zinc/64/16/95/1313641695.db2.gz OQRYHHSKABTVNP-YPMHNXCESA-N 2 0 330.350 2.865 20 10 EFCDRP Cc1cc(Cl)cc(C[NH+]2CCC3(CC(N(C)C)=NO3)CC2)c1O ZINC001237685558 1313691852 /nfs/dbraw/zinc/69/18/52/1313691852.db2.gz NJMVUDVLXWTGDI-UHFFFAOYSA-N 2 0 337.851 2.984 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CCC3CC[NH+](C)CC3)CC2)cc1 ZINC001207489268 1313698989 /nfs/dbraw/zinc/69/89/89/1313698989.db2.gz XNZTWWSPYMEUQC-UHFFFAOYSA-N 2 0 331.504 2.939 20 10 EFCDRP [O-]c1c(F)cccc1C[N@H+]1C[C@@H]2CC[NH+](Cc3cn[nH]c3)CC[C@@H]2C1 ZINC001276538110 1313705929 /nfs/dbraw/zinc/70/59/29/1313705929.db2.gz SZKOVXHHVMOGQI-IYBDPMFKSA-N 2 0 344.434 2.598 20 10 EFCDRP Cc1cc(F)cc(CN(CCC[NH+](C)C)CCC[NH+](C)C)c1O ZINC001238062453 1313753660 /nfs/dbraw/zinc/75/36/60/1313753660.db2.gz QDBZGMMHTXNQRK-UHFFFAOYSA-N 2 0 325.472 2.545 20 10 EFCDRP Cc1cccc(CCC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC000796448791 1301638245 /nfs/dbraw/zinc/63/82/45/1301638245.db2.gz MQUFXFGAPUNSJW-UHFFFAOYSA-N 2 0 338.499 2.864 20 10 EFCDRP CCOc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645891 1302668027 /nfs/dbraw/zinc/66/80/27/1302668027.db2.gz DQKGBCIBOOSDBZ-QWHCGFSZSA-N 2 0 332.366 2.750 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001222400758 1311125277 /nfs/dbraw/zinc/12/52/77/1311125277.db2.gz GVRHURWBHGYNSC-UHFFFAOYSA-N 2 0 329.488 2.958 20 10 EFCDRP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]([NH3+])CCCC[NH2+]C(C)C ZINC001161134504 1311866690 /nfs/dbraw/zinc/86/66/90/1311866690.db2.gz AKWWHEAGBZRIBH-IBGZPJMESA-N 2 0 348.535 2.597 20 10 EFCDRP CC[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@H](CC)[NH2+]1 ZINC001246186065 1314595201 /nfs/dbraw/zinc/59/52/01/1314595201.db2.gz WQYQPCBQYDCMOU-PMOLBWCYSA-N 3 0 344.547 2.837 20 10 EFCDRP FC(F)(F)Oc1ccc(N2CCN([C@@H]3CCC[NH2+]CC3)CC2)cc1 ZINC001246993662 1314726861 /nfs/dbraw/zinc/72/68/61/1314726861.db2.gz IJJPYYLCERZKFV-CQSZACIVSA-N 2 0 343.393 2.849 20 10 EFCDRP C[C@]([NH3+])(CCCC[NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217755032 1315110223 /nfs/dbraw/zinc/11/02/23/1315110223.db2.gz BGIMRLHZGQBIMJ-SFHVURJKSA-N 2 0 325.416 2.830 20 10 EFCDRP CC[NH+](CC)C[C@@H](O)C[NH2+][C@@H]1c2c(c(C)cc(C)c2O)CC1(C)C ZINC001253216584 1315582526 /nfs/dbraw/zinc/58/25/26/1315582526.db2.gz OCFUZMFTUQWPGL-HNAYVOBHSA-N 2 0 334.504 2.925 20 10 EFCDRP CC(C)[NH+]1CCC(NC2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001257212315 1316047095 /nfs/dbraw/zinc/04/70/95/1316047095.db2.gz ZEYUGEDHQMVEPB-UHFFFAOYSA-N 2 0 331.504 2.819 20 10 EFCDRP CN1CCN(c2ccc(C[N@H+](C[C@H]3CCOC3)C3CC3)cc2F)CC1 ZINC001319798863 1328993174 /nfs/dbraw/zinc/99/31/74/1328993174.db2.gz OVKZRBHYSMLACX-QGZVFWFLSA-N 2 0 347.478 2.578 20 10 EFCDRP CN1CCN(c2ccc(CN3CCOCC34CCCC4)cc2F)CC1 ZINC001324752752 1329655783 /nfs/dbraw/zinc/65/57/83/1329655783.db2.gz ROUDQDJOFKHIMP-UHFFFAOYSA-N 2 0 347.478 2.723 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001325338983 1329681134 /nfs/dbraw/zinc/68/11/34/1329681134.db2.gz FTHTXUNJNNYSPB-DLBZAZTESA-N 2 0 331.504 2.866 20 10 EFCDRP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1c(O)cccc1Br ZINC001348089192 1332799066 /nfs/dbraw/zinc/79/90/66/1332799066.db2.gz FZHZZSZYMHONGB-GFCCVEGCSA-N 2 0 345.281 2.601 20 10 EFCDRP COc1ccc(N2CCC([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000161613770 716077288 /nfs/dbraw/zinc/07/72/88/716077288.db2.gz RGVIBFFSFLIBKC-PKOBYXMFSA-N 2 0 329.488 2.880 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c(O)c1OC ZINC000894479411 722752095 /nfs/dbraw/zinc/75/20/95/722752095.db2.gz PFOQVYSQBNQMSW-HNNXBMFYSA-N 2 0 334.460 2.573 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000121177168 723131984 /nfs/dbraw/zinc/13/19/84/723131984.db2.gz BFBCRVDMCYEGHR-MSOLQXFVSA-N 2 0 332.536 2.677 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cnc4ccccc4n3)cc2)CC1 ZINC000895607556 724221702 /nfs/dbraw/zinc/22/17/02/724221702.db2.gz PFKSNUVPEDRGAB-UHFFFAOYSA-N 2 0 347.466 2.671 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1)C1CC[NH+](C)CC1 ZINC000151550215 725644534 /nfs/dbraw/zinc/64/45/34/725644534.db2.gz JLWRZJLWUISIFE-OAHLLOKOSA-N 2 0 349.494 2.607 20 10 EFCDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000158257225 728326525 /nfs/dbraw/zinc/32/65/25/728326525.db2.gz JCZMEXBCGTYKEH-HZPDHXFCSA-N 2 0 335.467 2.655 20 10 EFCDRP C[C@@H]([NH2+]CCCC1CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1 ZINC001576243338 1089038963 /nfs/dbraw/zinc/03/89/63/1089038963.db2.gz AOGUYMPTONEDMB-QGZVFWFLSA-N 2 0 331.504 2.954 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@H](C)[NH3+])C3)cc2)CC1 ZINC001578941090 1090484274 /nfs/dbraw/zinc/48/42/74/1090484274.db2.gz ODJGYOWWGJGRLS-WMZOPIPTSA-N 2 0 331.504 2.861 20 10 EFCDRP COC1CCN(c2ccc(C[N@@H+]3CCC[C@H]([C@@H](C)[NH3+])C3)cc2)CC1 ZINC001578941084 1090484294 /nfs/dbraw/zinc/48/42/94/1090484294.db2.gz ODJGYOWWGJGRLS-AEFFLSMTSA-N 2 0 331.504 2.861 20 10 EFCDRP [NH3+]C[C@H]1CC[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC001580258738 1090836918 /nfs/dbraw/zinc/83/69/18/1090836918.db2.gz WNPWIYQLNIBVJU-ZFWWWQNUSA-N 2 0 339.430 2.974 20 10 EFCDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC001580258736 1090837181 /nfs/dbraw/zinc/83/71/81/1090837181.db2.gz WNPWIYQLNIBVJU-HIFRSBDPSA-N 2 0 339.430 2.974 20 10 EFCDRP C[NH+]1CCN(c2ccc(CNc3cccc4c3CC[C@@H]4[NH3+])cc2)CC1 ZINC001167436949 1101712793 /nfs/dbraw/zinc/71/27/93/1101712793.db2.gz IHQAYFTYAGEBPL-FQEVSTJZSA-N 2 0 336.483 2.997 20 10 EFCDRP Cc1cccc([C@@H](O)C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000905428469 1103188079 /nfs/dbraw/zinc/18/80/79/1103188079.db2.gz UKOXTUGAZOBHIR-NRFANRHFSA-N 2 0 339.483 2.570 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])c1O ZINC000841031487 1105940724 /nfs/dbraw/zinc/94/07/24/1105940724.db2.gz SOEGMBBYBAMGAE-GXFFZTMASA-N 2 0 343.265 2.770 20 10 EFCDRP COC(=O)C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000897888439 1106132251 /nfs/dbraw/zinc/13/22/51/1106132251.db2.gz BBTDDISPINOHKL-GOSISDBHSA-N 2 0 347.503 2.506 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)[NH+](C)C)cc1 ZINC000898450138 1108943682 /nfs/dbraw/zinc/94/36/82/1108943682.db2.gz OGYWDEGGMCDWRT-SXLOBPIMSA-N 2 0 330.520 2.572 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC(C3C[NH2+]C3)CC2)cc1Br ZINC001235338090 1111739149 /nfs/dbraw/zinc/73/91/49/1111739149.db2.gz AZFPRCPCXGIZCJ-UHFFFAOYSA-N 2 0 339.277 2.895 20 10 EFCDRP Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)CC2 ZINC000296490613 241087563 /nfs/dbraw/zinc/08/75/63/241087563.db2.gz POHIGHPVPFTFBH-MOPGFXCFSA-N 2 0 338.451 2.736 20 10 EFCDRP C[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000363785107 299423931 /nfs/dbraw/zinc/42/39/31/299423931.db2.gz ODPZJTBSYYSEKJ-WMZOPIPTSA-N 2 0 330.520 2.572 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCCN2CC[NH+](CC)CC2)cc1 ZINC000154242772 284372245 /nfs/dbraw/zinc/37/22/45/284372245.db2.gz PVOSLPYLUKDPIN-GOSISDBHSA-N 2 0 332.536 2.821 20 10 EFCDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c1 ZINC000184968449 473286328 /nfs/dbraw/zinc/28/63/28/473286328.db2.gz OPZUKHJBKZLHTB-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cnn(C)c3)cc2F)CC1 ZINC000155285562 472528567 /nfs/dbraw/zinc/52/85/67/472528567.db2.gz MFQDZTGAMGHFGX-HNNXBMFYSA-N 2 0 345.466 2.552 20 10 EFCDRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)N1CC[NH+](C)CC1 ZINC000132370967 472729406 /nfs/dbraw/zinc/72/94/06/472729406.db2.gz JYEZUULOSHHJKG-FXAWDEMLSA-N 2 0 332.536 2.675 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1 ZINC000092665909 472957245 /nfs/dbraw/zinc/95/72/45/472957245.db2.gz WNPOQFAFMAJBRF-ROUUACIJSA-N 2 0 331.504 2.691 20 10 EFCDRP C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)CN1CC[NH+](C)CC1 ZINC000185344213 473399889 /nfs/dbraw/zinc/39/98/89/473399889.db2.gz DJXJXAFNGUUZPE-IRXDYDNUSA-N 2 0 345.531 2.805 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185344976 473401027 /nfs/dbraw/zinc/40/10/27/473401027.db2.gz CZLMUFGOVUOHET-HUUCEWRRSA-N 2 0 339.911 2.970 20 10 EFCDRP C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)N1CC[NH+](C)CC1 ZINC000185365599 473406447 /nfs/dbraw/zinc/40/64/47/473406447.db2.gz ZRRYAPXZALVFHK-CVEARBPZSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)ccc1O ZINC000186197645 473614233 /nfs/dbraw/zinc/61/42/33/473614233.db2.gz GVUCYLOYYIFGPL-CYBMUJFWSA-N 2 0 333.407 2.718 20 10 EFCDRP CC[C@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000186580135 473693377 /nfs/dbraw/zinc/69/33/77/473693377.db2.gz BIQHTTMZIILWRG-XLIONFOSSA-N 2 0 332.536 2.819 20 10 EFCDRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3cc(Cl)cc(C)c3O)C2)CC1 ZINC000180069505 473790381 /nfs/dbraw/zinc/79/03/81/473790381.db2.gz COFSVPPOWABZII-QGZVFWFLSA-N 2 0 337.895 2.566 20 10 EFCDRP CC[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000282180254 473972490 /nfs/dbraw/zinc/97/24/90/473972490.db2.gz FPMWFBNXKIWOTJ-LJQANCHMSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 ZINC000264930133 474161051 /nfs/dbraw/zinc/16/10/51/474161051.db2.gz AHCBOJFDNPFANG-HZPDHXFCSA-N 2 0 337.483 2.871 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000271226045 474451975 /nfs/dbraw/zinc/45/19/75/474451975.db2.gz REAIDASZWOJJFA-UHFFFAOYSA-N 2 0 331.504 2.691 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(N(C)C)cc1 ZINC000271508860 474575515 /nfs/dbraw/zinc/57/55/15/474575515.db2.gz NLRXMFDDQMUSDX-BEVDRBHNSA-N 2 0 331.504 2.781 20 10 EFCDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000271873204 474596830 /nfs/dbraw/zinc/59/68/30/474596830.db2.gz NGHFCJDDTWBZPV-OAHLLOKOSA-N 2 0 333.451 2.575 20 10 EFCDRP Cc1cccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)c1O ZINC000271887668 474598075 /nfs/dbraw/zinc/59/80/75/474598075.db2.gz WIHOVDXGLNGVSN-UHFFFAOYSA-N 2 0 331.504 2.691 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273563858 474964625 /nfs/dbraw/zinc/96/46/25/474964625.db2.gz IXVIIHVLBBVLGH-CRAIPNDOSA-N 2 0 333.520 2.933 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H](C)O[C@@H]3C)cc2F)CC1 ZINC000295270900 475117657 /nfs/dbraw/zinc/11/76/57/475117657.db2.gz VPRUCSUTAPJSDU-HDMKZQKVSA-N 2 0 335.467 2.623 20 10 EFCDRP Cc1cccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c1O ZINC000375244014 476735100 /nfs/dbraw/zinc/73/51/00/476735100.db2.gz CPVDNZOSUHZSNV-UHFFFAOYSA-N 2 0 331.504 2.550 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000247099253 535765220 /nfs/dbraw/zinc/76/52/20/535765220.db2.gz SGLXRGCLDJDWKG-ROUUACIJSA-N 2 0 332.536 2.677 20 10 EFCDRP c1cc(N2CCSCC2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000754784660 575489558 /nfs/dbraw/zinc/48/95/58/575489558.db2.gz IGVRKYDCUPIOFP-MJGOQNOKSA-N 2 0 331.529 2.956 20 10 EFCDRP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000756399112 575730757 /nfs/dbraw/zinc/73/07/57/575730757.db2.gz MLIDQUBFNXSABH-CYBMUJFWSA-N 2 0 325.884 2.722 20 10 EFCDRP C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)CN1CC[NH+](C)CC1 ZINC000756534140 575756663 /nfs/dbraw/zinc/75/66/63/575756663.db2.gz KUGHIKLINLCSOJ-FMKPAKJESA-N 2 0 335.467 2.553 20 10 EFCDRP C[C@H]1C[C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756636515 575771581 /nfs/dbraw/zinc/77/15/81/575771581.db2.gz DYDVAPBUUHRDFH-XJKSGUPXSA-N 2 0 335.467 2.695 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1C ZINC000769471342 577364984 /nfs/dbraw/zinc/36/49/84/577364984.db2.gz SSAQJWCBMNXSNK-YLJYHZDGSA-N 2 0 331.504 2.828 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CC[C@@H](OCC[NH+](CC)CC)C2)c(O)c1 ZINC000769514298 577368790 /nfs/dbraw/zinc/36/87/90/577368790.db2.gz IXTVYNQITKNXOW-GOSISDBHSA-N 2 0 336.476 2.724 20 10 EFCDRP CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](OCC[NH+](CC)CC)C2)c1 ZINC000769514382 577368908 /nfs/dbraw/zinc/36/89/08/577368908.db2.gz KIWDEONYDWFLBZ-GOSISDBHSA-N 2 0 336.476 2.724 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CCSC(F)(F)F)cc2)CC1 ZINC000771823492 581247622 /nfs/dbraw/zinc/24/76/22/581247622.db2.gz FLAAESHXZBVQDU-UHFFFAOYSA-N 2 0 333.423 2.781 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)cc2)CC1 ZINC000771823333 581247653 /nfs/dbraw/zinc/24/76/53/581247653.db2.gz LKIKQHVHMKQOGN-UHFFFAOYSA-N 3 0 344.547 2.837 20 10 EFCDRP C[C@H](CC1CCOCC1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000771842607 581249576 /nfs/dbraw/zinc/24/95/76/581249576.db2.gz JHYBCAATGWRBEI-QGZVFWFLSA-N 2 0 331.504 2.733 20 10 EFCDRP COc1cc(C[NH2+]C[C@H]2CN3CCC[C@H]3CO2)c(O)c(C(C)(C)C)c1 ZINC000850118476 1250292392 /nfs/dbraw/zinc/29/23/92/1250292392.db2.gz HJKLAUKOETVIMP-RDJZCZTQSA-N 2 0 348.487 2.651 20 10 EFCDRP Oc1ccc(Br)cc1C[N@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236314189 1252074781 /nfs/dbraw/zinc/07/47/81/1252074781.db2.gz JTVMMCFEUGMRQA-TXEJJXNPSA-N 2 0 325.250 2.586 20 10 EFCDRP C[NH+]1CCC(N2CCC([NH2+]Cc3ccc4c(c3)CCCO4)CC2)CC1 ZINC000921629359 1257854098 /nfs/dbraw/zinc/85/40/98/1257854098.db2.gz UUFSNMRPNWLXFK-UHFFFAOYSA-N 2 0 343.515 2.660 20 10 EFCDRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000186582397 1266786803 /nfs/dbraw/zinc/78/68/03/1266786803.db2.gz SOZAPVSEXPVEMC-SJORKVTESA-N 2 0 345.531 2.948 20 10 EFCDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000824914330 1278340172 /nfs/dbraw/zinc/34/01/72/1278340172.db2.gz PKWHJDAEKIHEAD-UHFFFAOYSA-N 2 0 337.483 2.872 20 10 EFCDRP Cc1cc(O)c(C[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000825283138 1278492864 /nfs/dbraw/zinc/49/28/64/1278492864.db2.gz GDMZICZEMCALGP-HNNXBMFYSA-N 2 0 326.868 2.681 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000691447767 1274087847 /nfs/dbraw/zinc/08/78/47/1274087847.db2.gz VSRLAACTPQQDBX-UONOGXRCSA-N 2 0 325.250 2.871 20 10 EFCDRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000691455338 1274132260 /nfs/dbraw/zinc/13/22/60/1274132260.db2.gz NYUYSIISXSKLDZ-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3C[NH3+])cc2F)C[C@H](C)O1 ZINC000817890437 1276347668 /nfs/dbraw/zinc/34/76/68/1276347668.db2.gz XPGMJPLSVXLNBM-CXHZTBPHSA-N 2 0 335.467 2.656 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2F)C[C@@H](C)O1 ZINC000817890528 1276348458 /nfs/dbraw/zinc/34/84/58/1276348458.db2.gz ZQIICYNUKYWUGL-SUQXETJPSA-N 2 0 347.478 2.812 20 10 EFCDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817893105 1276363244 /nfs/dbraw/zinc/36/32/44/1276363244.db2.gz DRBPIJRAJIBCHD-ICSRJNTNSA-N 2 0 331.504 2.502 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000817894738 1276363477 /nfs/dbraw/zinc/36/34/77/1276363477.db2.gz NQWDIAQCYJSQEY-PWRODBHTSA-N 2 0 343.515 2.924 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000817894919 1276364837 /nfs/dbraw/zinc/36/48/37/1276364837.db2.gz OXGCZCRYQAYMGA-VAMGGRTRSA-N 2 0 329.488 2.534 20 10 EFCDRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817896153 1276365030 /nfs/dbraw/zinc/36/50/30/1276365030.db2.gz YRJLAHLGTOIIEJ-WOJBJXKFSA-N 2 0 331.504 2.645 20 10 EFCDRP CC[C@@H](NCc1ccc(N2CC[NH+](CC)CC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817902406 1276367763 /nfs/dbraw/zinc/36/77/63/1276367763.db2.gz PWNWWOQWNVEKOG-MOPGFXCFSA-N 2 0 348.510 2.588 20 10 EFCDRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817940486 1276385523 /nfs/dbraw/zinc/38/55/23/1276385523.db2.gz IDEYBGKNETVALP-CQSZACIVSA-N 2 0 337.895 2.827 20 10 EFCDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817964401 1276403385 /nfs/dbraw/zinc/40/33/85/1276403385.db2.gz BJLAGODMRAKIEG-BEFAXECRSA-N 2 0 335.467 2.703 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000817976928 1276416263 /nfs/dbraw/zinc/41/62/63/1276416263.db2.gz XDEQEMRTHFGREJ-HZMBPMFUSA-N 2 0 325.250 2.947 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCOCC2)cc1Cl ZINC000817976840 1276416845 /nfs/dbraw/zinc/41/68/45/1276416845.db2.gz VKQWKJBQJXLLRN-RDTXWAMCSA-N 2 0 349.906 2.969 20 10 EFCDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817987452 1276428092 /nfs/dbraw/zinc/42/80/92/1276428092.db2.gz ZLPBXLGGNZKYCT-NVXWUHKLSA-N 2 0 347.478 2.988 20 10 EFCDRP COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)C3CC[NH+](C)CC3)C2)cc1 ZINC000818345279 1276510894 /nfs/dbraw/zinc/51/08/94/1276510894.db2.gz SWBVKJAOFVSCND-SJORKVTESA-N 2 0 331.504 2.841 20 10 EFCDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc(N3CCOCC3)c(F)c1)CC[NH2+]CC2 ZINC000818431316 1276522116 /nfs/dbraw/zinc/52/21/16/1276522116.db2.gz IXPRMZYGFWKFFS-MRXNPFEDSA-N 2 0 347.478 2.626 20 10 EFCDRP Cc1cc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@@H](C)C2)ccc1N(C)C ZINC000815078040 1287302065 /nfs/dbraw/zinc/30/20/65/1287302065.db2.gz LZPUSWSABYUTGG-GHTZIAJQSA-N 2 0 344.547 2.519 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](C(C)(C)C)C3)cc2)CC1 ZINC000790930884 1277853298 /nfs/dbraw/zinc/85/32/98/1277853298.db2.gz JXAZTSNVYINCEZ-LJQANCHMSA-N 2 0 331.504 2.685 20 10 EFCDRP CC(C)(C[NH2+]Cc1ccc(N2CCOCC2)cc1)C[NH+]1CCCC1 ZINC000791010073 1277906256 /nfs/dbraw/zinc/90/62/56/1277906256.db2.gz CVKYZMSZPRNYSN-UHFFFAOYSA-N 2 0 331.504 2.735 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)cc1F ZINC000844902229 1279325258 /nfs/dbraw/zinc/32/52/58/1279325258.db2.gz MDVVQSBKIUVQOV-BXWFABGCSA-N 2 0 335.467 2.610 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000844902457 1279325445 /nfs/dbraw/zinc/32/54/45/1279325445.db2.gz MYINEGWICGNXKF-NSHGMRRFSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000844902456 1279325746 /nfs/dbraw/zinc/32/57/46/1279325746.db2.gz MYINEGWICGNXKF-NLWGTHIKSA-N 2 0 331.504 2.779 20 10 EFCDRP CO[C@@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000793339880 1279559185 /nfs/dbraw/zinc/55/91/85/1279559185.db2.gz NMMXPZMNTCPENX-FQEVSTJZSA-N 2 0 331.504 2.829 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c1O ZINC000846155526 1280040756 /nfs/dbraw/zinc/04/07/56/1280040756.db2.gz HACBROKJOJPOSD-BMGDILEWSA-N 2 0 348.487 2.819 20 10 EFCDRP COc1ccc(C[NH2+][C@H](C)C[C@H](C)NC(=O)C[N@H+](C)C(C)C)cc1C ZINC001146600034 1280947244 /nfs/dbraw/zinc/94/72/44/1280947244.db2.gz DSUSHHMOUBVLAQ-SJORKVTESA-N 2 0 349.519 2.717 20 10 EFCDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000872250767 1287502659 /nfs/dbraw/zinc/50/26/59/1287502659.db2.gz ATNIVYFTBIKYJV-MRXNPFEDSA-N 2 0 335.467 2.530 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)N2CC[NH+](C)CC2)c1O ZINC000808690919 1281846964 /nfs/dbraw/zinc/84/69/64/1281846964.db2.gz GZHMBLUDVLXDHT-KBPBESRZSA-N 2 0 325.884 2.641 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693304 1281847561 /nfs/dbraw/zinc/84/75/61/1281847561.db2.gz YOBCQLBAFBGGBQ-ZFWWWQNUSA-N 2 0 339.911 2.888 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+]CCCN2CC[NH+](C)CC2)c1O ZINC000808672981 1281857766 /nfs/dbraw/zinc/85/77/66/1281857766.db2.gz IYVIDCJUGBVMPN-AWEZNQCLSA-N 2 0 325.884 2.642 20 10 EFCDRP C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809700359 1282384010 /nfs/dbraw/zinc/38/40/10/1282384010.db2.gz FBCIMHLYMZATRW-WIYYLYMNSA-N 2 0 345.531 2.954 20 10 EFCDRP C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809700356 1282384209 /nfs/dbraw/zinc/38/42/09/1282384209.db2.gz FBCIMHLYMZATRW-GHTZIAJQSA-N 2 0 345.531 2.954 20 10 EFCDRP CCOc1cccc(CN(CC[NH+](C)C)C[C@@H]2CCC[N@@H+]2CC)c1O ZINC000809737049 1282437568 /nfs/dbraw/zinc/43/75/68/1282437568.db2.gz CFJNXTNMLNGSOP-SFHVURJKSA-N 2 0 349.519 2.639 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC[C@H](O)c3ccccc3)cc2)CC1 ZINC000809748184 1282446265 /nfs/dbraw/zinc/44/62/65/1282446265.db2.gz KUFVIKKWJCZECU-NRFANRHFSA-N 2 0 339.483 2.652 20 10 EFCDRP CC[NH+](CC)CCC[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809749287 1282449139 /nfs/dbraw/zinc/44/91/39/1282449139.db2.gz MDWMGYHOBTVISK-UHFFFAOYSA-N 3 0 346.563 2.992 20 10 EFCDRP Cc1cc(C)c([C@@H](C)[NH2+]CC2CC[NH+](CCN(C)C)CC2)c(O)c1 ZINC000815575933 1287608210 /nfs/dbraw/zinc/60/82/10/1287608210.db2.gz FGRYVOUVXDORJV-QGZVFWFLSA-N 2 0 333.520 2.933 20 10 EFCDRP CC[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810219987 1283048103 /nfs/dbraw/zinc/04/81/03/1283048103.db2.gz NXMAGYRTSOJWDI-CQSZACIVSA-N 2 0 346.393 2.908 20 10 EFCDRP CC[C@H]([NH2+]C[C@]1(O)CCN(C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810238079 1283089044 /nfs/dbraw/zinc/08/90/44/1283089044.db2.gz XXWIKPGSKCWGED-DZGCQCFKSA-N 2 0 332.366 2.518 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)cc2)CC1 ZINC000814178592 1286360500 /nfs/dbraw/zinc/36/05/00/1286360500.db2.gz WJBPRKJCILUOBY-FQEVSTJZSA-N 2 0 343.515 2.687 20 10 EFCDRP COc1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1Cn1cccn1 ZINC000873069462 1289551636 /nfs/dbraw/zinc/55/16/36/1289551636.db2.gz GCEWZUAATGRAEC-OALUTQOASA-N 2 0 342.487 2.902 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 ZINC000247072782 1289866716 /nfs/dbraw/zinc/86/67/16/1289866716.db2.gz QHIJVYLSJVDIJA-JXFKEZNVSA-N 2 0 331.504 2.984 20 10 EFCDRP C[NH+](C)CCC1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000092381095 1290687675 /nfs/dbraw/zinc/68/76/75/1290687675.db2.gz GHNFGRBZAMGZJQ-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c(O)c1 ZINC000877076429 1291126431 /nfs/dbraw/zinc/12/64/31/1291126431.db2.gz MIWCBYNQYZTDOY-UHFFFAOYSA-N 2 0 340.467 2.947 20 10 EFCDRP C[NH+]1CCN(c2cc[nH+]c(NCc3cccc(Cl)c3O)c2)CC1 ZINC000877691978 1291330997 /nfs/dbraw/zinc/33/09/97/1291330997.db2.gz ZHKSEBQTJYMNKM-UHFFFAOYSA-N 2 0 332.835 2.805 20 10 EFCDRP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775500910 1292783115 /nfs/dbraw/zinc/78/31/15/1292783115.db2.gz AUMQZYBLTOLXNL-CJNGLKHVSA-N 2 0 325.884 2.722 20 10 EFCDRP COc1ccc(C[NH+]2CCC(COCC[NH+]3CCCC3)CC2)c(O)c1 ZINC001203621010 1312973226 /nfs/dbraw/zinc/97/32/26/1312973226.db2.gz NHZBBLKLECAZMA-UHFFFAOYSA-N 2 0 348.487 2.725 20 10 EFCDRP C[NH+]1CCC(C[NH+]2CCN(Cc3cc(Cl)ccc3O)CC2)CC1 ZINC001203664718 1312984298 /nfs/dbraw/zinc/98/42/98/1312984298.db2.gz ROYIFUPQXBWBGA-UHFFFAOYSA-N 2 0 337.895 2.505 20 10 EFCDRP C[NH+]1CC2(C1)CC[NH+](Cc1cccc(OC(F)(F)F)c1O)CC2 ZINC001233767532 1312987524 /nfs/dbraw/zinc/98/75/24/1312987524.db2.gz DTMKGCVIPSNOAK-UHFFFAOYSA-N 2 0 330.350 2.818 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(CO)c1 ZINC000883290060 1293532507 /nfs/dbraw/zinc/53/25/07/1293532507.db2.gz JOLIEHGCRSNJKN-QGZVFWFLSA-N 2 0 339.483 2.782 20 10 EFCDRP Cc1ccc(C[N@H+]2C[C@H]3CN(Cc4ccc(O)c(O)c4)C[C@H]3C2)cc1 ZINC001203878458 1313040094 /nfs/dbraw/zinc/04/00/94/1313040094.db2.gz UTIOASLMUGGZCZ-KDURUIRLSA-N 2 0 338.451 2.970 20 10 EFCDRP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ccccc1O ZINC000775655746 1293929252 /nfs/dbraw/zinc/92/92/52/1293929252.db2.gz LDJXHOZOIJSAOG-UHFFFAOYSA-N 2 0 325.456 2.776 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCC[N@@H+](C(C)(C)C)CC3)cc2)CC1 ZINC000775665284 1293961188 /nfs/dbraw/zinc/96/11/88/1293961188.db2.gz KLCKQGDGLHEUET-UHFFFAOYSA-N 2 0 344.547 2.745 20 10 EFCDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775724113 1294273446 /nfs/dbraw/zinc/27/34/46/1294273446.db2.gz GXMXSFBTOFXWIA-HXUWFJFHSA-N 3 0 344.547 2.602 20 10 EFCDRP C[N@H+](CCc1nccs1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775734629 1294310681 /nfs/dbraw/zinc/31/06/81/1294310681.db2.gz UINDQMBMFSQGDE-UHFFFAOYSA-N 2 0 330.501 2.569 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001276446194 1313097103 /nfs/dbraw/zinc/09/71/03/1313097103.db2.gz SLJAZJUMHJXSHA-APWZRJJASA-N 2 0 345.531 2.757 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cc(C(C)(C)C)ccc1O ZINC001276445513 1313094138 /nfs/dbraw/zinc/09/41/38/1313094138.db2.gz NWBDLLLSTPEGMC-HDICACEKSA-N 2 0 331.504 2.510 20 10 EFCDRP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)c2c1 ZINC001234569329 1313160162 /nfs/dbraw/zinc/16/01/62/1313160162.db2.gz LLJDFXIIBRSSOA-FOIQADDNSA-N 2 0 326.440 2.938 20 10 EFCDRP Oc1c(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc2c3c1CCCN3CCC2 ZINC001234994760 1313219051 /nfs/dbraw/zinc/21/90/51/1313219051.db2.gz VZQSIQDLECADJC-NRFANRHFSA-N 2 0 341.499 2.667 20 10 EFCDRP CC(C)(C)c1ccc(O)c(CN2CCOC[C@@]3(CCC[NH2+]C3)C2)c1 ZINC001235021936 1313226029 /nfs/dbraw/zinc/22/60/29/1313226029.db2.gz KYBSMVARGONGNZ-HXUWFJFHSA-N 2 0 332.488 2.892 20 10 EFCDRP Oc1ccccc1C[N@@H+]1CCC[C@@]2(CC[NH+](CCn3ccnc3)C2)C1 ZINC001275267348 1296247303 /nfs/dbraw/zinc/24/73/03/1296247303.db2.gz MAPIHVYZMIMIOS-FQEVSTJZSA-N 2 0 340.471 2.577 20 10 EFCDRP CCOC(=O)c1c(C[NH+]2CCC(C[NH3+])CC2)c2ccccc2n1C ZINC001205052806 1313226918 /nfs/dbraw/zinc/22/69/18/1313226918.db2.gz FXPHMVPSFNEXMF-UHFFFAOYSA-N 2 0 329.444 2.526 20 10 EFCDRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(N3CCOCC3)c(Cl)c2)CC1 ZINC001205280965 1313263650 /nfs/dbraw/zinc/26/36/50/1313263650.db2.gz NDIZNHUEKKSESK-GOSISDBHSA-N 2 0 337.895 2.880 20 10 EFCDRP Cc1cccc(C[N@H+]2C[C@@H]3CC[NH+](Cc4cn[nH]c4)CC[C@@H]3C2)c1O ZINC001276080233 1296594583 /nfs/dbraw/zinc/59/45/83/1296594583.db2.gz KUDHESZLIOOKOG-HDICACEKSA-N 2 0 340.471 2.768 20 10 EFCDRP Cc1cc(C[NH+]2CCC(C3C[NH2+]C3)CC2)c(O)cc1Br ZINC001235339368 1313295732 /nfs/dbraw/zinc/29/57/32/1313295732.db2.gz UVXZAYWVKKMNBV-UHFFFAOYSA-N 2 0 339.277 2.895 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@]2(C1)C[NH2+]CC[C@H]2F ZINC001235408524 1313315038 /nfs/dbraw/zinc/31/50/38/1313315038.db2.gz UJVVMIJHNYBBCW-HUUCEWRRSA-N 2 0 332.341 2.935 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc(Br)ccc2O)CC[C@H]1C[NH3+] ZINC001205602674 1313320717 /nfs/dbraw/zinc/32/07/17/1313320717.db2.gz LKTVYNSLWVMLQH-NEPJUHHUSA-N 2 0 327.266 2.962 20 10 EFCDRP C[C@@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC[C@@H]1C[NH3+] ZINC001205617349 1313324009 /nfs/dbraw/zinc/32/40/09/1313324009.db2.gz JCRFOLFKHNSZAT-NVXWUHKLSA-N 2 0 343.515 2.898 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)[C@@H](C[NH3+])CC3)cc2)CC1 ZINC001205627232 1313325984 /nfs/dbraw/zinc/32/59/84/1313325984.db2.gz ODVXHNKRNDLCBY-UYAOXDASSA-N 3 0 344.547 2.635 20 10 EFCDRP Nc1ccc(C[N@@H+]2CCCn3cnc(C[NH2+]C4CCC4)c3C2)cc1 ZINC001235558384 1313351474 /nfs/dbraw/zinc/35/14/74/1313351474.db2.gz HWMOILMVHSSYRK-UHFFFAOYSA-N 2 0 325.460 2.513 20 10 EFCDRP C[N@H+](CCCc1ccccc1)Cc1cc2c(cc1O)OCC[NH2+]C2 ZINC001235670182 1313371249 /nfs/dbraw/zinc/37/12/49/1313371249.db2.gz RZHSTEJDJWBHTE-UHFFFAOYSA-N 2 0 326.440 2.939 20 10 EFCDRP c1ccc(O[C@@H]2CC[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001235674806 1313372119 /nfs/dbraw/zinc/37/21/19/1313372119.db2.gz PQUJISGJPMSWEA-OAQYLSRUSA-N 2 0 337.467 2.750 20 10 EFCDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1c(O)cccc1Br ZINC001235716457 1313382270 /nfs/dbraw/zinc/38/22/70/1313382270.db2.gz CRDKAFBGWSCVST-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C[NH3+])[C@H](C)C3)cc2)CC1 ZINC001206005517 1313389789 /nfs/dbraw/zinc/38/97/89/1313389789.db2.gz YJUPBSJYWJIDIX-UYAOXDASSA-N 3 0 344.547 2.635 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C[NH3+])[C@H](C)C3)cc2)CC1 ZINC001206005516 1313389987 /nfs/dbraw/zinc/38/99/87/1313389987.db2.gz YJUPBSJYWJIDIX-QUCCMNQESA-N 3 0 344.547 2.635 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2cc(O)c(Br)cc2O)CCC[C@H]1C[NH3+] ZINC001206024570 1313393816 /nfs/dbraw/zinc/39/38/16/1313393816.db2.gz KIEMZKPDMNCMIX-MNOVXSKESA-N 2 0 343.265 2.667 20 10 EFCDRP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001235865479 1313412333 /nfs/dbraw/zinc/41/23/33/1313412333.db2.gz DTDVVVKJQWCGLW-LPHOPBHVSA-N 2 0 329.488 2.956 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN3CC[NH2+][C@@H](CC(C)C)C3)cc2)CC1 ZINC001235881946 1313414146 /nfs/dbraw/zinc/41/41/46/1313414146.db2.gz WTICFTBJQZEYAO-FQEVSTJZSA-N 2 0 344.547 2.648 20 10 EFCDRP CC[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1O)Cc1ccccc1F ZINC001235961071 1313423125 /nfs/dbraw/zinc/42/31/25/1313423125.db2.gz WXVLAHXWTAWJGM-UHFFFAOYSA-N 2 0 343.446 2.963 20 10 EFCDRP CC[N@H+](Cc1cccc(F)c1)Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236043232 1313433454 /nfs/dbraw/zinc/43/34/54/1313433454.db2.gz XKYKMWRGVKLXJJ-UHFFFAOYSA-N 2 0 343.446 2.963 20 10 EFCDRP Oc1c(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cccc1OC(F)(F)F ZINC001236321971 1313468994 /nfs/dbraw/zinc/46/89/94/1313468994.db2.gz YJSDHLPKNPANAC-TXEJJXNPSA-N 2 0 330.350 2.722 20 10 EFCDRP COc1ccc2ccc(O)c(C[N@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)c2c1 ZINC001236321023 1313469004 /nfs/dbraw/zinc/46/90/04/1313469004.db2.gz NLJDFZCQOJPFBX-IYBDPMFKSA-N 2 0 326.440 2.985 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCCC[C@](C)(C[NH3+])C3)cc2)CC1 ZINC001206556267 1313475763 /nfs/dbraw/zinc/47/57/63/1313475763.db2.gz PXIPTIDURDHBOS-OAQYLSRUSA-N 3 0 344.547 2.779 20 10 EFCDRP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001236434790 1313480986 /nfs/dbraw/zinc/48/09/86/1313480986.db2.gz VTUNJRTULXGQAH-NRFANRHFSA-N 2 0 343.515 2.877 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C(C)C)[C@@H]3CCC[NH2+]C3)cc2)CC1 ZINC001236467506 1313484663 /nfs/dbraw/zinc/48/46/63/1313484663.db2.gz FXHHAWFCHQPWKP-OAQYLSRUSA-N 2 0 344.547 2.791 20 10 EFCDRP CC(C)C[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554772 1313491681 /nfs/dbraw/zinc/49/16/81/1313491681.db2.gz UXCPEJGJCYTYBY-IYARVYRRSA-N 3 0 347.503 2.602 20 10 EFCDRP CCN(CCC[NH+](C)C)Cc1cc(OC)c(Br)cc1O ZINC001236752572 1313522171 /nfs/dbraw/zinc/52/21/71/1313522171.db2.gz ZEUGVKRIMXUBOU-UHFFFAOYSA-N 2 0 345.281 2.937 20 10 EFCDRP COc1cc(O)c(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1OC ZINC001236755290 1313522728 /nfs/dbraw/zinc/52/27/28/1313522728.db2.gz APTMBSBKLHYTOU-UHFFFAOYSA-N 2 0 336.476 2.962 20 10 EFCDRP Cc1c(CN(CC[NH+](C)C)[C@@H]2CCC[NH2+]C2)c2ccccc2n1C ZINC001236922192 1313553605 /nfs/dbraw/zinc/55/36/05/1313553605.db2.gz FBXNHKBDUIURMC-QGZVFWFLSA-N 2 0 328.504 2.602 20 10 EFCDRP CO[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236934004 1313556808 /nfs/dbraw/zinc/55/68/08/1313556808.db2.gz BMKFEEUBTWCPMT-SFHVURJKSA-N 2 0 335.467 2.578 20 10 EFCDRP CC(C)OC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236940088 1313557126 /nfs/dbraw/zinc/55/71/26/1313557126.db2.gz XFUAFMAVNFZNAI-UHFFFAOYSA-N 2 0 349.494 2.967 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4CCCO[C@@H]4C3)c(F)c2)CC1 ZINC001236935213 1313557493 /nfs/dbraw/zinc/55/74/93/1313557493.db2.gz GMOAOLGFVSNSRE-OXJNMPFZSA-N 2 0 347.478 2.578 20 10 EFCDRP Cc1cc(C)c(C[N@H+]2CCC[C@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001276365579 1299017644 /nfs/dbraw/zinc/01/76/44/1299017644.db2.gz RGWNNFYGPQRNHN-OAQYLSRUSA-N 2 0 345.531 2.859 20 10 EFCDRP CO[C@@H]1[C@@H](C)[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000776497812 1299317014 /nfs/dbraw/zinc/31/70/14/1299317014.db2.gz GBQYLOITEMGKNN-KFKAGJAMSA-N 2 0 331.504 2.588 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC34CCOCC4)cc2)CC1 ZINC000800294170 1307668871 /nfs/dbraw/zinc/66/88/71/1307668871.db2.gz ZGUPQCPLBMFDKH-HXUWFJFHSA-N 2 0 343.515 2.877 20 10 EFCDRP Cc1cc(C)c(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c(O)c1 ZINC001231845050 1312573537 /nfs/dbraw/zinc/57/35/37/1312573537.db2.gz WPWWGAUUEFXGDY-KDURUIRLSA-N 2 0 337.467 2.968 20 10 EFCDRP C[NH+](C)CCN1CCC2(C[NH+](Cc3ccc4ccccc4c3O)C2)C1 ZINC001276374009 1314584095 /nfs/dbraw/zinc/58/40/95/1314584095.db2.gz OJCZTSDVFCWPKD-UHFFFAOYSA-N 2 0 339.483 2.615 20 10 EFCDRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)CC1(C)C ZINC001246172282 1314593457 /nfs/dbraw/zinc/59/34/57/1314593457.db2.gz HLQHFAUSWHLACR-UHFFFAOYSA-N 3 0 344.547 2.837 20 10 EFCDRP Fc1cccc2c1C[C@H]([NH2+]Cc1ccc(N3CC[NH2+]CC3)cc1)CC2 ZINC001246176321 1314594082 /nfs/dbraw/zinc/59/40/82/1314594082.db2.gz WLTPBIWDDQEIPI-GOSISDBHSA-N 2 0 339.458 2.882 20 10 EFCDRP c1ccc(C[N@@H+]2CC[C@H](Oc3ccc(N4CC[NH2+]CC4)cc3)C2)cc1 ZINC001217946137 1315123528 /nfs/dbraw/zinc/12/35/28/1315123528.db2.gz NPVQVJZQGICJGN-NRFANRHFSA-N 2 0 337.467 2.750 20 10 EFCDRP Cc1cc(C[NH+]2C[C@H]3CC[N@@H+](C)C[C@H]3C2)c(O)cc1Br ZINC001250124179 1315175321 /nfs/dbraw/zinc/17/53/21/1315175321.db2.gz ZHZVAVMZUPVBLU-OCCSQVGLSA-N 2 0 339.277 2.847 20 10 EFCDRP CC(C)(C[NH3+])c1ccc(NC(=O)C[C@@H]([NH3+])c2ccccc2O)cc1 ZINC001218895161 1315255815 /nfs/dbraw/zinc/25/58/15/1315255815.db2.gz JLDLGSGABYOTCB-MRXNPFEDSA-N 2 0 327.428 2.657 20 10 EFCDRP CC[NH+](CC)C[C@@H](O)CNc1ccccc1OCC1CC[NH+](C)CC1 ZINC001253200344 1315579726 /nfs/dbraw/zinc/57/97/26/1315579726.db2.gz BTRJKMKOXPXMQK-SFHVURJKSA-N 2 0 349.519 2.522 20 10 EFCDRP C[N@H+](Cc1ccccc1O)CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001254039873 1315668375 /nfs/dbraw/zinc/66/83/75/1315668375.db2.gz MXQITYOJLGXSEK-UHFFFAOYSA-N 2 0 340.467 2.851 20 10 EFCDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(Br)cc2O)C1 ZINC001328759244 1330627633 /nfs/dbraw/zinc/62/76/33/1330627633.db2.gz OEGDKDORRKFFTE-GFCCVEGCSA-N 2 0 327.266 2.976 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CCCc3cncn3C)CC2)cc1 ZINC001329001008 1330655555 /nfs/dbraw/zinc/65/55/55/1330655555.db2.gz STCDHIIIXPWZQM-UHFFFAOYSA-N 2 0 328.460 2.574 20 10 EFCDRP Cc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)cnc1F ZINC001333795551 1331215838 /nfs/dbraw/zinc/21/58/38/1331215838.db2.gz CGXBSIJFAVHPOC-UHFFFAOYSA-N 2 0 328.435 2.571 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC001337785106 1331598741 /nfs/dbraw/zinc/59/87/41/1331598741.db2.gz JQGWZEWRBQKJPF-DLBZAZTESA-N 2 0 331.504 2.866 20 10 EFCDRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001338184820 1331668684 /nfs/dbraw/zinc/66/86/84/1331668684.db2.gz APDWFGZHTVGMAE-UHFFFAOYSA-N 2 0 344.547 2.793 20 10 EFCDRP C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C[C@@H](C2CC2)O1 ZINC001339602690 1331910048 /nfs/dbraw/zinc/91/00/48/1331910048.db2.gz AFLCCZRAUMEWHS-QRWLVFNGSA-N 2 0 347.478 2.577 20 10 EFCDRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001341604223 1332270674 /nfs/dbraw/zinc/27/06/74/1332270674.db2.gz GMLCXCFLKJIDTI-HKBOAZHASA-N 2 0 343.515 2.970 20 10 EFCDRP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC001346539709 1332654885 /nfs/dbraw/zinc/65/48/85/1332654885.db2.gz FZLQZORWJRVRJL-HXUWFJFHSA-N 2 0 343.515 2.974 20 10 EFCDRP Fc1cc(C[NH2+][C@H]2CCCN3CCCC[C@H]23)ccc1N1CCOCC1 ZINC000848575654 1334803971 /nfs/dbraw/zinc/80/39/71/1334803971.db2.gz URHNGCNDMAYWOF-AZUAARDMSA-N 2 0 347.478 2.769 20 10 EFCDRP CCc1cccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c1O ZINC000848899987 1334972054 /nfs/dbraw/zinc/97/20/54/1334972054.db2.gz WIACSLXFQUVSGG-RBUKOAKNSA-N 2 0 332.488 2.812 20 10 EFCDRP CCc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c1O ZINC000848902810 1334973110 /nfs/dbraw/zinc/97/31/10/1334973110.db2.gz TYTJJLDGTKYUPU-HXUWFJFHSA-N 2 0 340.467 2.811 20 10 EFCDRP COc1ccc2c(c1)CN(Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC000848926094 1334991802 /nfs/dbraw/zinc/99/18/02/1334991802.db2.gz QPRVONLXEFNFCP-UHFFFAOYSA-N 2 0 337.467 2.963 20 10 EFCDRP COc1ccc(N2CC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)C2)cc1 ZINC000849350173 1335596379 /nfs/dbraw/zinc/59/63/79/1335596379.db2.gz LVNRPGWJHCGHFN-KCUHQSDYSA-N 2 0 329.488 2.784 20 10 EFCDRP COc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c(O)c1OC ZINC000892237470 715400705 /nfs/dbraw/zinc/40/07/05/715400705.db2.gz ZQLSSKNMMMUEEF-RHSMWYFYSA-N 2 0 346.471 2.858 20 10 EFCDRP CC[C@@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)ccc1O ZINC000219315712 716386178 /nfs/dbraw/zinc/38/61/78/716386178.db2.gz RCBBQVCLSCJRSP-CQSZACIVSA-N 2 0 345.281 2.774 20 10 EFCDRP C[C@@H]1CN(c2ccc(C[NH2+]CC3CC[NH+](C)CC3)cc2F)C[C@@H](C)O1 ZINC000892624052 718352121 /nfs/dbraw/zinc/35/21/21/718352121.db2.gz YRPOCVPOFPAWRR-HZPDHXFCSA-N 2 0 349.494 2.871 20 10 EFCDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185648044 720424803 /nfs/dbraw/zinc/42/48/03/720424803.db2.gz PVYUYGAFGQCSPZ-MRXNPFEDSA-N 2 0 345.531 2.948 20 10 EFCDRP COc1cc(C)cc(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1O ZINC000894189607 721187308 /nfs/dbraw/zinc/18/73/08/721187308.db2.gz BXCUQUPCPANTML-UHFFFAOYSA-N 2 0 344.455 2.939 20 10 EFCDRP C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000895606834 724221436 /nfs/dbraw/zinc/22/14/36/724221436.db2.gz GOIOWOPUSLFMBT-QGZVFWFLSA-N 2 0 339.483 2.865 20 10 EFCDRP CC[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(N(C)C)cc1 ZINC000154387922 727800538 /nfs/dbraw/zinc/80/05/38/727800538.db2.gz HBAKLYIORUPJCE-FQEVSTJZSA-N 2 0 332.536 2.821 20 10 EFCDRP CC[N@@H+]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 ZINC000157379985 728137898 /nfs/dbraw/zinc/13/78/98/728137898.db2.gz QHIJVYLSJVDIJA-OXQOHEQNSA-N 2 0 331.504 2.984 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CCCC3CC[NH2+]CC3)CC2)cc1 ZINC001578181631 1090294404 /nfs/dbraw/zinc/29/44/04/1090294404.db2.gz LWDBCMOXVSLULA-UHFFFAOYSA-N 2 0 331.504 2.987 20 10 EFCDRP COc1ccc(N2CC[NH+](C[C@H]3CC[C@H](C[NH3+])CC3)CC2)c(OC)c1 ZINC001579225222 1090551285 /nfs/dbraw/zinc/55/12/85/1090551285.db2.gz FXYDDCAJSYFFML-QAQDUYKDSA-N 2 0 347.503 2.591 20 10 EFCDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC001580258737 1090836954 /nfs/dbraw/zinc/83/69/54/1090836954.db2.gz WNPWIYQLNIBVJU-UKRRQHHQSA-N 2 0 339.430 2.974 20 10 EFCDRP c1c(C[NH2+]Cc2ccc(N3CCOCC3)cc2)sc2c1C[NH2+]CC2 ZINC001580890743 1091036606 /nfs/dbraw/zinc/03/66/06/1091036606.db2.gz OZKRABBCOGUALK-UHFFFAOYSA-N 2 0 343.496 2.520 20 10 EFCDRP c1csc(SCCC[NH2+][C@@H]2CCOC3(CC[NH2+]CC3)C2)n1 ZINC001580897312 1091039337 /nfs/dbraw/zinc/03/93/37/1091039337.db2.gz OGUTYJIJCUQQJK-CYBMUJFWSA-N 2 0 327.519 2.516 20 10 EFCDRP CC1(C)CC([NH3+])CC(C)(C)N1c1ccc(CN2CC[NH2+]CC2)cc1 ZINC001167624952 1093140338 /nfs/dbraw/zinc/14/03/38/1093140338.db2.gz JFBRHVMYXHQNQX-UHFFFAOYSA-N 2 0 330.520 2.577 20 10 EFCDRP COc1cc(Br)cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])c1O ZINC000841031488 1102838224 /nfs/dbraw/zinc/83/82/24/1102838224.db2.gz SOEGMBBYBAMGAE-MFKMUULPSA-N 2 0 343.265 2.770 20 10 EFCDRP Cc1cc(Br)cc(C[NH2+]CC2(C)CC[NH2+]CC2)c1O ZINC000841057440 1102902640 /nfs/dbraw/zinc/90/26/40/1102902640.db2.gz MUELEQDWPSUDSQ-UHFFFAOYSA-N 2 0 327.266 2.942 20 10 EFCDRP CCOCc1cc(C[NH2+][C@@H]2Cc3ccccc3[C@H]2N)ccc1OC ZINC000904462610 1107937762 /nfs/dbraw/zinc/93/77/62/1107937762.db2.gz XJHSRYQDZGNSDO-UYAOXDASSA-N 2 0 326.440 2.946 20 10 EFCDRP CCC[NH+]1CCC(NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)CC1 ZINC000898449414 1108943363 /nfs/dbraw/zinc/94/33/63/1108943363.db2.gz DYVSJLCFZKBJPX-FQEVSTJZSA-N 2 0 332.536 2.819 20 10 EFCDRP COc1cc(O)c(CN2CC[C@H](C[NH+]3CCCCC3)C2)cc1OC ZINC000160296828 239047041 /nfs/dbraw/zinc/04/70/41/239047041.db2.gz NYDSRESNCLVUHR-OAHLLOKOSA-N 2 0 334.460 2.717 20 10 EFCDRP Oc1cc2c(cc1C[NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)OCO2 ZINC000192929626 240073011 /nfs/dbraw/zinc/07/30/11/240073011.db2.gz SVDFKWPGMJGPEI-MRXNPFEDSA-N 2 0 340.423 2.733 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000247099271 240276768 /nfs/dbraw/zinc/27/67/68/240276768.db2.gz SGLXRGCLDJDWKG-ZWKOTPCHSA-N 2 0 332.536 2.677 20 10 EFCDRP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@@H]3O)CC1)CC2 ZINC000296245733 241079640 /nfs/dbraw/zinc/07/96/40/241079640.db2.gz AYYQGYWWJRBPLI-KURKYZTESA-N 2 0 330.472 2.737 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000364452025 242299339 /nfs/dbraw/zinc/29/93/39/242299339.db2.gz WBCRJDMCGQRUEN-CGTJXYLNSA-N 2 0 347.478 2.940 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000363784830 287069497 /nfs/dbraw/zinc/06/94/97/287069497.db2.gz ODPZJTBSYYSEKJ-AEFFLSMTSA-N 2 0 330.520 2.572 20 10 EFCDRP Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423081376 274668894 /nfs/dbraw/zinc/66/88/94/274668894.db2.gz BMQHYYCRSVKDPP-FGTMMUONSA-N 2 0 327.472 2.733 20 10 EFCDRP CC[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccc(N(C)C)cc1 ZINC000370637899 288090381 /nfs/dbraw/zinc/09/03/81/288090381.db2.gz VULIJEISYKUYAJ-RXVVDRJESA-N 2 0 344.547 2.962 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cc(F)ccc1O ZINC000184969168 473287649 /nfs/dbraw/zinc/28/76/49/473287649.db2.gz FDGPWYDSMWHFOV-CQSZACIVSA-N 2 0 344.434 2.529 20 10 EFCDRP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000185206596 473363161 /nfs/dbraw/zinc/36/31/61/473363161.db2.gz VVBVJGSWWMHANQ-XHSDSOJGSA-N 2 0 336.476 2.941 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000090937167 472667023 /nfs/dbraw/zinc/66/70/23/472667023.db2.gz NQJOTLJMMGTJEU-MRXNPFEDSA-N 2 0 342.487 2.939 20 10 EFCDRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)N1CC[NH+](C)CC1 ZINC000132371605 472730075 /nfs/dbraw/zinc/73/00/75/472730075.db2.gz JYEZUULOSHHJKG-XLIONFOSSA-N 2 0 332.536 2.675 20 10 EFCDRP Cc1ccc(O)c(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)c1 ZINC000092665912 472957575 /nfs/dbraw/zinc/95/75/75/472957575.db2.gz WNPOQFAFMAJBRF-QZTJIDSGSA-N 2 0 331.504 2.691 20 10 EFCDRP CCOc1cccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1O ZINC000093735019 473137163 /nfs/dbraw/zinc/13/71/63/473137163.db2.gz YQEPDLQRNYRIJB-UHFFFAOYSA-N 2 0 348.487 2.868 20 10 EFCDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000185344922 473400773 /nfs/dbraw/zinc/40/07/73/473400773.db2.gz CZLMUFGOVUOHET-GJZGRUSLSA-N 2 0 339.911 2.970 20 10 EFCDRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(Cl)ccc1O ZINC000185366701 473406469 /nfs/dbraw/zinc/40/64/69/473406469.db2.gz DLYSTKPBXWYHAG-AWEZNQCLSA-N 2 0 325.884 2.724 20 10 EFCDRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185365615 473407578 /nfs/dbraw/zinc/40/75/78/473407578.db2.gz ZRRYAPXZALVFHK-JKSUJKDBSA-N 2 0 331.504 2.558 20 10 EFCDRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc2ccccc2c1O ZINC000185392468 473414358 /nfs/dbraw/zinc/41/43/58/473414358.db2.gz MXVLQJVZBSXBOG-JKSUJKDBSA-N 2 0 327.472 2.832 20 10 EFCDRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000185647746 473477263 /nfs/dbraw/zinc/47/72/63/473477263.db2.gz RFORYVMKJAPLCG-CYBMUJFWSA-N 2 0 325.884 2.722 20 10 EFCDRP Cc1cccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)c1O ZINC000179909582 473752569 /nfs/dbraw/zinc/75/25/69/473752569.db2.gz VWWQWTHQDYXKNR-ROUUACIJSA-N 2 0 331.504 2.691 20 10 EFCDRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000227329770 474245613 /nfs/dbraw/zinc/24/56/13/474245613.db2.gz FZVOEXHRMQPUMO-UHFFFAOYSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccccc1O ZINC000183609093 474399992 /nfs/dbraw/zinc/39/99/92/474399992.db2.gz JQMVRNTWSOIUMD-OAHLLOKOSA-N 2 0 341.455 2.534 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCSC3)cc2F)CC1 ZINC000278531795 474686528 /nfs/dbraw/zinc/68/65/28/474686528.db2.gz RTZRLCIYOYKGRX-INIZCTEOSA-N 2 0 337.508 2.810 20 10 EFCDRP C[C@H]([NH2+]C[C@H]1CN(C)CCN1C)c1ccc(N2CCCCC2)cc1 ZINC000268879912 475047817 /nfs/dbraw/zinc/04/78/17/475047817.db2.gz HQCJMEJAVPBHOB-PXNSSMCTSA-N 2 0 330.520 2.573 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[C@H](C)O[C@H]3C)cc2F)CC1 ZINC000295270903 475118095 /nfs/dbraw/zinc/11/80/95/475118095.db2.gz VPRUCSUTAPJSDU-RLFYNMQTSA-N 2 0 335.467 2.623 20 10 EFCDRP C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)C1 ZINC000369551245 476426553 /nfs/dbraw/zinc/42/65/53/476426553.db2.gz SAAXEMPYANMOFQ-SFHVURJKSA-N 2 0 339.483 2.757 20 10 EFCDRP CN(C)c1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000375243965 476735025 /nfs/dbraw/zinc/73/50/25/476735025.db2.gz CFUPSSSSQWIOQG-UHFFFAOYSA-N 2 0 344.547 2.602 20 10 EFCDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000375471015 476856028 /nfs/dbraw/zinc/85/60/28/476856028.db2.gz GEHDDEUYLCESIU-UHFFFAOYSA-N 2 0 329.488 2.583 20 10 EFCDRP C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)CN1CC[NH+](C)CC1 ZINC000756534149 575756524 /nfs/dbraw/zinc/75/65/24/575756524.db2.gz KUGHIKLINLCSOJ-IJEWVQPXSA-N 2 0 335.467 2.553 20 10 EFCDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c2c1c(F)ccc2O ZINC000756578915 575765068 /nfs/dbraw/zinc/76/50/68/575765068.db2.gz XQJOJYJJEPXOOE-CPUCHLNUSA-N 2 0 347.478 2.838 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756636499 575771482 /nfs/dbraw/zinc/77/14/82/575771482.db2.gz DYDVAPBUUHRDFH-BBRMVZONSA-N 2 0 335.467 2.695 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCCN3C3CC3)cc2)CC1 ZINC000766226674 577123906 /nfs/dbraw/zinc/12/39/06/577123906.db2.gz TZAVCEHETRVJSZ-NRFANRHFSA-N 2 0 342.531 2.545 20 10 EFCDRP C[NH+](C)CCOC1CC[NH+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444949 577274223 /nfs/dbraw/zinc/27/42/23/577274223.db2.gz DGQZGHVYDYPBAC-UHFFFAOYSA-N 2 0 332.488 2.814 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1C ZINC000769471340 577365125 /nfs/dbraw/zinc/36/51/25/577365125.db2.gz SSAQJWCBMNXSNK-XLIONFOSSA-N 2 0 331.504 2.828 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000769515363 577369117 /nfs/dbraw/zinc/36/91/17/577369117.db2.gz OZHLGEZFXROIMD-INIZCTEOSA-N 2 0 326.868 2.978 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]CC3(O)CCCCCC3)cc2)CC1 ZINC000771844125 581249806 /nfs/dbraw/zinc/24/98/06/581249806.db2.gz WEBKJYCEPGFHRF-UHFFFAOYSA-N 2 0 331.504 2.613 20 10 EFCDRP CSc1cc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)ccn1 ZINC000771882027 581254242 /nfs/dbraw/zinc/25/42/42/581254242.db2.gz PSEYHTYSZMWKJN-UHFFFAOYSA-N 2 0 342.512 2.845 20 10 EFCDRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000771888367 581254950 /nfs/dbraw/zinc/25/49/50/581254950.db2.gz OLQHXRCCKZCPBX-AZUAARDMSA-N 2 0 331.504 2.732 20 10 EFCDRP CC(C)[NH+]1CCC([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000850565720 1250539494 /nfs/dbraw/zinc/53/94/94/1250539494.db2.gz HQQFUHAEMJJISS-UHFFFAOYSA-N 2 0 331.504 2.610 20 10 EFCDRP Cc1nc([C@H]2CCC[NH2+]C2)cc(N2C[C@@H](CC[NH3+])c3ccccc32)n1 ZINC001168545441 1257059217 /nfs/dbraw/zinc/05/92/17/1257059217.db2.gz OUEHFWULECPOGG-JKSUJKDBSA-N 2 0 337.471 2.836 20 10 EFCDRP Cc1cc(C[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)ccc1N(C)C ZINC000923381032 1261580296 /nfs/dbraw/zinc/58/02/96/1261580296.db2.gz ZKVUXSBALNQPEP-ICSRJNTNSA-N 2 0 331.504 2.779 20 10 EFCDRP Cc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)ccc1N(C)C ZINC000923393767 1261599446 /nfs/dbraw/zinc/59/94/46/1261599446.db2.gz XNAJVZWSNOJISK-SXLOBPIMSA-N 2 0 331.504 2.922 20 10 EFCDRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921860694 1262923530 /nfs/dbraw/zinc/92/35/30/1262923530.db2.gz UPDCPKODLOJQFK-VQTJNVASSA-N 2 0 344.499 2.869 20 10 EFCDRP CO[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1(C)C ZINC000824821148 1278304370 /nfs/dbraw/zinc/30/43/70/1278304370.db2.gz VJCUUFGKRZJLJC-IBGZPJMESA-N 2 0 331.504 2.685 20 10 EFCDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000824913557 1278338718 /nfs/dbraw/zinc/33/87/18/1278338718.db2.gz BCCRLTQBRARZPC-UHFFFAOYSA-N 3 0 332.536 2.648 20 10 EFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000700809916 1269550408 /nfs/dbraw/zinc/55/04/08/1269550408.db2.gz VZBAZKAWDGSONK-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP CCn1ccc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)c1 ZINC000792182354 1278621552 /nfs/dbraw/zinc/62/15/52/1278621552.db2.gz CQQSEBMQBATPNJ-UHFFFAOYSA-N 2 0 326.488 2.892 20 10 EFCDRP Oc1cc(Br)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000691447769 1274088168 /nfs/dbraw/zinc/08/81/68/1274088168.db2.gz VSRLAACTPQQDBX-ZIAGYGMSSA-N 2 0 325.250 2.871 20 10 EFCDRP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000706059865 1274356471 /nfs/dbraw/zinc/35/64/71/1274356471.db2.gz PISHTJPETATOMV-LBPRGKRZSA-N 2 0 327.266 2.976 20 10 EFCDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1C(F)(F)F ZINC000817887756 1276345886 /nfs/dbraw/zinc/34/58/86/1276345886.db2.gz DMGOHFWSUIVMIA-CHWSQXEVSA-N 2 0 345.409 2.757 20 10 EFCDRP CCN(CC)c1ccc(C[NH2+][C@@H]2CCOC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000817890506 1276348309 /nfs/dbraw/zinc/34/83/09/1276348309.db2.gz YZHVCZPXTJJAGZ-VAMGGRTRSA-N 2 0 331.504 2.780 20 10 EFCDRP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000817894736 1276363050 /nfs/dbraw/zinc/36/30/50/1276363050.db2.gz NQWDIAQCYJSQEY-NJDAHSKKSA-N 2 0 343.515 2.924 20 10 EFCDRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817893517 1276363128 /nfs/dbraw/zinc/36/31/28/1276363128.db2.gz GGRJAVDZMNCSJR-UTKZUKDTSA-N 2 0 339.483 2.571 20 10 EFCDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817895434 1276364756 /nfs/dbraw/zinc/36/47/56/1276364756.db2.gz UWUJPMMKSGCOJN-MJGOQNOKSA-N 2 0 331.504 2.924 20 10 EFCDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817897939 1276366479 /nfs/dbraw/zinc/36/64/79/1276366479.db2.gz AWAYZDQZAMFRJG-JJRVBVJISA-N 2 0 339.430 2.974 20 10 EFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000817901810 1276366624 /nfs/dbraw/zinc/36/66/24/1276366624.db2.gz XSNJVVXBQJVAEI-IHRRRGAJSA-N 2 0 327.419 2.972 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN[C@H](C)[C@@H]3CCCC[NH2+]3)cc2F)CC1 ZINC000817902367 1276366864 /nfs/dbraw/zinc/36/68/64/1276366864.db2.gz OXXJXSNAWRRHJD-APWZRJJASA-N 2 0 348.510 2.588 20 10 EFCDRP C[C@H]([NH3+])[C@H]1COCC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000817902473 1276366884 /nfs/dbraw/zinc/36/68/84/1276366884.db2.gz RCOYPMDSYAUVDI-PWIZWCRZSA-N 2 0 331.504 2.765 20 10 EFCDRP C[C@H]([NH3+])C[C@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903207 1276367145 /nfs/dbraw/zinc/36/71/45/1276367145.db2.gz KFCRUMRCQFRBKQ-STQMWFEESA-N 2 0 327.419 2.972 20 10 EFCDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903880 1276367374 /nfs/dbraw/zinc/36/73/74/1276367374.db2.gz WNNFNAVLDFAWJK-CXAGYDPISA-N 2 0 339.430 2.974 20 10 EFCDRP C[C@@H]([NH2+]CCN1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817943356 1276389636 /nfs/dbraw/zinc/38/96/36/1276389636.db2.gz MCUBWECJMRBOMQ-GOSISDBHSA-N 2 0 330.520 2.623 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(N2CCOCC2)c(F)c1 ZINC000817959544 1276398792 /nfs/dbraw/zinc/39/87/92/1276398792.db2.gz GXWXFEZYHWBSOI-YXJHDRRASA-N 2 0 335.467 2.830 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(N2CCOCC2)cc1Cl ZINC000817976837 1276416913 /nfs/dbraw/zinc/41/69/13/1276416913.db2.gz VKQWKJBQJXLLRN-KBXCAEBGSA-N 2 0 349.906 2.969 20 10 EFCDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817981630 1276419898 /nfs/dbraw/zinc/41/98/98/1276419898.db2.gz UCEYDTUUYFEPEK-RDJZCZTQSA-N 2 0 335.467 2.845 20 10 EFCDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817981072 1276420960 /nfs/dbraw/zinc/42/09/60/1276420960.db2.gz GUVSTXYQHMDPIL-KKUMJFAQSA-N 2 0 337.895 2.955 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(N2CCOCC2)cc1Cl ZINC000817981074 1276421178 /nfs/dbraw/zinc/42/11/78/1276421178.db2.gz GUVSTXYQHMDPIL-RRFJBIMHSA-N 2 0 337.895 2.955 20 10 EFCDRP COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)C3CC[NH+](C)CC3)C2)cc1 ZINC000818345276 1276511635 /nfs/dbraw/zinc/51/16/35/1276511635.db2.gz SWBVKJAOFVSCND-DLBZAZTESA-N 2 0 331.504 2.841 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCN(c3ccc(OC)cc3)C2)[C@@H](C)C1 ZINC000818344140 1276511657 /nfs/dbraw/zinc/51/16/57/1276511657.db2.gz JUARENPNVBUMOD-QKLQHJQFSA-N 2 0 331.504 2.841 20 10 EFCDRP CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000789593785 1276871754 /nfs/dbraw/zinc/87/17/54/1276871754.db2.gz WCFYMVFSSJLZGR-OAQYLSRUSA-N 2 0 345.531 2.811 20 10 EFCDRP Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)ccc1N(C)C ZINC000815074258 1287300522 /nfs/dbraw/zinc/30/05/22/1287300522.db2.gz NMHVIFJRPRLKMO-MISYRCLQSA-N 2 0 331.504 2.745 20 10 EFCDRP CC(C)(C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1)C[NH+]1CCCC1 ZINC000791010208 1277905878 /nfs/dbraw/zinc/90/58/78/1277905878.db2.gz GEHYATDOQJGZJU-UHFFFAOYSA-N 2 0 349.494 2.874 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c(O)c1 ZINC000844902543 1279323760 /nfs/dbraw/zinc/32/37/60/1279323760.db2.gz OWKBGZLTGCPXIB-TXPKVOOTSA-N 2 0 334.460 2.509 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)cc1F ZINC000844902232 1279324911 /nfs/dbraw/zinc/32/49/11/1279324911.db2.gz MDVVQSBKIUVQOV-TXPKVOOTSA-N 2 0 335.467 2.610 20 10 EFCDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCOCC2)c(F)c1 ZINC000844925633 1279344575 /nfs/dbraw/zinc/34/45/75/1279344575.db2.gz DMMGAFFGIPKDDF-HNNXBMFYSA-N 2 0 335.467 2.703 20 10 EFCDRP CCOC1(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCC1 ZINC000815146497 1287348788 /nfs/dbraw/zinc/34/87/88/1287348788.db2.gz DQPRZRHGTJZTFK-UHFFFAOYSA-N 2 0 331.504 2.877 20 10 EFCDRP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1O ZINC000846156064 1280039769 /nfs/dbraw/zinc/03/97/69/1280039769.db2.gz RWOZXJLXCXSSQD-OWCLPIDISA-N 2 0 336.476 2.941 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@@H]3CC[N@@H+](C(C)C)C3)CC2)cc1 ZINC000809735742 1282435611 /nfs/dbraw/zinc/43/56/11/1282435611.db2.gz QTUAPKWDVBMTTA-KRWDZBQOSA-N 2 0 331.504 2.984 20 10 EFCDRP CC[C@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810213771 1283037366 /nfs/dbraw/zinc/03/73/66/1283037366.db2.gz XHFKWPPMIQGIET-ZFWWWQNUSA-N 2 0 346.393 2.908 20 10 EFCDRP CC[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1O ZINC000810213765 1283037503 /nfs/dbraw/zinc/03/75/03/1283037503.db2.gz XHFKWPPMIQGIET-DZGCQCFKSA-N 2 0 346.393 2.908 20 10 EFCDRP CC[C@H]([NH2+]C[C@@]1(O)CCN(C)C1)c1ccc(C(F)(F)F)cc1O ZINC000810238082 1283088560 /nfs/dbraw/zinc/08/85/60/1283088560.db2.gz XXWIKPGSKCWGED-ZFWWWQNUSA-N 2 0 332.366 2.518 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3Cc4cccc(F)c4C3)cc2)CC1 ZINC001171774452 1285779407 /nfs/dbraw/zinc/77/94/07/1285779407.db2.gz AEBYMTPRMOPVFL-GOSISDBHSA-N 2 0 339.458 2.835 20 10 EFCDRP CC(C)[C@H](C[NH2+]Cc1ccc2ccccc2c1O)N1CC[NH+](C)CC1 ZINC000816534273 1288193547 /nfs/dbraw/zinc/19/35/47/1288193547.db2.gz CSWXMPWFSFUTGH-FQEVSTJZSA-N 2 0 341.499 2.907 20 10 EFCDRP CN1CC[NH+](CCCC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816535674 1288196225 /nfs/dbraw/zinc/19/62/25/1288196225.db2.gz WJDIHCNWOKRYSO-UHFFFAOYSA-N 2 0 327.472 2.663 20 10 EFCDRP CC(C)[C@]1(CO)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000816662283 1288234902 /nfs/dbraw/zinc/23/49/02/1288234902.db2.gz LQDZOWGIZPCPSQ-OAQYLSRUSA-N 2 0 345.531 2.669 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@]4(CCCO4)[C@@H]3C3CC3)cc2)CC1 ZINC000816666294 1288236476 /nfs/dbraw/zinc/23/64/76/1288236476.db2.gz JLXQTSPBEXLLCR-SFTDATJTSA-N 2 0 341.499 2.582 20 10 EFCDRP CC[N@H+](C)CCC(=O)N[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001135861643 1288519418 /nfs/dbraw/zinc/51/94/18/1288519418.db2.gz UZLZGRIAUHHHKW-IAGOWNOFSA-N 2 0 349.519 2.718 20 10 EFCDRP CC[NH+]1CCC(N2CCC[N@H+](Cc3cccc(C)c3O)CC2)CC1 ZINC000817413788 1288591631 /nfs/dbraw/zinc/59/16/31/1288591631.db2.gz JLRPCJAICLDZAX-UHFFFAOYSA-N 2 0 331.504 2.693 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CSC[C@@H]3C)cc2F)CC1 ZINC000823801484 1289462955 /nfs/dbraw/zinc/46/29/55/1289462955.db2.gz GOQCKVVYMGVKLH-YOEHRIQHSA-N 2 0 337.508 2.809 20 10 EFCDRP COc1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1Cn1cccn1 ZINC000873014275 1289518802 /nfs/dbraw/zinc/51/88/02/1289518802.db2.gz NKPQWBLZZADTFN-OALUTQOASA-N 2 0 340.471 2.656 20 10 EFCDRP COc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1Cn1cccn1 ZINC000873015944 1289520435 /nfs/dbraw/zinc/52/04/35/1289520435.db2.gz CJXJLZDTUPVSED-QGZVFWFLSA-N 2 0 342.487 2.762 20 10 EFCDRP COc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1Cn1cccn1 ZINC000873015943 1289521494 /nfs/dbraw/zinc/52/14/94/1289521494.db2.gz CJXJLZDTUPVSED-KRWDZBQOSA-N 2 0 342.487 2.762 20 10 EFCDRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)C1 ZINC000873020648 1289524341 /nfs/dbraw/zinc/52/43/41/1289524341.db2.gz YZPOEKXLIARZDK-SFHVURJKSA-N 2 0 342.487 2.762 20 10 EFCDRP CCCOc1ccc(C[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cc1C ZINC000873107356 1289570351 /nfs/dbraw/zinc/57/03/51/1289570351.db2.gz OWNJCLKJMKXPOS-SFHVURJKSA-N 2 0 333.520 2.899 20 10 EFCDRP CCCOc1ccc(C[NH2+][C@H](C)CCN2CC[NH+](C)CC2)cc1C ZINC000873107355 1289570758 /nfs/dbraw/zinc/57/07/58/1289570758.db2.gz OWNJCLKJMKXPOS-GOSISDBHSA-N 2 0 333.520 2.899 20 10 EFCDRP OCCCN1CCC[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000824559385 1289699478 /nfs/dbraw/zinc/69/94/78/1289699478.db2.gz RZKGEVTXAOIKJQ-FQEVSTJZSA-N 2 0 331.504 2.613 20 10 EFCDRP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000775500912 1292783056 /nfs/dbraw/zinc/78/30/56/1292783056.db2.gz AUMQZYBLTOLXNL-XJKSGUPXSA-N 2 0 325.884 2.722 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2c([O-])cc(Br)cc2F)CC1 ZINC001205580183 1292806667 /nfs/dbraw/zinc/80/66/67/1292806667.db2.gz RBMBYGRRMDKTMK-CQSZACIVSA-N 2 0 349.219 2.947 20 10 EFCDRP COc1cccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1O ZINC001203595821 1312966566 /nfs/dbraw/zinc/96/65/66/1312966566.db2.gz PMQXVJLHVMKTTB-OALUTQOASA-N 2 0 338.451 2.965 20 10 EFCDRP CCOc1cccc(C[NH+]2CCN(c3cc[nH+]c(C)c3)CC2)c1O ZINC001203617191 1312972693 /nfs/dbraw/zinc/97/26/93/1312972693.db2.gz LEYBGDABSQIMSV-UHFFFAOYSA-N 2 0 327.428 2.817 20 10 EFCDRP [O-]c1c(F)cc(F)cc1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000883085696 1293455683 /nfs/dbraw/zinc/45/56/83/1293455683.db2.gz XEEDTSZXSMQFKA-KRWDZBQOSA-N 2 0 348.393 2.527 20 10 EFCDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1ccc(F)cn1 ZINC000883290021 1293532845 /nfs/dbraw/zinc/53/28/45/1293532845.db2.gz ILAFRDAIDKJYBV-HNNXBMFYSA-N 2 0 328.435 2.823 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOc4ccccc4C3)cc2)CC1 ZINC000775658803 1293939916 /nfs/dbraw/zinc/93/99/16/1293939916.db2.gz CGZLOMNWLNEVOC-UHFFFAOYSA-N 2 0 337.467 2.833 20 10 EFCDRP CC(C)C[C@@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775689286 1294149140 /nfs/dbraw/zinc/14/91/40/1294149140.db2.gz BOSHCNFKWVZSBT-HXUWFJFHSA-N 2 0 331.504 2.685 20 10 EFCDRP CC(C)C[C@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775689284 1294149181 /nfs/dbraw/zinc/14/91/81/1294149181.db2.gz BOSHCNFKWVZSBT-FQEVSTJZSA-N 2 0 331.504 2.685 20 10 EFCDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC000775715995 1294241643 /nfs/dbraw/zinc/24/16/43/1294241643.db2.gz OGLIXAWOQYKTLR-RXVVDRJESA-N 3 0 344.547 2.743 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC4(CCCCC4)C3)cc2)CC1 ZINC000775717666 1294245311 /nfs/dbraw/zinc/24/53/11/1294245311.db2.gz FOOGBPDASAQPAF-UHFFFAOYSA-N 2 0 343.515 2.974 20 10 EFCDRP CC(C)CO[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000775737865 1294344655 /nfs/dbraw/zinc/34/46/55/1294344655.db2.gz NVADHOALQAWBBK-FQEVSTJZSA-N 2 0 331.504 2.685 20 10 EFCDRP C[NH+](C)CCN1CCC2(C[NH+](Cc3cc(C(C)(C)C)ccc3O)C2)C1 ZINC001276444013 1313090211 /nfs/dbraw/zinc/09/02/11/1313090211.db2.gz BHJRECJZQANFRD-UHFFFAOYSA-N 2 0 345.531 2.759 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(Cl)cn3)cc2)CC1 ZINC000886185623 1294754612 /nfs/dbraw/zinc/75/46/12/1294754612.db2.gz AZJVHFWWHWNWAH-UHFFFAOYSA-N 2 0 330.863 2.777 20 10 EFCDRP CN(C)c1ccc(C[N@H+](C)CCN2CC[NH+](C)CC2)c2ccccc21 ZINC001204240540 1313106850 /nfs/dbraw/zinc/10/68/50/1313106850.db2.gz XKBCNGMLGXCLGT-UHFFFAOYSA-N 2 0 340.515 2.585 20 10 EFCDRP CCCCN(CCCC)c1ccc(CN2C[C@H]([NH3+])C[C@@H](O)C2)c(O)c1 ZINC001204954669 1313214862 /nfs/dbraw/zinc/21/48/62/1313214862.db2.gz HUMBNLSZWOLNOI-IEBWSBKVSA-N 2 0 349.519 2.693 20 10 EFCDRP Oc1cc(C(F)(F)F)ccc1CN1CCOC[C@@]2(CCC[NH2+]C2)C1 ZINC001235023723 1313226382 /nfs/dbraw/zinc/22/63/82/1313226382.db2.gz WGSMFUYCVAUMMX-MRXNPFEDSA-N 2 0 344.377 2.613 20 10 EFCDRP COc1ccc2c(c1)C1(CC[NH2+]CC1)N(Cc1ccc(N)cc1)CC2 ZINC001235020311 1313225703 /nfs/dbraw/zinc/22/57/03/1313225703.db2.gz SEZJZJKXSMHOMU-UHFFFAOYSA-N 2 0 337.467 2.914 20 10 EFCDRP Cc1cccc2c1CC[N@H+](Cc1ccc(N3CC[NH2+]CC3)cc1O)C2 ZINC001205164888 1313243619 /nfs/dbraw/zinc/24/36/19/1313243619.db2.gz UWARTPAQQRFXHO-UHFFFAOYSA-N 2 0 337.467 2.669 20 10 EFCDRP COc1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CC[NH2+]CC3)cc1)C2 ZINC001205164690 1313243807 /nfs/dbraw/zinc/24/38/07/1313243807.db2.gz NROBYIZUCQMJHE-UHFFFAOYSA-N 2 0 337.467 2.663 20 10 EFCDRP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)Cc2ccccc21 ZINC001205164832 1313244237 /nfs/dbraw/zinc/24/42/37/1313244237.db2.gz SGHUEYUTYHMVOK-INIZCTEOSA-N 2 0 337.467 2.921 20 10 EFCDRP C[NH+](C)CCN[C@@]12CC[C@@]([NH2+]Cc3cc(F)ccc3O)(C1)CCC2 ZINC001275913853 1296448760 /nfs/dbraw/zinc/44/87/60/1296448760.db2.gz RTFDKUHTGJSWJR-RBUKOAKNSA-N 2 0 335.467 2.618 20 10 EFCDRP C[C@]1([NH3+])CCC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)CC1 ZINC001205266418 1313262386 /nfs/dbraw/zinc/26/23/86/1313262386.db2.gz UIGPMOSAIXYKEC-FQEVSTJZSA-N 2 0 329.488 2.794 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@](C)([NH3+])CC3)cc2)CC1 ZINC001205273180 1313262884 /nfs/dbraw/zinc/26/28/84/1313262884.db2.gz HBLDHXMFNXXZLF-FQEVSTJZSA-N 3 0 330.520 2.532 20 10 EFCDRP C[C@H]1CC[N@H+](Cc2cc3c4c(c2O)CCCN4CCC3)C[C@H]1C[NH3+] ZINC001205303366 1313267187 /nfs/dbraw/zinc/26/71/87/1313267187.db2.gz DAZNDWSHLIDHFH-WMLDXEAASA-N 2 0 329.488 2.508 20 10 EFCDRP F[C@@H]1CC[NH2+]C[C@@]12CC[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235401879 1313312654 /nfs/dbraw/zinc/31/26/54/1313312654.db2.gz HKZBCNKDGRONIQ-TZIWHRDSSA-N 2 0 343.490 2.909 20 10 EFCDRP F[C@H]1CC[NH2+]C[C@]12CC[N@H+](Cc1cc3c4c(c1)CCCN4CCC3)C2 ZINC001235401874 1313312813 /nfs/dbraw/zinc/31/28/13/1313312813.db2.gz HKZBCNKDGRONIQ-FPOVZHCZSA-N 2 0 343.490 2.909 20 10 EFCDRP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001205726632 1313345555 /nfs/dbraw/zinc/34/55/55/1313345555.db2.gz VZEWCGXMPJGYQM-FQEVSTJZSA-N 2 0 326.440 2.735 20 10 EFCDRP COc1cccc(C[N@H+](C)Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001235662944 1313368511 /nfs/dbraw/zinc/36/85/11/1313368511.db2.gz FUMZYOFLOKUDCB-UHFFFAOYSA-N 2 0 325.456 2.737 20 10 EFCDRP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001205904889 1313373755 /nfs/dbraw/zinc/37/37/55/1313373755.db2.gz XXZVFCOVAAKJHZ-HOCLYGCPSA-N 2 0 329.488 2.650 20 10 EFCDRP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001205904890 1313373809 /nfs/dbraw/zinc/37/38/09/1313373809.db2.gz XXZVFCOVAAKJHZ-ZBFHGGJFSA-N 2 0 329.488 2.650 20 10 EFCDRP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1cc2c3c(c1O)CCCN3CCC2 ZINC001205904887 1313373876 /nfs/dbraw/zinc/37/38/76/1313373876.db2.gz XXZVFCOVAAKJHZ-GDBMZVCRSA-N 2 0 329.488 2.650 20 10 EFCDRP C[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)CCC[C@H]1C[NH3+] ZINC001205984258 1313386364 /nfs/dbraw/zinc/38/63/64/1313386364.db2.gz RRKWVXWXAVAGJN-NEPJUHHUSA-N 2 0 327.266 2.962 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc(O)c(Br)cc2O)CCC[C@@H]1C[NH3+] ZINC001206024572 1313393375 /nfs/dbraw/zinc/39/33/75/1313393375.db2.gz KIEMZKPDMNCMIX-WDEREUQCSA-N 2 0 343.265 2.667 20 10 EFCDRP CC(C)(C)c1cccc(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c1O ZINC001235814201 1313403845 /nfs/dbraw/zinc/40/38/45/1313403845.db2.gz AQNRAOCBNYKCHY-UHFFFAOYSA-N 2 0 345.531 2.949 20 10 EFCDRP Cc1cc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c(O)cc1Br ZINC001235959342 1313423060 /nfs/dbraw/zinc/42/30/60/1313423060.db2.gz OFFGGAVQAOTOKC-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP [NH3+]C1CN([C@H]2CCC[N@H+](Cc3cccc(-c4ccccc4)c3O)C2)C1 ZINC001236076540 1313438599 /nfs/dbraw/zinc/43/85/99/1313438599.db2.gz BGYDDAHORBLEGU-IBGZPJMESA-N 2 0 337.467 2.667 20 10 EFCDRP C[N@H+](Cc1cc2c3c(c1O)CCCN3CCC2)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236216885 1313457573 /nfs/dbraw/zinc/45/75/73/1313457573.db2.gz LVWDKMYYUFAVEI-ROUUACIJSA-N 2 0 329.488 2.793 20 10 EFCDRP C[C@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCOCC3)cc2F)C1 ZINC001206556886 1313475700 /nfs/dbraw/zinc/47/57/00/1313475700.db2.gz ZGZHRXLRJWJAEB-LJQANCHMSA-N 2 0 335.467 2.613 20 10 EFCDRP CC(C)CN(Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236477535 1313486025 /nfs/dbraw/zinc/48/60/25/1313486025.db2.gz GVCSEQIORJPZEX-OAQYLSRUSA-N 2 0 344.547 2.648 20 10 EFCDRP CCOC(=O)c1c(CN2C[C@H](C[NH3+])CC[C@@H]2C)c2ccccc2n1C ZINC001206811152 1313514802 /nfs/dbraw/zinc/51/48/02/1313514802.db2.gz QYXDJNTVEZVKLV-GJZGRUSLSA-N 2 0 343.471 2.914 20 10 EFCDRP C[NH+](C)CC1CC[NH+](Cc2cc(O)c(Br)cc2O)CC1 ZINC001236774699 1313526923 /nfs/dbraw/zinc/52/69/23/1313526923.db2.gz HLZHEJUZPKJBEX-UHFFFAOYSA-N 2 0 343.265 2.634 20 10 EFCDRP CCN(Cc1ccncc1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236929207 1313555704 /nfs/dbraw/zinc/55/57/04/1313555704.db2.gz BEXXMRCWYNEJMZ-UHFFFAOYSA-N 2 0 342.462 2.995 20 10 EFCDRP C[C@H]1C[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3F)CC[C@H]2O1 ZINC001236933981 1313556626 /nfs/dbraw/zinc/55/66/26/1313556626.db2.gz BDVFMQMDVHPBNE-RIFZZMRRSA-N 2 0 347.478 2.577 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@]4(CCOC4)C3)c(F)c2)CC1 ZINC001236935620 1313557028 /nfs/dbraw/zinc/55/70/28/1313557028.db2.gz IRTNFCOWIQOPPU-HXUWFJFHSA-N 2 0 347.478 2.580 20 10 EFCDRP C[NH+](C)CCN(Cc1ccc(C(C)(C)C)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236934762 1313557060 /nfs/dbraw/zinc/55/70/60/1313557060.db2.gz YQFHTWOBYCOWKE-GOSISDBHSA-N 2 0 333.520 2.805 20 10 EFCDRP C[N@H+](CCc1cccnc1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236935208 1313557240 /nfs/dbraw/zinc/55/72/40/1313557240.db2.gz DXRZFZXLSIZURC-UHFFFAOYSA-N 2 0 342.462 2.647 20 10 EFCDRP CCCOC1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)CC1 ZINC001236940768 1313557352 /nfs/dbraw/zinc/55/73/52/1313557352.db2.gz UBZOYGUPVOESGF-UHFFFAOYSA-N 2 0 349.494 2.969 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(C(F)(F)F)ccc1O)[C@H]1CCC[NH2+]C1 ZINC001236934612 1313557619 /nfs/dbraw/zinc/55/76/19/1313557619.db2.gz XNAPQUCCUZOSFR-HNNXBMFYSA-N 2 0 345.409 2.527 20 10 EFCDRP CO[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@@H](C)C1 ZINC001236944811 1313558775 /nfs/dbraw/zinc/55/87/75/1313558775.db2.gz GEOIFUZTXBYONK-YJBOKZPZSA-N 2 0 335.467 2.577 20 10 EFCDRP CO[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)[C@H](C)C1 ZINC001236944808 1313558804 /nfs/dbraw/zinc/55/88/04/1313558804.db2.gz GEOIFUZTXBYONK-QAPCUYQASA-N 2 0 335.467 2.577 20 10 EFCDRP Cc1cc(C)c(C[N@H+]2CCC[C@@]3(CCN(CC[NH+](C)C)C3)C2)c(O)c1 ZINC001276365578 1299017178 /nfs/dbraw/zinc/01/71/78/1299017178.db2.gz RGWNNFYGPQRNHN-NRFANRHFSA-N 2 0 345.531 2.859 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCC3(C[NH+](C)C3)CC2)cc1Br ZINC001237683452 1313690650 /nfs/dbraw/zinc/69/06/50/1313690650.db2.gz ZVGAEULPGJMHNX-UHFFFAOYSA-N 2 0 339.277 2.991 20 10 EFCDRP CC[N@H+]([C@@H]1CCOC1)C1CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238065924 1313754404 /nfs/dbraw/zinc/75/44/04/1313754404.db2.gz CKIVOJJVAAUOBM-GOSISDBHSA-N 2 0 336.451 2.915 20 10 EFCDRP Cc1c(C[N@@H+]2CC[C@H]3CN(CC[NH+](C)C)C[C@H]32)c2ccccc2n1C ZINC001276557117 1313852021 /nfs/dbraw/zinc/85/20/21/1313852021.db2.gz VPFHYPNBXVRUPX-LAUBAEHRSA-N 2 0 340.515 2.554 20 10 EFCDRP c1c(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc2c3c1CCCN3CCC2 ZINC001222629431 1311163414 /nfs/dbraw/zinc/16/34/14/1311163414.db2.gz GOQIBKYVXFDLEF-BGYRXZFFSA-N 2 0 325.500 2.817 20 10 EFCDRP c1ccc2c(c1)NC[C@H]1C[N@@H+](Cc3ccc(N4CC[NH2+]CC4)cc3)C[C@H]21 ZINC001224117770 1311344813 /nfs/dbraw/zinc/34/48/13/1311344813.db2.gz CVUNNBXLOOGSRS-RXVVDRJESA-N 2 0 348.494 2.737 20 10 EFCDRP Cc1cc(F)cc(C[NH+]2C[C@@H]3CC[N@H+](CCN(C)C)CC[C@@H]3C2)c1O ZINC001277519949 1312500005 /nfs/dbraw/zinc/50/00/05/1312500005.db2.gz RRHHHJGJBXCRPO-CALCHBBNSA-N 2 0 349.494 2.545 20 10 EFCDRP COc1cc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c(O)cc1O ZINC001231636385 1312537119 /nfs/dbraw/zinc/53/71/19/1312537119.db2.gz UHJPZGDNYPEIOC-INIZCTEOSA-N 2 0 334.460 2.947 20 10 EFCDRP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)c(Cl)c3)C[C@@H]2C1 ZINC001232196767 1312647383 /nfs/dbraw/zinc/64/73/83/1312647383.db2.gz LSUUERXMILPABQ-SJORKVTESA-N 2 0 349.906 2.560 20 10 EFCDRP CN(CCC[NH+](C)C)Cc1ccc(N2CCOCC2)c(Cl)c1 ZINC001232198130 1312647418 /nfs/dbraw/zinc/64/74/18/1312647418.db2.gz IYFAQNBLFUPOSX-UHFFFAOYSA-N 2 0 325.884 2.560 20 10 EFCDRP C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246173394 1314593130 /nfs/dbraw/zinc/59/31/30/1314593130.db2.gz LXHKYYBOSGUEAK-INIZCTEOSA-N 2 0 327.447 2.956 20 10 EFCDRP COc1cccc(C[C@@H](C)[NH2+]Cc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001246174998 1314593587 /nfs/dbraw/zinc/59/35/87/1314593587.db2.gz RELIPZJJQIJXGE-QGZVFWFLSA-N 2 0 339.483 2.826 20 10 EFCDRP C[C@H]1CC[C@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C[NH2+]1 ZINC001246339619 1314612892 /nfs/dbraw/zinc/61/28/92/1314612892.db2.gz GJRDXSMHOABYBI-AFHBHXEDSA-N 2 0 341.455 2.569 20 10 EFCDRP C[NH+](C)Cc1ccc2[nH]c(-c3ccc(N4CC[NH2+]CC4)cc3)nc2c1 ZINC001247021544 1314732532 /nfs/dbraw/zinc/73/25/32/1314732532.db2.gz RAVINODPSQDYCJ-UHFFFAOYSA-N 2 0 335.455 2.701 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3CCC[C@]34CC[NH2+]C4)cc2)CC1 ZINC001218095181 1315147498 /nfs/dbraw/zinc/14/74/98/1315147498.db2.gz GVFUUHAIQCJAAS-WOJBJXKFSA-N 2 0 329.488 2.740 20 10 EFCDRP CCc1ccc(C[N@H+]2C[C@@H]3CC[NH+](CCN(C)C)CC[C@@H]3C2)c(O)c1 ZINC001276804666 1315311469 /nfs/dbraw/zinc/31/14/69/1315311469.db2.gz JTLPUIJFRPHTDD-KDURUIRLSA-N 2 0 345.531 2.660 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)c2ccccc2)CC1 ZINC001252008573 1315403843 /nfs/dbraw/zinc/40/38/43/1315403843.db2.gz HJXPFWAHVFVVTR-FQEVSTJZSA-N 2 0 326.440 2.680 20 10 EFCDRP CC(C)c1ccc(C[NH+]2CC3(C2)CCN(CC[NH+](C)C)C3)c(O)c1 ZINC001276814760 1315431727 /nfs/dbraw/zinc/43/17/27/1315431727.db2.gz LZGFIRYYRQIJDL-UHFFFAOYSA-N 2 0 331.504 2.585 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC([NH2+]C[C@H](O)c2ccc(F)cc2)CC1 ZINC001252865514 1315518360 /nfs/dbraw/zinc/51/83/60/1315518360.db2.gz IWEFXKMSZLBYCJ-FQEVSTJZSA-N 2 0 344.430 2.819 20 10 EFCDRP Oc1ccccc1C[NH+]1CCC(NC2CC[NH+](C3CC3)CC2)CC1 ZINC001256071934 1315899059 /nfs/dbraw/zinc/89/90/59/1315899059.db2.gz DCDLSNUMFKMGNI-UHFFFAOYSA-N 2 0 329.488 2.573 20 10 EFCDRP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC001320245944 1329105799 /nfs/dbraw/zinc/10/57/99/1329105799.db2.gz KNUHNWLWMPXBMX-DLBZAZTESA-N 2 0 331.504 2.866 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(O)c(F)c3)cc2)CC1 ZINC001355346747 1334749239 /nfs/dbraw/zinc/74/92/39/1334749239.db2.gz WZXHBPMDFYDUAW-UHFFFAOYSA-N 2 0 329.419 2.573 20 10 EFCDRP CCc1cccc(C[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1O ZINC000848901288 1334972508 /nfs/dbraw/zinc/97/25/08/1334972508.db2.gz REYLEBFUIUWKHQ-UHFFFAOYSA-N 2 0 329.444 2.580 20 10 EFCDRP CCc1cccc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c1O ZINC000848899985 1334972543 /nfs/dbraw/zinc/97/25/43/1334972543.db2.gz WIACSLXFQUVSGG-MOPGFXCFSA-N 2 0 332.488 2.812 20 10 EFCDRP COc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(O)c1OC ZINC000891746561 714992882 /nfs/dbraw/zinc/99/28/82/714992882.db2.gz VSGHKSMQOCWFGH-UHFFFAOYSA-N 2 0 336.476 2.962 20 10 EFCDRP Cc1cc(O)c(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1C ZINC000092665083 715115972 /nfs/dbraw/zinc/11/59/72/715115972.db2.gz RHHOMXJOULZJCT-KDURUIRLSA-N 2 0 345.531 2.999 20 10 EFCDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000158256789 715490313 /nfs/dbraw/zinc/49/03/13/715490313.db2.gz JCZMEXBCGTYKEH-HOTGVXAUSA-N 2 0 335.467 2.655 20 10 EFCDRP C[N@H+](CCN1CC[NH+](Cc2ccccc2O)CC1)Cc1ccccc1 ZINC000179570698 717790725 /nfs/dbraw/zinc/79/07/25/717790725.db2.gz YHWVOPQMLRAULE-UHFFFAOYSA-N 2 0 339.483 2.642 20 10 EFCDRP CC1(C)[NH2+]CC[C@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000925577379 720470970 /nfs/dbraw/zinc/47/09/70/720470970.db2.gz NOJFKXSPQIGANF-MRXNPFEDSA-N 2 0 339.430 2.987 20 10 EFCDRP COc1cccc(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1O ZINC000237222320 723295960 /nfs/dbraw/zinc/29/59/60/723295960.db2.gz JPXRRQYVPHUCHB-UHFFFAOYSA-N 2 0 330.428 2.631 20 10 EFCDRP COc1ccc(C[N@@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)c(O)c1OC ZINC000895508082 724163952 /nfs/dbraw/zinc/16/39/52/724163952.db2.gz DXDVRVLZLVFTIK-ZBFHGGJFSA-N 2 0 336.476 2.962 20 10 EFCDRP C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1cccc(C[NH3+])c1 ZINC001578489881 1090385223 /nfs/dbraw/zinc/38/52/23/1090385223.db2.gz SCMNZFYARCPYSI-UHFFFAOYSA-N 2 0 325.456 2.614 20 10 EFCDRP Cc1c[nH]c2nc(NCc3ccc(N4CC[NH+](C)CC4)cc3)ncc12 ZINC001167426884 1101586106 /nfs/dbraw/zinc/58/61/06/1101586106.db2.gz MXEYNCWUUVQCON-UHFFFAOYSA-N 2 0 336.443 2.582 20 10 EFCDRP C[NH+]1CCN(c2ccc(CNc3ccc(C4([NH3+])CC4)cc3)cc2)CC1 ZINC001167434470 1101662231 /nfs/dbraw/zinc/66/22/31/1101662231.db2.gz LPWHFTDGJMJITE-UHFFFAOYSA-N 2 0 336.483 2.998 20 10 EFCDRP COc1cc(Br)cc(C[NH2+]CC2([NH3+])CCCCC2)c1O ZINC000841039668 1102867757 /nfs/dbraw/zinc/86/77/57/1102867757.db2.gz YMDLZLFWZRHNBQ-UHFFFAOYSA-N 2 0 343.265 2.915 20 10 EFCDRP [NH3+]CC1(N(Cc2ccccc2)c2ccc(C3([NH3+])CCC3)cc2)COC1 ZINC001167374424 1102916874 /nfs/dbraw/zinc/91/68/74/1102916874.db2.gz DKXAZTHPZNDZHS-UHFFFAOYSA-N 2 0 337.467 2.759 20 10 EFCDRP CN(C)c1ccc([C@@H](CNC2CC[NH+](C3CC3)CC2)[NH+](C)C)cc1 ZINC000898449333 1108943303 /nfs/dbraw/zinc/94/33/03/1108943303.db2.gz BPZDEFPOUOKITK-HXUWFJFHSA-N 2 0 330.520 2.572 20 10 EFCDRP CN(C)c1ccc([C@H](CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)[NH+](C)C)cc1 ZINC000898450137 1108944320 /nfs/dbraw/zinc/94/43/20/1108944320.db2.gz OGYWDEGGMCDWRT-RLLQIKCJSA-N 2 0 330.520 2.572 20 10 EFCDRP Cc1cc(Br)cc(C[N@H+](C)C[C@@H]2CCC[NH2+]C2)c1O ZINC001235957047 1111932827 /nfs/dbraw/zinc/93/28/27/1111932827.db2.gz KCAGBAXQOGCZNG-GFCCVEGCSA-N 2 0 327.266 2.895 20 10 EFCDRP CCN(C)c1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(C)CC2)cc1 ZINC000154357150 1112021663 /nfs/dbraw/zinc/02/16/63/1112021663.db2.gz RYMHPAHIFBXBJP-GOSISDBHSA-N 2 0 332.536 2.821 20 10 EFCDRP COc1cc(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1OC ZINC000160459173 239052532 /nfs/dbraw/zinc/05/25/32/239052532.db2.gz VZUDEJVNIXEDLJ-PBHICJAKSA-N 2 0 346.471 2.858 20 10 EFCDRP C[NH+]1CCN(CCC[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000263900677 240392354 /nfs/dbraw/zinc/39/23/54/240392354.db2.gz WAERYWMRUJFNFX-UHFFFAOYSA-N 2 0 339.483 2.786 20 10 EFCDRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCc3cccc(O)c32)ccn1 ZINC000297080122 241109845 /nfs/dbraw/zinc/10/98/45/241109845.db2.gz WSYKALLQAUFMTL-MRXNPFEDSA-N 2 0 327.428 2.505 20 10 EFCDRP Oc1cccc(Cl)c1C[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000295522311 241056709 /nfs/dbraw/zinc/05/67/09/241056709.db2.gz VVZVTUAUBBJODZ-INIZCTEOSA-N 2 0 346.858 2.902 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c(O)c1 ZINC000185042354 473309273 /nfs/dbraw/zinc/30/92/73/473309273.db2.gz OGGVVKXRGBQWQH-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)c(O)c1 ZINC000185166051 473349097 /nfs/dbraw/zinc/34/90/97/473349097.db2.gz MHMJTXWNLFRJEK-INIZCTEOSA-N 2 0 340.471 2.698 20 10 EFCDRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccccc1O ZINC000185207538 473362459 /nfs/dbraw/zinc/36/24/59/473362459.db2.gz HNKUPORFZMENNH-GOSISDBHSA-N 2 0 340.471 2.780 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCCN2CCC[N@H+](C)CC2)cc1 ZINC000128281847 472429064 /nfs/dbraw/zinc/42/90/64/472429064.db2.gz YAOZGIOZSDUPBF-SFHVURJKSA-N 2 0 332.536 2.821 20 10 EFCDRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000154885168 472483679 /nfs/dbraw/zinc/48/36/79/472483679.db2.gz PSRXLAYUXQADLY-OALUTQOASA-N 2 0 344.547 2.963 20 10 EFCDRP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(N(C)C)cc1 ZINC000132857867 472759514 /nfs/dbraw/zinc/75/95/14/472759514.db2.gz KAQOJBNIGFYUIF-SJORKVTESA-N 2 0 331.504 2.904 20 10 EFCDRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(Cl)ccc1O ZINC000185366719 473407479 /nfs/dbraw/zinc/40/74/79/473407479.db2.gz DLYSTKPBXWYHAG-CQSZACIVSA-N 2 0 325.884 2.724 20 10 EFCDRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000185647722 473477091 /nfs/dbraw/zinc/47/70/91/473477091.db2.gz RFORYVMKJAPLCG-ZDUSSCGKSA-N 2 0 325.884 2.722 20 10 EFCDRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1O ZINC000186127719 473596440 /nfs/dbraw/zinc/59/64/40/473596440.db2.gz CFPSLZNNVZSFOR-IXDGSTSKSA-N 2 0 336.451 2.950 20 10 EFCDRP C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000127307439 473598622 /nfs/dbraw/zinc/59/86/22/473598622.db2.gz SZJRDBMGJNQJHA-OALUTQOASA-N 2 0 344.547 2.963 20 10 EFCDRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000186592502 473695566 /nfs/dbraw/zinc/69/55/66/473695566.db2.gz BPLQPCRVHXULMJ-KBPBESRZSA-N 2 0 325.884 2.722 20 10 EFCDRP COc1ccc(O)c(C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000179884101 473748811 /nfs/dbraw/zinc/74/88/11/473748811.db2.gz DCYGSLQEOLWNNP-IYBDPMFKSA-N 2 0 348.487 2.722 20 10 EFCDRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cc(F)ccc3O)CC2)C[C@@H](C)O1 ZINC000180001243 473773527 /nfs/dbraw/zinc/77/35/27/473773527.db2.gz CJEJQXKNHWWJML-HUUCEWRRSA-N 2 0 336.451 2.853 20 10 EFCDRP Oc1ccc(Br)cc1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000227437232 474246114 /nfs/dbraw/zinc/24/61/14/474246114.db2.gz GFUJDVMTBJUZKB-NSHDSACASA-N 2 0 325.250 2.729 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CNc3ccnc(C)n3)cc2F)CC1 ZINC000266192741 474425145 /nfs/dbraw/zinc/42/51/45/474425145.db2.gz CCOCKFGJEISGNK-UHFFFAOYSA-N 2 0 329.423 2.678 20 10 EFCDRP Cc1ccc(O)c(C[N@@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000190322389 474579043 /nfs/dbraw/zinc/57/90/43/474579043.db2.gz MUVUNEQVAFZASK-OAQYLSRUSA-N 2 0 340.467 2.769 20 10 EFCDRP CCN(CC)c1ccc(C[N@H+](C)CCCN2CC[NH+](C)CC2)cc1 ZINC000272567998 474618446 /nfs/dbraw/zinc/61/84/46/474618446.db2.gz CQKLRCFHVJEIBL-UHFFFAOYSA-N 2 0 332.536 2.602 20 10 EFCDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1C ZINC000368328314 477798059 /nfs/dbraw/zinc/79/80/59/477798059.db2.gz OTIOJDDOQRTZHL-DLBZAZTESA-N 2 0 331.504 2.828 20 10 EFCDRP C[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1cc(Cl)ccc1O ZINC000368328339 477798504 /nfs/dbraw/zinc/79/85/04/477798504.db2.gz OXXABPXTZANBPC-HIFRSBDPSA-N 2 0 337.895 2.865 20 10 EFCDRP CCO[C@@H](CC[NH+](C)C)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000165990982 527718503 /nfs/dbraw/zinc/71/85/03/527718503.db2.gz MIHOECMJMMVJIS-FQEVSTJZSA-N 2 0 349.519 2.610 20 10 EFCDRP CCN(C)c1ccc([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cc1 ZINC000160177630 527869847 /nfs/dbraw/zinc/86/98/47/527869847.db2.gz VRXOZTNGWYEQNV-KRWDZBQOSA-N 2 0 332.536 2.819 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2c1c(F)ccc2O ZINC000756395903 575730273 /nfs/dbraw/zinc/73/02/73/575730273.db2.gz KUKKDQQHQICREU-BBRMVZONSA-N 2 0 335.467 2.695 20 10 EFCDRP C[C@H]1C[C@H]([NH2+]CC(C)(C)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756400031 575731274 /nfs/dbraw/zinc/73/12/74/575731274.db2.gz UHHYGYUYNVYSRC-ZFWWWQNUSA-N 2 0 335.467 2.695 20 10 EFCDRP CC[NH+]1CCN(CCC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000756408614 575732636 /nfs/dbraw/zinc/73/26/36/575732636.db2.gz QDSYHLLYMQQEHM-GOEBONIOSA-N 2 0 335.467 2.697 20 10 EFCDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3c(cc2O)OC[C@@H]3O)CC1 ZINC000768449733 577275052 /nfs/dbraw/zinc/27/50/52/577275052.db2.gz ZSWIFMCHZDWCIL-IBGZPJMESA-N 2 0 348.487 2.762 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(OC)c(C)cc2O)C1 ZINC000768465796 577276318 /nfs/dbraw/zinc/27/63/18/577276318.db2.gz LQSFVLMDBLGKON-KRWDZBQOSA-N 2 0 336.476 2.642 20 10 EFCDRP CCOc1ccc(C[N@@H+]2CC[C@H](OCC[NH+](CC)CC)C2)c(O)c1 ZINC000769514300 577368838 /nfs/dbraw/zinc/36/88/38/577368838.db2.gz IXTVYNQITKNXOW-SFHVURJKSA-N 2 0 336.476 2.724 20 10 EFCDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000769513608 577368956 /nfs/dbraw/zinc/36/89/56/577368956.db2.gz CXLSCKAOWFVVKW-AWEZNQCLSA-N 2 0 326.868 2.978 20 10 EFCDRP CO[C@]1(C)C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000771841072 581249627 /nfs/dbraw/zinc/24/96/27/581249627.db2.gz DEQWKVOHURPVPN-AZUAARDMSA-N 2 0 331.504 2.732 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CCO)c3ccccc3)cc2)CC1 ZINC000771842299 581249635 /nfs/dbraw/zinc/24/96/35/581249635.db2.gz MEYVHILXXGIKTI-OAQYLSRUSA-N 2 0 339.483 2.652 20 10 EFCDRP CO[C@@]1(C)C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1(C)C ZINC000771841074 581249644 /nfs/dbraw/zinc/24/96/44/581249644.db2.gz DEQWKVOHURPVPN-ICSRJNTNSA-N 2 0 331.504 2.732 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000771847937 581250311 /nfs/dbraw/zinc/25/03/11/581250311.db2.gz SCJHSQYUNAJJBK-GOSISDBHSA-N 2 0 329.488 2.630 20 10 EFCDRP CCN(C)c1ccc(C[N@@H+]2CC[C@@H](N3CC[NH+](C)CC3)[C@@H](C)C2)cc1 ZINC000773823587 581466437 /nfs/dbraw/zinc/46/64/37/581466437.db2.gz UWLMHUKZQQIGCL-GHTZIAJQSA-N 2 0 344.547 2.601 20 10 EFCDRP C[C@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)cc(F)c1[O-] ZINC000774381327 581490571 /nfs/dbraw/zinc/49/05/71/581490571.db2.gz LYDOYWIJRJTNFZ-JTQLQIEISA-N 2 0 349.244 2.523 20 10 EFCDRP COc1cccc(O)c1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000850361825 1250451255 /nfs/dbraw/zinc/45/12/55/1250451255.db2.gz FQXMRXTULGZKMD-UHFFFAOYSA-N 2 0 341.455 2.798 20 10 EFCDRP CC[NH+](CC)CCOCC[NH2+]Cc1ccc(Br)cc1O ZINC000825510282 1278577652 /nfs/dbraw/zinc/57/76/52/1278577652.db2.gz ZFAYVSLKJGRXBP-UHFFFAOYSA-N 2 0 345.281 2.603 20 10 EFCDRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cc(Br)ccc1O)C2 ZINC001169107494 1272700473 /nfs/dbraw/zinc/70/04/73/1272700473.db2.gz IBFUFJFCFLVKOX-BTTYYORXSA-N 2 0 325.250 2.870 20 10 EFCDRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817893518 1276363086 /nfs/dbraw/zinc/36/30/86/1276363086.db2.gz GGRJAVDZMNCSJR-UWJYYQICSA-N 2 0 339.483 2.571 20 10 EFCDRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817896150 1276365008 /nfs/dbraw/zinc/36/50/08/1276365008.db2.gz YRJLAHLGTOIIEJ-UXHICEINSA-N 2 0 331.504 2.645 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN[C@H](C)[C@H]3CCCC[NH2+]3)cc2F)CC1 ZINC000817902370 1276367048 /nfs/dbraw/zinc/36/70/48/1276367048.db2.gz OXXJXSNAWRRHJD-VQIMIIECSA-N 2 0 348.510 2.588 20 10 EFCDRP C[C@H](C[C@H](C)[NH3+])[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000817903206 1276367066 /nfs/dbraw/zinc/36/70/66/1276367066.db2.gz KFCRUMRCQFRBKQ-QWHCGFSZSA-N 2 0 327.419 2.972 20 10 EFCDRP C[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCC[NH2+]1 ZINC000817903922 1276368875 /nfs/dbraw/zinc/36/88/75/1276368875.db2.gz XBZQHLAIADPFGZ-CXAGYDPISA-N 2 0 339.430 2.987 20 10 EFCDRP C[C@@H]([NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCC[NH2+]1 ZINC000817903923 1276368927 /nfs/dbraw/zinc/36/89/27/1276368927.db2.gz XBZQHLAIADPFGZ-DYVFJYSZSA-N 2 0 339.430 2.987 20 10 EFCDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCN1CC[NH2+]CC1 ZINC000817944699 1276389800 /nfs/dbraw/zinc/38/98/00/1276389800.db2.gz JVPVMTXJBRNKDW-HXUWFJFHSA-N 2 0 339.483 2.561 20 10 EFCDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817947761 1276390883 /nfs/dbraw/zinc/39/08/83/1276390883.db2.gz QJUZCNWYSPGXCK-ZOBUZTSGSA-N 2 0 335.467 2.701 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccc(N2CCOCC2)c(F)c1 ZINC000817959541 1276399270 /nfs/dbraw/zinc/39/92/70/1276399270.db2.gz GXWXFEZYHWBSOI-QILLFSRXSA-N 2 0 335.467 2.830 20 10 EFCDRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cc(Br)ccc1O ZINC000817976929 1276415491 /nfs/dbraw/zinc/41/54/91/1276415491.db2.gz XDEQEMRTHFGREJ-IINYFYTJSA-N 2 0 325.250 2.947 20 10 EFCDRP Cc1cc(C[N@@H+]2CC[C@H](N3CC[NH+](C)CC3)[C@H](C)C2)ccc1N(C)C ZINC000815078041 1287302038 /nfs/dbraw/zinc/30/20/38/1287302038.db2.gz LZPUSWSABYUTGG-NQIIRXRSSA-N 2 0 344.547 2.519 20 10 EFCDRP C[C@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1CC[NH3+] ZINC000844900646 1279322411 /nfs/dbraw/zinc/32/24/11/1279322411.db2.gz CAOWEBXQLYLTQZ-MAUKXSAKSA-N 2 0 335.467 2.612 20 10 EFCDRP [NH3+]CC1(CC[NH2+]Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 ZINC000844903591 1279324830 /nfs/dbraw/zinc/32/48/30/1279324830.db2.gz HCYNUHNUWBVVEB-UHFFFAOYSA-N 2 0 332.448 2.804 20 10 EFCDRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)c(F)c1 ZINC000844904395 1279325542 /nfs/dbraw/zinc/32/55/42/1279325542.db2.gz KNPHGMCRZGIJJQ-UHFFFAOYSA-N 2 0 347.409 2.550 20 10 EFCDRP CO[C@]1(C)CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000793339883 1279559279 /nfs/dbraw/zinc/55/92/79/1279559279.db2.gz NMMXPZMNTCPENX-HXUWFJFHSA-N 2 0 331.504 2.829 20 10 EFCDRP C[N@@H+](Cc1c(O)cc(O)cc1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001144514438 1279773920 /nfs/dbraw/zinc/77/39/20/1279773920.db2.gz DGGXIGVCCIHXPG-MRXNPFEDSA-N 2 0 342.439 2.757 20 10 EFCDRP COc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c1O ZINC000846156062 1280039162 /nfs/dbraw/zinc/03/91/62/1280039162.db2.gz RWOZXJLXCXSSQD-OAGGEKHMSA-N 2 0 336.476 2.941 20 10 EFCDRP COc1cccc([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)c1O ZINC000846156676 1280040811 /nfs/dbraw/zinc/04/08/11/1280040811.db2.gz GWVNCKZXSFXNTI-CQSZACIVSA-N 2 0 345.443 2.587 20 10 EFCDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)CN2CC[NH+](C)CC2)c1O ZINC000808693336 1281847483 /nfs/dbraw/zinc/84/74/83/1281847483.db2.gz GJUKYNSHSBAHES-KGLIPLIRSA-N 2 0 325.884 2.641 20 10 EFCDRP CCOc1ccc(CN(CC[NH+](C)C)C[C@@H]2CCC[N@@H+]2CC)c(O)c1 ZINC000809738397 1282437676 /nfs/dbraw/zinc/43/76/76/1282437676.db2.gz XEMGZFMRCADSCT-SFHVURJKSA-N 2 0 349.519 2.639 20 10 EFCDRP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809750297 1282449096 /nfs/dbraw/zinc/44/90/96/1282449096.db2.gz SZUJVRVLWIGDHK-UHFFFAOYSA-N 3 0 344.547 2.746 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCc4occc4C3)cc2)CC1 ZINC000809792852 1282490505 /nfs/dbraw/zinc/49/05/05/1282490505.db2.gz JISZRAWRKHDGNV-UHFFFAOYSA-N 2 0 325.456 2.980 20 10 EFCDRP Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)c(O)c1 ZINC000815578980 1287610020 /nfs/dbraw/zinc/61/00/20/1287610020.db2.gz BRAUZMALVVUSPL-IAGOWNOFSA-N 2 0 331.504 2.828 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(C)(C)[C@@H]3[C@@H]3CCCO3)cc2)CC1 ZINC000811510671 1284390046 /nfs/dbraw/zinc/39/00/46/1284390046.db2.gz MSICSDFXBBWEJZ-PMACEKPBSA-N 2 0 343.515 2.828 20 10 EFCDRP COC(=O)[C@@H]1CCC[C@H]([NH2+]C2CCN(Cc3ccccc3O)CC2)C1 ZINC001172605469 1286198816 /nfs/dbraw/zinc/19/88/16/1286198816.db2.gz XQTUQZAURDSHIO-QAPCUYQASA-N 2 0 346.471 2.678 20 10 EFCDRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816548129 1288198709 /nfs/dbraw/zinc/19/87/09/1288198709.db2.gz WBFGBQGCORUARW-QGZVFWFLSA-N 2 0 341.499 2.909 20 10 EFCDRP CC(C)[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCCO1 ZINC000816675921 1288241339 /nfs/dbraw/zinc/24/13/39/1288241339.db2.gz OPWBZMSGQZKJHC-HXUWFJFHSA-N 2 0 331.504 2.685 20 10 EFCDRP C[C@H]([NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C)C1CC[NH+](C)CC1 ZINC000903448361 1312694789 /nfs/dbraw/zinc/69/47/89/1312694789.db2.gz NSVKSCGUYQCJDN-OXJNMPFZSA-N 2 0 332.536 2.675 20 10 EFCDRP C[NH+]1CCN(C2CC[NH+](Cc3c(O)ccc4ccccc43)CC2)CC1 ZINC000872732510 1289345193 /nfs/dbraw/zinc/34/51/93/1289345193.db2.gz WMUURSXUAYZVLV-UHFFFAOYSA-N 2 0 339.483 2.757 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CSC[C@H]3C)cc2F)CC1 ZINC000823801481 1289461991 /nfs/dbraw/zinc/46/19/91/1289461991.db2.gz GOQCKVVYMGVKLH-PBHICJAKSA-N 2 0 337.508 2.809 20 10 EFCDRP CCCOc1ccc(C[NH2+]C2CCN(CC[NH+](C)C)CC2)cc1C ZINC000873010516 1289517641 /nfs/dbraw/zinc/51/76/41/1289517641.db2.gz KZMNYCNDXGIISP-UHFFFAOYSA-N 2 0 333.520 2.899 20 10 EFCDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000873043890 1289536841 /nfs/dbraw/zinc/53/68/41/1289536841.db2.gz VRZAMDJATABHRE-UHFFFAOYSA-N 2 0 342.487 2.762 20 10 EFCDRP CCCOc1ccc(C[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)cc1C ZINC000873043930 1289537296 /nfs/dbraw/zinc/53/72/96/1289537296.db2.gz WUVGLDVVMQUNHU-KRWDZBQOSA-N 2 0 333.520 2.757 20 10 EFCDRP C[C@@H]1C[C@@H](Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)c2c1c(F)ccc2O ZINC000873243952 1289676556 /nfs/dbraw/zinc/67/65/56/1289676556.db2.gz DUUUQZYDRCIDBA-IUODEOHRSA-N 2 0 342.418 2.996 20 10 EFCDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(N2CCOCC2)c(F)c1 ZINC000873259676 1289687430 /nfs/dbraw/zinc/68/74/30/1289687430.db2.gz JIABAXKJNSARQC-XYVMCAHJSA-N 2 0 347.478 2.844 20 10 EFCDRP COc1ccc(N2CCC([NH2+]C[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC000873260180 1289687451 /nfs/dbraw/zinc/68/74/51/1289687451.db2.gz URIKSIUJPUDPJX-VBUUOAMHSA-N 2 0 329.488 2.784 20 10 EFCDRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC3(CO2)CC[NH2+]CC3)c2c1c(F)ccc2O ZINC000873291973 1289705900 /nfs/dbraw/zinc/70/59/00/1289705900.db2.gz JNDASXUSVRBJMS-VNHYZAJKSA-N 2 0 334.435 2.828 20 10 EFCDRP Cc1cccc(O)c1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000876874971 1291055688 /nfs/dbraw/zinc/05/56/88/1291055688.db2.gz OEARPJGFKXTSHO-UHFFFAOYSA-N 2 0 340.467 2.947 20 10 EFCDRP C[C@H](C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C[NH+]1CCCCC1 ZINC000876948551 1291082129 /nfs/dbraw/zinc/08/21/29/1291082129.db2.gz NNDBJMLLCBLQQA-GOSISDBHSA-N 2 0 345.531 2.859 20 10 EFCDRP Cc1ccc(C[NH2+]Cc2ccncc2OCCC[NH+](C)C)c(O)c1 ZINC000877536078 1291264901 /nfs/dbraw/zinc/26/49/01/1291264901.db2.gz WQUXLAZTHIARNA-UHFFFAOYSA-N 2 0 329.444 2.716 20 10 EFCDRP C[N@H+](CCCC[NH2+]Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000877577984 1291281097 /nfs/dbraw/zinc/28/10/97/1291281097.db2.gz PSQUORDVIDPLLI-UHFFFAOYSA-N 2 0 331.504 2.612 20 10 EFCDRP COc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c(O)c1 ZINC001203627734 1312975089 /nfs/dbraw/zinc/97/50/89/1312975089.db2.gz MIXIZGLLFGFKEH-OALUTQOASA-N 2 0 338.451 2.965 20 10 EFCDRP CCC[NH+](CCC)CCN1CC[NH+](Cc2ccc(OC)cc2O)CC1 ZINC001203628984 1312975672 /nfs/dbraw/zinc/97/56/72/1312975672.db2.gz MCUAQOVLDQEHEU-UHFFFAOYSA-N 2 0 349.519 2.640 20 10 EFCDRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000883290016 1293532718 /nfs/dbraw/zinc/53/27/18/1293532718.db2.gz IHBMGLMGCXCTKY-QUCCMNQESA-N 2 0 331.504 2.733 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ccc(O)cc4C3)cc2)CC1 ZINC000775655194 1293912783 /nfs/dbraw/zinc/91/27/83/1293912783.db2.gz AVQBWFKGBAOUNP-UHFFFAOYSA-N 2 0 337.467 2.702 20 10 EFCDRP CCN(CC)c1ccc(C[NH+]2CCN(CCC[NH+](C)C)CC2)cc1 ZINC001203941612 1313052323 /nfs/dbraw/zinc/05/23/23/1313052323.db2.gz CUYGYLMOIFLJNT-UHFFFAOYSA-N 2 0 332.536 2.602 20 10 EFCDRP C[N@H+](CCC(=O)OC(C)(C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775723034 1294270062 /nfs/dbraw/zinc/27/00/62/1294270062.db2.gz BPPBYULIZJMOIT-UHFFFAOYSA-N 2 0 347.503 2.602 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C4CCOCC4)C3)cc2)CC1 ZINC000775725014 1294285274 /nfs/dbraw/zinc/28/52/74/1294285274.db2.gz FGQVHLACJORFIY-HXUWFJFHSA-N 2 0 343.515 2.687 20 10 EFCDRP C[NH+]1CCN(c2ccc(CN3CCO[C@@H](c4ccco4)C3)cc2)CC1 ZINC000775734713 1294322494 /nfs/dbraw/zinc/32/24/94/1294322494.db2.gz XSIOZZZDTVAZMQ-HXUWFJFHSA-N 2 0 341.455 2.605 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(C(C)(C)C)ccc1O ZINC001276443989 1313089660 /nfs/dbraw/zinc/08/96/60/1313089660.db2.gz BCINEXLGGLQUOL-KDURUIRLSA-N 2 0 345.531 2.900 20 10 EFCDRP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1ccc(N2CCCC2)cc1 ZINC001204322651 1313122451 /nfs/dbraw/zinc/12/24/51/1313122451.db2.gz UVFGLCFIXINMGD-UHFFFAOYSA-N 2 0 346.563 2.992 20 10 EFCDRP CN(C)CC[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001275267036 1296246046 /nfs/dbraw/zinc/24/60/46/1296246046.db2.gz JQBBHWAJDMJCSI-UHFFFAOYSA-N 2 0 331.504 2.632 20 10 EFCDRP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@](O)(C[NH3+])CC2)cc1 ZINC001205220874 1313253326 /nfs/dbraw/zinc/25/33/26/1313253326.db2.gz MWCPWMUOVLVUJW-FQEVSTJZSA-N 2 0 327.472 2.770 20 10 EFCDRP COc1cc(O)c(C[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c(OC)c1 ZINC001235228333 1313269327 /nfs/dbraw/zinc/26/93/27/1313269327.db2.gz LVESVXKCBREMDV-KRWDZBQOSA-N 2 0 334.460 2.764 20 10 EFCDRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2c(O)cccc2Br)CC1 ZINC001205560073 1313313558 /nfs/dbraw/zinc/31/35/58/1313313558.db2.gz ZCFAKTXUGZVUNQ-CQSZACIVSA-N 2 0 331.229 2.808 20 10 EFCDRP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235424393 1313318825 /nfs/dbraw/zinc/31/88/25/1313318825.db2.gz HSOJBOQBSBVCLZ-IRXDYDNUSA-N 2 0 331.504 2.973 20 10 EFCDRP COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235424396 1313319437 /nfs/dbraw/zinc/31/94/37/1313319437.db2.gz HSOJBOQBSBVCLZ-SJORKVTESA-N 2 0 331.504 2.973 20 10 EFCDRP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C[NH3+])[C@@H](C)CC3)cc2)CC1 ZINC001205627230 1313326069 /nfs/dbraw/zinc/32/60/69/1313326069.db2.gz ODVXHNKRNDLCBY-ICSRJNTNSA-N 3 0 344.547 2.635 20 10 EFCDRP COC(=O)c1c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c2ccccc2n1C ZINC001205637893 1313328031 /nfs/dbraw/zinc/32/80/31/1313328031.db2.gz JTHOAGUCOJYASN-HUUCEWRRSA-N 2 0 343.471 2.772 20 10 EFCDRP C[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CCC[C@H]1C[NH3+] ZINC001205984260 1313386096 /nfs/dbraw/zinc/38/60/96/1313386096.db2.gz RRKWVXWXAVAGJN-RYUDHWBXSA-N 2 0 327.266 2.962 20 10 EFCDRP COc1cc(N(C)C)ccc1C[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235706405 1313381552 /nfs/dbraw/zinc/38/15/52/1313381552.db2.gz UNDMSBGVFAVJLF-UHFFFAOYSA-N 2 0 331.504 2.973 20 10 EFCDRP CC(C)(C)c1ccc(C[NH+]2CCN(C3(C)CC[NH2+]CC3)CC2)c(O)c1 ZINC001235823314 1313404859 /nfs/dbraw/zinc/40/48/59/1313404859.db2.gz VNMLAPDWKMEUAL-UHFFFAOYSA-N 2 0 345.531 2.949 20 10 EFCDRP COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC[C@@H]2CCC[NH2+]C2)C1 ZINC001235839436 1313407397 /nfs/dbraw/zinc/40/73/97/1313407397.db2.gz RPIDRXWRQIFHNV-HNNXBMFYSA-N 2 0 327.472 2.935 20 10 EFCDRP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](N3CC([NH3+])C3)C2)c2ccccc21 ZINC001236073571 1313437908 /nfs/dbraw/zinc/43/79/08/1313437908.db2.gz PAVKZCNUDDAMNK-GOSISDBHSA-N 2 0 338.499 2.513 20 10 EFCDRP C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001236072121 1313437932 /nfs/dbraw/zinc/43/79/32/1313437932.db2.gz OEQHUSXONKBSTM-MRXNPFEDSA-N 2 0 337.467 2.749 20 10 EFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](CC)CC2)cc1)C1CC[NH2+]CC1 ZINC001236181844 1313452582 /nfs/dbraw/zinc/45/25/82/1313452582.db2.gz HOPDOCAMUOXMBN-UHFFFAOYSA-N 3 0 344.547 2.793 20 10 EFCDRP C[N@H+](CCc1ccccc1F)Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001236265043 1313462275 /nfs/dbraw/zinc/46/22/75/1313462275.db2.gz HCOMHCMTOJMYGO-UHFFFAOYSA-N 2 0 327.447 2.910 20 10 EFCDRP CC[NH+]1CCN(c2ccc(CN(C3CC3)[C@H]3CCC[NH2+]C3)cc2)CC1 ZINC001236238508 1313459504 /nfs/dbraw/zinc/45/95/04/1313459504.db2.gz FUNJBKBYPPBWGI-NRFANRHFSA-N 2 0 342.531 2.545 20 10 EFCDRP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2ccc(N3CCOCC3)cc2F)C1 ZINC001206556885 1313475825 /nfs/dbraw/zinc/47/58/25/1313475825.db2.gz ZGZHRXLRJWJAEB-IBGZPJMESA-N 2 0 335.467 2.613 20 10 EFCDRP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2)CC2CC2)CC1 ZINC001236552329 1313491604 /nfs/dbraw/zinc/49/16/04/1313491604.db2.gz JYAXRBXEFMVYTK-XUTJKUGGSA-N 3 0 342.531 2.578 20 10 EFCDRP COc1cc(O)c(CN([C@@H]2CC[NH2+]C2)C2CCCCC2)c(OC)c1 ZINC001236653115 1313503603 /nfs/dbraw/zinc/50/36/03/1313503603.db2.gz OGFIDOHPUDCBNW-OAHLLOKOSA-N 2 0 334.460 2.906 20 10 EFCDRP COc1cc(C)c(C[NH+]2CCN(c3cc[nH+]c(C)c3)CC2)c(O)c1 ZINC001236812625 1313535205 /nfs/dbraw/zinc/53/52/05/1313535205.db2.gz CJTZTLCORFNZQC-UHFFFAOYSA-N 2 0 327.428 2.735 20 10 EFCDRP C[NH+](C)CCCN1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236832647 1313538382 /nfs/dbraw/zinc/53/83/82/1313538382.db2.gz JWHVTRHVNBJOHU-UHFFFAOYSA-N 2 0 327.472 2.615 20 10 EFCDRP C[N@H+](CCc1ccccn1)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236932598 1313556613 /nfs/dbraw/zinc/55/66/13/1313556613.db2.gz SMCXRUOKNVZJMQ-UHFFFAOYSA-N 2 0 342.462 2.647 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC4(C3)CCOCC4)c(F)c2)CC1 ZINC001236937700 1313557320 /nfs/dbraw/zinc/55/73/20/1313557320.db2.gz DEBFECAGSOQHFM-UHFFFAOYSA-N 2 0 347.478 2.580 20 10 EFCDRP C[NH+](C)CCN(Cc1cc(C(F)(F)F)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001236934613 1313557610 /nfs/dbraw/zinc/55/76/10/1313557610.db2.gz XNAPQUCCUZOSFR-OAHLLOKOSA-N 2 0 345.409 2.527 20 10 EFCDRP CCC[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CCOCC1 ZINC001236942395 1313557880 /nfs/dbraw/zinc/55/78/80/1313557880.db2.gz JGUVGCBJJMKSPV-UHFFFAOYSA-N 2 0 349.494 2.969 20 10 EFCDRP C[N@H+](Cc1ccccc1O)Cc1ccc(N2CC[NH+](C)CC2)cc1F ZINC001236944037 1313558196 /nfs/dbraw/zinc/55/81/96/1313558196.db2.gz YSXROJFFNWBEMS-UHFFFAOYSA-N 2 0 343.446 2.915 20 10 EFCDRP CC(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)c(O)c1 ZINC001237048975 1313575841 /nfs/dbraw/zinc/57/58/41/1313575841.db2.gz QENPOURNOZUABZ-RBUKOAKNSA-N 2 0 331.504 2.726 20 10 EFCDRP CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1O ZINC000852754625 1299864229 /nfs/dbraw/zinc/86/42/29/1299864229.db2.gz YIZAYOQXBVJUQC-OAHLLOKOSA-N 2 0 334.435 2.946 20 10 EFCDRP Cc1cc(Cl)cc(C[NH+]2CCC(N3CC[NH+](C)CC3)CC2)c1O ZINC001237687780 1313692239 /nfs/dbraw/zinc/69/22/39/1313692239.db2.gz UUGQZKPQJISBEM-UHFFFAOYSA-N 2 0 337.895 2.566 20 10 EFCDRP C[N@H+](CCC1CC[NH+](C)CC1)Cc1ccc(N2CCOCC2)cc1 ZINC001207484413 1313697816 /nfs/dbraw/zinc/69/78/16/1313697816.db2.gz JWSDBQRCVJSQFY-UHFFFAOYSA-N 2 0 331.504 2.687 20 10 EFCDRP CC[NH+]1CCC(C[NH+]2CCN(c3ccc(OC)cc3C)CC2)CC1 ZINC001208602313 1313973545 /nfs/dbraw/zinc/97/35/45/1313973545.db2.gz BBPMLIRKCFSRIA-UHFFFAOYSA-N 2 0 331.504 2.858 20 10 EFCDRP CCOc1ccc(N2CC[NH+](CC3CC[NH+](CC)CC3)CC2)cc1 ZINC001208602587 1313973694 /nfs/dbraw/zinc/97/36/94/1313973694.db2.gz IYSIMHOTPFMSNY-UHFFFAOYSA-N 2 0 331.504 2.939 20 10 EFCDRP COc1cc(C)c(C[N@@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)c(O)c1 ZINC001222609963 1311160662 /nfs/dbraw/zinc/16/06/62/1311160662.db2.gz TZVBYKPQFUGDSZ-IBGZPJMESA-N 2 0 338.451 2.898 20 10 EFCDRP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(N4CC[NH+](C)CC4)cc3)(C1)CCC2 ZINC001276876385 1311234513 /nfs/dbraw/zinc/23/45/13/1311234513.db2.gz WHKMOTQYDYQLLG-LEWJYISDSA-N 3 0 342.531 2.593 20 10 EFCDRP Cc1cc(C)c(CNc2cccc(N3CCC([NH3+])CC3)[nH+]2)c(O)c1 ZINC001160809907 1311786028 /nfs/dbraw/zinc/78/60/28/1311786028.db2.gz CRNDVAVOLWABGI-UHFFFAOYSA-N 2 0 326.444 2.944 20 10 EFCDRP CCCCOC(=O)CC[C@@H](C)[NH2+]Cc1ccc(N2CC[NH2+]CC2)cc1 ZINC001246172211 1314593567 /nfs/dbraw/zinc/59/35/67/1314593567.db2.gz GPJRYYFKTXXYJC-QGZVFWFLSA-N 2 0 347.503 2.698 20 10 EFCDRP C[C@@H]1CC[C@@H](N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2O)C[NH2+]1 ZINC001246339623 1314612421 /nfs/dbraw/zinc/61/24/21/1314612421.db2.gz GJRDXSMHOABYBI-UYVJDWJCSA-N 2 0 341.455 2.569 20 10 EFCDRP c1ccc2c(c1)nc(-c1ccc(N3CC[NH2+]CC3)cc1)n2[C@@H]1CC[NH2+]C1 ZINC001247046099 1314734497 /nfs/dbraw/zinc/73/44/97/1314734497.db2.gz CTITYQMRUFERTN-GOSISDBHSA-N 2 0 347.466 2.647 20 10 EFCDRP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc4c(c3O)C=CC(C)(C)O4)C[C@H]2C1 ZINC001249259084 1315040479 /nfs/dbraw/zinc/04/04/79/1315040479.db2.gz RFBIRFCMWGVLGK-HZPDHXFCSA-N 2 0 328.456 2.960 20 10 EFCDRP CC[NH+]1C[C@H]2C[NH+](Cc3ccc4c(c3O)C=CC(C)(C)O4)C[C@@H]2C1 ZINC001249259083 1315040820 /nfs/dbraw/zinc/04/08/20/1315040820.db2.gz RFBIRFCMWGVLGK-HOTGVXAUSA-N 2 0 328.456 2.960 20 10 EFCDRP CC[NH+]1CCN(c2ccc(O[C@@H]3CCC[C@@H]4C[NH2+]C[C@@H]43)cc2)CC1 ZINC001218147659 1315155091 /nfs/dbraw/zinc/15/50/91/1315155091.db2.gz OUCKGCHYOLNLJV-LSTHTHJFSA-N 2 0 329.488 2.595 20 10 EFCDRP CCc1ccc(C[NH+]2CCC3(CC[N@H+](CCN(C)C)C3)CC2)c(O)c1 ZINC001276805626 1315319161 /nfs/dbraw/zinc/31/91/61/1315319161.db2.gz ZBOVACOUYDVJLL-UHFFFAOYSA-N 2 0 345.531 2.804 20 10 EFCDRP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2ccccc2cc1O ZINC001276813218 1315409132 /nfs/dbraw/zinc/40/91/32/1315409132.db2.gz MXYKAONNQRHWHV-BGYRXZFFSA-N 2 0 339.483 2.756 20 10 EFCDRP C[NH+](C)CCN1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cc2ccccc2cc1O ZINC001276813329 1315410259 /nfs/dbraw/zinc/41/02/59/1315410259.db2.gz OBUQQJRWBBFCTF-PMACEKPBSA-N 2 0 339.483 2.756 20 10 EFCDRP CC(C)c1ccc(C[NH+]2CCC3(CN(CC[NH+](C)C)C3)CC2)c(O)c1 ZINC001276814501 1315426287 /nfs/dbraw/zinc/42/62/87/1315426287.db2.gz IDRHFIDFNVDWOC-UHFFFAOYSA-N 2 0 345.531 2.975 20 10 EFCDRP CN1CCN(c2ccc(C[N@H+](C)Cc3ccncc3)cc2F)CC1 ZINC001254746614 1315743222 /nfs/dbraw/zinc/74/32/22/1315743222.db2.gz VEQNAIOWVPMWMF-UHFFFAOYSA-N 2 0 328.435 2.605 20 10 EFCDRP COc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c(O)c1OC ZINC001262363283 1316463990 /nfs/dbraw/zinc/46/39/90/1316463990.db2.gz NTJBRKQPXKJWQV-UHFFFAOYSA-N 2 0 334.460 2.906 20 10 EFCDRP CCC[C@]1(CO)CCC[N@@H+]1Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001320870018 1329312434 /nfs/dbraw/zinc/31/24/34/1329312434.db2.gz WCHZVWWETPMIIT-HXUWFJFHSA-N 2 0 349.494 2.705 20 10 EFCDRP COc1cc(C[N@@H+]2CCN(c3cc[nH+]cc3)C[C@@H]2C)c(O)cc1C ZINC001337238394 1331552921 /nfs/dbraw/zinc/55/29/21/1331552921.db2.gz VYXHISOTSNRSLM-HNNXBMFYSA-N 2 0 327.428 2.815 20 10 EFCDRP C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C[C@@H](C2CC2)O1 ZINC001339602691 1331910324 /nfs/dbraw/zinc/91/03/24/1331910324.db2.gz AFLCCZRAUMEWHS-YWZLYKJASA-N 2 0 347.478 2.577 20 10 EFCDRP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC001344578240 1332464349 /nfs/dbraw/zinc/46/43/49/1332464349.db2.gz CSNFFZYQPOBLDD-HZPDHXFCSA-N 2 0 331.504 2.865 20 10 EFCDRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3noc4ccccc43)cc2)CC1 ZINC000848579434 1334805377 /nfs/dbraw/zinc/80/53/77/1334805377.db2.gz CDDIZUXAJXNHFI-UHFFFAOYSA-N 2 0 336.439 2.869 20 10 EFCDRP CCc1cccc(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)c1O ZINC000848899767 1334970547 /nfs/dbraw/zinc/97/05/47/1334970547.db2.gz KACQDWSIECWASF-UHFFFAOYSA-N 2 0 326.444 2.714 20 10 EFCDRP CCc1cccc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c1O ZINC000848899986 1334972182 /nfs/dbraw/zinc/97/21/82/1334972182.db2.gz WIACSLXFQUVSGG-OALUTQOASA-N 2 0 332.488 2.812 20 10 EFCDRP CCc1cccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c1O ZINC000848902809 1334973230 /nfs/dbraw/zinc/97/32/30/1334973230.db2.gz TYTJJLDGTKYUPU-FQEVSTJZSA-N 2 0 340.467 2.811 20 10 EFCDRP CCc1cccc(C[N@H+](C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c1O ZINC000848910923 1334980234 /nfs/dbraw/zinc/98/02/34/1334980234.db2.gz OIUVWONPDPJOBK-IBGZPJMESA-N 2 0 331.504 2.555 20 10 EFCDRP CC1(C)[NH2+]CC[C@@H]1[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000925577378 720470942 /nfs/dbraw/zinc/47/09/42/720470942.db2.gz NOJFKXSPQIGANF-INIZCTEOSA-N 2 0 339.430 2.987 20 10 EFCDRP COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c(O)c1OC ZINC000895508080 724163940 /nfs/dbraw/zinc/16/39/40/724163940.db2.gz DXDVRVLZLVFTIK-GOEBONIOSA-N 2 0 336.476 2.962 20 10 EFCDRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(N(C)C)cc1 ZINC000154388021 727800532 /nfs/dbraw/zinc/80/05/32/727800532.db2.gz HBAKLYIORUPJCE-HXUWFJFHSA-N 2 0 332.536 2.821 20 10 EFCDRP