smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+]1CCC([N@H+](C)Cc2cc(Br)cc(OC)c2O)CC1 ZINC000125208972 700732394 /nfs/dbraw/zinc/73/23/94/700732394.db2.gz GIYLMBPEQZEKMA-UHFFFAOYSA-N 2 2 357.292 3.079 20 10 FGCDLP CC[NH+]1CCC([N@@H+](C)Cc2cc(Br)cc(OC)c2O)CC1 ZINC000125208972 700732396 /nfs/dbraw/zinc/73/23/96/700732396.db2.gz GIYLMBPEQZEKMA-UHFFFAOYSA-N 2 2 357.292 3.079 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000781909808 724611064 /nfs/dbraw/zinc/61/10/64/724611064.db2.gz QUSXGYDDSZZBLL-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000781909808 724611069 /nfs/dbraw/zinc/61/10/69/724611069.db2.gz QUSXGYDDSZZBLL-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC000781909808 724611073 /nfs/dbraw/zinc/61/10/73/724611073.db2.gz QUSXGYDDSZZBLL-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC000781909808 724611074 /nfs/dbraw/zinc/61/10/74/724611074.db2.gz QUSXGYDDSZZBLL-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ncc(Cl)s3)cc2F)CC1 ZINC000769911688 723700269 /nfs/dbraw/zinc/70/02/69/723700269.db2.gz MZUASXNRWBXQBT-UHFFFAOYSA-N 2 2 368.909 3.367 20 10 FGCDLP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000788817214 725089558 /nfs/dbraw/zinc/08/95/58/725089558.db2.gz XWCMHBSHVSUIGR-CYBMUJFWSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000788817214 725089562 /nfs/dbraw/zinc/08/95/62/725089562.db2.gz XWCMHBSHVSUIGR-CYBMUJFWSA-N 2 2 359.436 3.088 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000809767539 725266647 /nfs/dbraw/zinc/26/66/47/725266647.db2.gz NMAVSKLBASQPBT-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000809767539 725266648 /nfs/dbraw/zinc/26/66/48/725266648.db2.gz NMAVSKLBASQPBT-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c1 ZINC000809767539 725266649 /nfs/dbraw/zinc/26/66/49/725266649.db2.gz NMAVSKLBASQPBT-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c1 ZINC000809767539 725266650 /nfs/dbraw/zinc/26/66/50/725266650.db2.gz NMAVSKLBASQPBT-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(Br)c(F)cc1O ZINC000817987845 727290770 /nfs/dbraw/zinc/29/07/70/727290770.db2.gz YUBSVTJOJBIEMO-IRCOFANPSA-N 2 2 357.267 3.333 20 10 FGCDLP C[C@@H]1CCCN(c2ccc(C[NH2+]C[C@H](O)C[N@H+](C)C3CC3)cc2Cl)C1 ZINC000819289606 727364751 /nfs/dbraw/zinc/36/47/51/727364751.db2.gz FTLFKGZOGVJGCV-QAPCUYQASA-N 2 2 365.949 3.121 20 10 FGCDLP C[C@@H]1CCCN(c2ccc(C[NH2+]C[C@H](O)C[N@@H+](C)C3CC3)cc2Cl)C1 ZINC000819289606 727364752 /nfs/dbraw/zinc/36/47/52/727364752.db2.gz FTLFKGZOGVJGCV-QAPCUYQASA-N 2 2 365.949 3.121 20 10 FGCDLP COc1cc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc(Cl)c1OC ZINC000841040018 730205297 /nfs/dbraw/zinc/20/52/97/730205297.db2.gz GSNKLCXKFWARBV-QGZVFWFLSA-N 2 2 363.889 3.213 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087434 730209213 /nfs/dbraw/zinc/20/92/13/730209213.db2.gz NMTMPLFWHSLBOU-CJNGLKHVSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087434 730209214 /nfs/dbraw/zinc/20/92/14/730209214.db2.gz NMTMPLFWHSLBOU-CJNGLKHVSA-N 2 2 353.304 3.427 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H]3CCCSCC3)CC2)cc1 ZINC000850422524 731355565 /nfs/dbraw/zinc/35/55/65/731355565.db2.gz TVAKUAGUDUFXJP-GOSISDBHSA-N 2 2 363.571 3.083 20 10 FGCDLP CC[C@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000274892477 497192912 /nfs/dbraw/zinc/19/29/12/497192912.db2.gz JQARYDYIKNXQIG-FQEVSTJZSA-N 2 2 367.493 3.021 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(OC)c2O)[C@@H]1c1cnn(C)c1 ZINC000364717806 498110680 /nfs/dbraw/zinc/11/06/80/498110680.db2.gz RGGGIHRVNMXNPD-OXJNMPFZSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(OC)c2O)[C@@H]1c1cnn(C)c1 ZINC000364717806 498110687 /nfs/dbraw/zinc/11/06/87/498110687.db2.gz RGGGIHRVNMXNPD-OXJNMPFZSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cccc(OC)c2O)[C@@H]1c1cnn(C)c1 ZINC000364717806 498110696 /nfs/dbraw/zinc/11/06/96/498110696.db2.gz RGGGIHRVNMXNPD-OXJNMPFZSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cccc(OC)c2O)[C@@H]1c1cnn(C)c1 ZINC000364717806 498110699 /nfs/dbraw/zinc/11/06/99/498110699.db2.gz RGGGIHRVNMXNPD-OXJNMPFZSA-N 2 2 372.513 3.039 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cc(F)cc(F)c1O ZINC000756765050 722969768 /nfs/dbraw/zinc/96/97/68/722969768.db2.gz NDAGJCPZXXFPRK-JBBXEZCESA-N 2 2 354.441 3.089 20 10 FGCDLP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000750056298 722753135 /nfs/dbraw/zinc/75/31/35/722753135.db2.gz GSFLZBZRUXPLCM-KRWDZBQOSA-N 2 2 368.905 3.181 20 10 FGCDLP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000750056298 722753136 /nfs/dbraw/zinc/75/31/36/722753136.db2.gz GSFLZBZRUXPLCM-KRWDZBQOSA-N 2 2 368.905 3.181 20 10 FGCDLP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774122418 723861012 /nfs/dbraw/zinc/86/10/12/723861012.db2.gz LGMBNZPBFQYLMC-ZDUSSCGKSA-N 2 2 360.329 3.377 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]CC3(SC)CCC3)CC2)cc1 ZINC000811473027 725367916 /nfs/dbraw/zinc/36/79/16/725367916.db2.gz SWGJUPVUHYMCOZ-UHFFFAOYSA-N 2 2 363.571 3.083 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(Br)cc(F)c1O ZINC000817987561 727290736 /nfs/dbraw/zinc/29/07/36/727290736.db2.gz UITXSUNGYSCSNR-SBFPOUOMSA-N 2 2 357.267 3.333 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000840900989 730189174 /nfs/dbraw/zinc/18/91/74/730189174.db2.gz VVWCMNWBMNNYCD-HXUWFJFHSA-N 2 2 360.885 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000840900989 730189177 /nfs/dbraw/zinc/18/91/77/730189177.db2.gz VVWCMNWBMNNYCD-HXUWFJFHSA-N 2 2 360.885 3.081 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cnc(-c3ccncc3)s2)cc1 ZINC000841046297 730206133 /nfs/dbraw/zinc/20/61/33/730206133.db2.gz ZLPGRLWDGFEVMV-SFHVURJKSA-N 2 2 353.495 3.061 20 10 FGCDLP C[C@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc(Cl)cc1O ZINC000841745536 730270168 /nfs/dbraw/zinc/27/01/68/730270168.db2.gz PSVGGKGDAQVJDK-KBXCAEBGSA-N 2 2 360.885 3.115 20 10 FGCDLP C[C@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc(Cl)cc1O ZINC000841745536 730270169 /nfs/dbraw/zinc/27/01/69/730270169.db2.gz PSVGGKGDAQVJDK-KBXCAEBGSA-N 2 2 360.885 3.115 20 10 FGCDLP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(F)cc(F)c1O ZINC000850483940 731361609 /nfs/dbraw/zinc/36/16/09/731361609.db2.gz YXMVOSWNHJHNIA-CYBMUJFWSA-N 2 2 354.441 3.212 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000186126768 495865799 /nfs/dbraw/zinc/86/57/99/495865799.db2.gz UFHASMNEOJYTKJ-FMEYXAORSA-N 2 2 352.906 3.464 20 10 FGCDLP Cc1cc(N2CCC([NH2+][C@H](C)c3ccc(F)c(F)c3O)CC2)nc(C)[nH+]1 ZINC000187748341 496555399 /nfs/dbraw/zinc/55/53/99/496555399.db2.gz GGHCUQRLMPKIMK-GFCCVEGCSA-N 2 2 362.424 3.397 20 10 FGCDLP COc1c(O)c(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)ccc1[N+](=O)[O-] ZINC000278637946 497176161 /nfs/dbraw/zinc/17/61/61/497176161.db2.gz ISTZDGSDSAITSW-UHFFFAOYSA-N 2 2 373.409 3.056 20 10 FGCDLP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000192822866 497222994 /nfs/dbraw/zinc/22/29/94/497222994.db2.gz XGBUOLQLIKOISF-QWHCGFSZSA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccc(F)c(F)c1O ZINC000191187446 497738232 /nfs/dbraw/zinc/73/82/32/497738232.db2.gz WDXJWZCMQAXEQZ-CQSZACIVSA-N 2 2 362.420 3.353 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287656127 498827356 /nfs/dbraw/zinc/82/73/56/498827356.db2.gz LMHWKUNMOLFDOI-ROUUACIJSA-N 2 2 353.938 3.358 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C[C@@H]2CCCO2)C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000372617032 499154572 /nfs/dbraw/zinc/15/45/72/499154572.db2.gz HIEMQPFARZROAY-AYMQEEERSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@@H]2CCCO2)C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000372617032 499154574 /nfs/dbraw/zinc/15/45/74/499154574.db2.gz HIEMQPFARZROAY-AYMQEEERSA-N 2 2 354.441 3.210 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1O ZINC000367909417 499244300 /nfs/dbraw/zinc/24/43/00/499244300.db2.gz GNIQWLKENYBRIJ-KDOFPFPSSA-N 2 2 351.922 3.255 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)C2 ZINC000368314606 499284618 /nfs/dbraw/zinc/28/46/18/499284618.db2.gz FEPCLGYGOMNXST-WCQYABFASA-N 2 2 350.260 3.325 20 10 FGCDLP COc1ccc(O)c(C[NH2+]C2CC([NH+]3CCC(C(F)(F)F)CC3)C2)c1 ZINC000373487103 499472700 /nfs/dbraw/zinc/47/27/00/499472700.db2.gz UVXWZOWCPMKUML-UHFFFAOYSA-N 2 2 358.404 3.296 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(F)cc(F)c1O ZINC000756433894 722964553 /nfs/dbraw/zinc/96/45/53/722964553.db2.gz ZWRYIXBIXSRTDQ-CYBMUJFWSA-N 2 2 350.409 3.462 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c(Cl)c1 ZINC000840909114 730190032 /nfs/dbraw/zinc/19/00/32/730190032.db2.gz PQKIJQRWVRXGFR-MSOLQXFVSA-N 2 2 352.906 3.212 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(Br)c(F)c2)cc1 ZINC000841045736 730205944 /nfs/dbraw/zinc/20/59/44/730205944.db2.gz PBQQAXJGHZUVQO-QGZVFWFLSA-N 2 2 366.278 3.444 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc(Cl)cc1O ZINC000841745542 730270194 /nfs/dbraw/zinc/27/01/94/730270194.db2.gz PSVGGKGDAQVJDK-RDTXWAMCSA-N 2 2 360.885 3.115 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc(Cl)cc1O ZINC000841745542 730270196 /nfs/dbraw/zinc/27/01/96/730270196.db2.gz PSVGGKGDAQVJDK-RDTXWAMCSA-N 2 2 360.885 3.115 20 10 FGCDLP CC[C@@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1cccc(Cl)c1O ZINC000854232611 731806409 /nfs/dbraw/zinc/80/64/09/731806409.db2.gz VLQSGLZPMORIPG-QGZVFWFLSA-N 2 2 367.921 3.077 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(Br)cc(F)c1O ZINC000873263056 735744420 /nfs/dbraw/zinc/74/44/20/735744420.db2.gz FAISCHKHFGHJQM-DJIHRAIXSA-N 2 2 357.267 3.475 20 10 FGCDLP CC[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1cc(Br)ccc1O ZINC000155280068 495902819 /nfs/dbraw/zinc/90/28/19/495902819.db2.gz ZRVIODPRUSDFCI-INIZCTEOSA-N 2 2 371.319 3.042 20 10 FGCDLP C[NH+]1CCC([NH+]2CCC(CC[NH2+]Cc3cccc(Cl)c3O)CC2)CC1 ZINC000378449056 499518296 /nfs/dbraw/zinc/51/82/96/499518296.db2.gz FHTJBKMSJMOHEY-UHFFFAOYSA-N 3 2 365.949 3.332 20 10 FGCDLP C[NH+]1CCC([NH+]2CCC(CC[NH2+]Cc3cccc(Cl)c3[O-])CC2)CC1 ZINC000378449056 499518298 /nfs/dbraw/zinc/51/82/98/499518298.db2.gz FHTJBKMSJMOHEY-UHFFFAOYSA-N 2 2 365.949 3.332 20 10 FGCDLP C[C@@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)cc(F)c1O ZINC000377796396 499735306 /nfs/dbraw/zinc/73/53/06/499735306.db2.gz NLGCMNVKGLPEQB-SCZZXKLOSA-N 2 2 354.223 3.225 20 10 FGCDLP COC(=O)C[N@H+](CCCCn1cc[nH+]c1C)Cc1cc(Cl)ccc1O ZINC000128409012 700774601 /nfs/dbraw/zinc/77/46/01/700774601.db2.gz PJNDETKSHONTBD-UHFFFAOYSA-N 2 2 365.861 3.006 20 10 FGCDLP COC(=O)C[N@@H+](CCCCn1cc[nH+]c1C)Cc1cc(Cl)ccc1O ZINC000128409012 700774604 /nfs/dbraw/zinc/77/46/04/700774604.db2.gz PJNDETKSHONTBD-UHFFFAOYSA-N 2 2 365.861 3.006 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc(Br)ccc1O ZINC000762652752 723267832 /nfs/dbraw/zinc/26/78/32/723267832.db2.gz XZTSYJYANBMDRX-ZIAGYGMSSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc(Br)ccc1O ZINC000762652752 723267835 /nfs/dbraw/zinc/26/78/35/723267835.db2.gz XZTSYJYANBMDRX-ZIAGYGMSSA-N 2 2 371.319 3.306 20 10 FGCDLP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Cl)c(F)cc3O)CC2)CC1 ZINC000816569492 727176861 /nfs/dbraw/zinc/17/68/61/727176861.db2.gz NLRRLXRTBJDTLA-UHFFFAOYSA-N 2 2 369.912 3.034 20 10 FGCDLP Oc1cccc(Br)c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000862248005 732797752 /nfs/dbraw/zinc/79/77/52/732797752.db2.gz GLBAQHZEBBYVTP-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1cccc(Br)c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000862248005 732797756 /nfs/dbraw/zinc/79/77/56/732797756.db2.gz GLBAQHZEBBYVTP-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccn3)C[C@@H]2C)c1 ZINC000185472933 495590304 /nfs/dbraw/zinc/59/03/04/495590304.db2.gz AUVPTIZINMCYNY-FTRWYGJKSA-N 2 2 355.482 3.357 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccn3)C[C@@H]2C)c1 ZINC000185472933 495590309 /nfs/dbraw/zinc/59/03/09/495590309.db2.gz AUVPTIZINMCYNY-FTRWYGJKSA-N 2 2 355.482 3.357 20 10 FGCDLP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+]2CCOCC2)c(O)c1 ZINC000185197854 496701047 /nfs/dbraw/zinc/70/10/47/496701047.db2.gz GWDLIMGHSFIGJD-GOSISDBHSA-N 2 2 370.493 3.262 20 10 FGCDLP COc1ccc(O)c([C@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)c[nH+]2)c1 ZINC000273517946 496827977 /nfs/dbraw/zinc/82/79/77/496827977.db2.gz SXFNRAPCAHOBGT-HNNXBMFYSA-N 2 2 370.497 3.499 20 10 FGCDLP CCOc1ccc(O)c(CNc2ccc(N3CCC([NH+](C)C)CC3)c[nH+]2)c1 ZINC000269148922 496882112 /nfs/dbraw/zinc/88/21/12/496882112.db2.gz PDSGCHQIHWMKRY-UHFFFAOYSA-N 2 2 370.497 3.328 20 10 FGCDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000093683327 700453028 /nfs/dbraw/zinc/45/30/28/700453028.db2.gz DHGNSJQCRNKTNK-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000093683327 700453029 /nfs/dbraw/zinc/45/30/29/700453029.db2.gz DHGNSJQCRNKTNK-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403277 722963987 /nfs/dbraw/zinc/96/39/87/722963987.db2.gz XNXLXQONHUKQFG-GHMZBOCLSA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403277 722963988 /nfs/dbraw/zinc/96/39/88/722963988.db2.gz XNXLXQONHUKQFG-GHMZBOCLSA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1O ZINC000762649651 723267057 /nfs/dbraw/zinc/26/70/57/723267057.db2.gz OLLRLMWZHYPAKY-KBPBESRZSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1O ZINC000762649651 723267060 /nfs/dbraw/zinc/26/70/60/723267060.db2.gz OLLRLMWZHYPAKY-KBPBESRZSA-N 2 2 371.319 3.306 20 10 FGCDLP Oc1ccc(Cl)c(F)c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000792166354 723317188 /nfs/dbraw/zinc/31/71/88/723317188.db2.gz YWHBGHBJFMJTJR-UHFFFAOYSA-N 2 2 356.869 3.119 20 10 FGCDLP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817938002 727288580 /nfs/dbraw/zinc/28/85/80/727288580.db2.gz BCLNGNYHBVSCMT-OAHLLOKOSA-N 2 2 351.922 3.489 20 10 FGCDLP Brc1cc(C[NH2+][C@@H]2CCC[NH2+]C2)ccc1N1CCCCC1 ZINC000841042281 730205360 /nfs/dbraw/zinc/20/53/60/730205360.db2.gz IKHTVGXDBPASQK-OAHLLOKOSA-N 2 2 352.320 3.281 20 10 FGCDLP Oc1c(Cl)cc(Cl)cc1CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC[NH2+]CC1 ZINC000903980469 743908001 /nfs/dbraw/zinc/90/80/01/743908001.db2.gz SJNRQUKNQXYKHM-IYBDPMFKSA-N 2 2 370.324 3.100 20 10 FGCDLP Oc1c(Cl)cc(Cl)cc1CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC[NH2+]CC1 ZINC000903980469 743908003 /nfs/dbraw/zinc/90/80/03/743908003.db2.gz SJNRQUKNQXYKHM-IYBDPMFKSA-N 2 2 370.324 3.100 20 10 FGCDLP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185648216 495660771 /nfs/dbraw/zinc/66/07/71/495660771.db2.gz IZNDUBSFYZJJPI-GFCCVEGCSA-N 2 2 360.329 3.376 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H](C)c3cscn3)CC2)cc1 ZINC000271152041 497274001 /nfs/dbraw/zinc/27/40/01/497274001.db2.gz QOKDOKRXOWSXAW-INIZCTEOSA-N 2 2 360.527 3.015 20 10 FGCDLP CC[C@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287656129 498827151 /nfs/dbraw/zinc/82/71/51/498827151.db2.gz LMHWKUNMOLFDOI-ZWKOTPCHSA-N 2 2 353.938 3.358 20 10 FGCDLP COC1CCN(c2ccc(C[N@@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)cc2)CC1 ZINC000294949254 498860701 /nfs/dbraw/zinc/86/07/01/498860701.db2.gz MKIQHCUTHVRMMJ-SFHVURJKSA-N 2 2 354.498 3.405 20 10 FGCDLP COC1CCN(c2ccc(C[N@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)cc2)CC1 ZINC000294949254 498860707 /nfs/dbraw/zinc/86/07/07/498860707.db2.gz MKIQHCUTHVRMMJ-SFHVURJKSA-N 2 2 354.498 3.405 20 10 FGCDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000295102692 498910365 /nfs/dbraw/zinc/91/03/65/498910365.db2.gz UHQWARZJPHYITF-RTWAWAEBSA-N 2 2 357.542 3.360 20 10 FGCDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000295102692 498910370 /nfs/dbraw/zinc/91/03/70/498910370.db2.gz UHQWARZJPHYITF-RTWAWAEBSA-N 2 2 357.542 3.360 20 10 FGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000295102692 498910374 /nfs/dbraw/zinc/91/03/74/498910374.db2.gz UHQWARZJPHYITF-RTWAWAEBSA-N 2 2 357.542 3.360 20 10 FGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000295102692 498910379 /nfs/dbraw/zinc/91/03/79/498910379.db2.gz UHQWARZJPHYITF-RTWAWAEBSA-N 2 2 357.542 3.360 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Br)cc(F)c1O ZINC000366732096 499053060 /nfs/dbraw/zinc/05/30/60/499053060.db2.gz WBZGVFMCSCSBIY-QWRGUYRKSA-N 2 2 368.250 3.404 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](Cc3ccncc3)CC2)cc1F ZINC000367670519 499223178 /nfs/dbraw/zinc/22/31/78/499223178.db2.gz NGVYPCVCAMMDQC-UHFFFAOYSA-N 2 2 356.489 3.383 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C2CC[NH+](Cc3ccncc3)CC2)cc1F ZINC000367670519 499223180 /nfs/dbraw/zinc/22/31/80/499223180.db2.gz NGVYPCVCAMMDQC-UHFFFAOYSA-N 2 2 356.489 3.383 20 10 FGCDLP Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c1O ZINC000368402224 499292632 /nfs/dbraw/zinc/29/26/32/499292632.db2.gz JODBLJQYFGAUJG-KBXCAEBGSA-N 2 2 362.905 3.260 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CCCn2cc[nH+]c21)c1ccc(N2CCC(O)CC2)cc1 ZINC000375877108 499564101 /nfs/dbraw/zinc/56/41/01/499564101.db2.gz WXDMSDIYXNHBEI-SJLPKXTDSA-N 2 2 354.498 3.072 20 10 FGCDLP C[NH+]1CCN(C[C@H]2CCC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377624058 499712179 /nfs/dbraw/zinc/71/21/79/499712179.db2.gz KNDKKPFIOFWLQG-CQSZACIVSA-N 2 2 372.340 3.158 20 10 FGCDLP C[NH+]1CCN(C[C@H]2CCC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377624058 499712180 /nfs/dbraw/zinc/71/21/80/499712180.db2.gz KNDKKPFIOFWLQG-CQSZACIVSA-N 2 2 372.340 3.158 20 10 FGCDLP C[NH+]1CCN(C[C@H]([NH2+]Cc2c(O)cccc2Cl)c2ccccc2)CC1 ZINC000733327038 722495663 /nfs/dbraw/zinc/49/56/63/722495663.db2.gz LQGRMXARRXYPON-IBGZPJMESA-N 2 2 359.901 3.124 20 10 FGCDLP CN1CC[NH+](CC2(C)CC[NH+](Cc3cc(Cl)cc(F)c3O)CC2)CC1 ZINC000757963759 722982087 /nfs/dbraw/zinc/98/20/87/722982087.db2.gz GBYPMXFZSGIUTE-UHFFFAOYSA-N 2 2 369.912 3.034 20 10 FGCDLP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1O ZINC000762649910 723267175 /nfs/dbraw/zinc/26/71/75/723267175.db2.gz OLLRLMWZHYPAKY-KGLIPLIRSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1O ZINC000762649910 723267176 /nfs/dbraw/zinc/26/71/76/723267176.db2.gz OLLRLMWZHYPAKY-KGLIPLIRSA-N 2 2 371.319 3.306 20 10 FGCDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc(Br)ccc2O)C1 ZINC000769513830 723688339 /nfs/dbraw/zinc/68/83/39/723688339.db2.gz FPVHQSUJEQRZKO-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc(Br)ccc2O)C1 ZINC000769513830 723688341 /nfs/dbraw/zinc/68/83/41/723688341.db2.gz FPVHQSUJEQRZKO-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000769513830 723688342 /nfs/dbraw/zinc/68/83/42/723688342.db2.gz FPVHQSUJEQRZKO-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815559402 727084022 /nfs/dbraw/zinc/08/40/22/727084022.db2.gz FZCJGGLNMSKOSR-KGLIPLIRSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Br)cc1O ZINC000817941687 727289064 /nfs/dbraw/zinc/28/90/64/727289064.db2.gz VHDILPQYGDVQSP-CYBMUJFWSA-N 2 2 364.287 3.380 20 10 FGCDLP C[C@H]1CCCN(c2ccc(C[NH2+]C[C@@H](O)C[N@H+](C)C3CC3)cc2Cl)C1 ZINC000819289605 727364795 /nfs/dbraw/zinc/36/47/95/727364795.db2.gz FTLFKGZOGVJGCV-MAUKXSAKSA-N 2 2 365.949 3.121 20 10 FGCDLP C[C@H]1CCCN(c2ccc(C[NH2+]C[C@@H](O)C[N@@H+](C)C3CC3)cc2Cl)C1 ZINC000819289605 727364797 /nfs/dbraw/zinc/36/47/97/727364797.db2.gz FTLFKGZOGVJGCV-MAUKXSAKSA-N 2 2 365.949 3.121 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc(OC(F)(F)F)c2)cc1 ZINC000841042863 730205712 /nfs/dbraw/zinc/20/57/12/730205712.db2.gz MGANBLKVBZZJFE-KRWDZBQOSA-N 2 2 353.388 3.441 20 10 FGCDLP CC(C)[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)N1CC[NH+](C)CC1 ZINC000132332260 494857651 /nfs/dbraw/zinc/85/76/51/494857651.db2.gz LRJYUSRVBQNTAR-INIZCTEOSA-N 2 2 360.329 3.061 20 10 FGCDLP C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1O)CN1CC[NH+](C)CC1 ZINC000185344550 495539802 /nfs/dbraw/zinc/53/98/02/495539802.db2.gz QQASHFSVYRCMAL-OLZOCXBDSA-N 2 2 360.329 3.233 20 10 FGCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c1 ZINC000273619806 496854995 /nfs/dbraw/zinc/85/49/95/496854995.db2.gz YQCZLOBYQKKNPR-CYBMUJFWSA-N 2 2 360.429 3.230 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2([NH2+]Cc3cc(F)ccc3O)CCCC2)no1 ZINC000272356844 497607245 /nfs/dbraw/zinc/60/72/45/497607245.db2.gz DWSVPGAHCILPCS-UHFFFAOYSA-N 2 2 362.449 3.315 20 10 FGCDLP Cc1cc[nH+]cc1CCC[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000289237360 498071508 /nfs/dbraw/zinc/07/15/08/498071508.db2.gz KVDRKBKRFNAKRH-UHFFFAOYSA-N 2 2 353.510 3.321 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@@H](C)c1ccc(Br)cc1O)C2 ZINC000368314604 499284656 /nfs/dbraw/zinc/28/46/56/499284656.db2.gz FEPCLGYGOMNXST-AAEUAGOBSA-N 2 2 350.260 3.325 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@H](C)c1ccc(Br)cc1O)C2 ZINC000368314607 499284725 /nfs/dbraw/zinc/28/47/25/499284725.db2.gz FEPCLGYGOMNXST-YPMHNXCESA-N 2 2 350.260 3.325 20 10 FGCDLP COc1c(O)c(C[N@@H+]2CCC[C@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000373207991 499457528 /nfs/dbraw/zinc/45/75/28/499457528.db2.gz FXKWPBMHNLUEBY-HNNXBMFYSA-N 2 2 374.441 3.466 20 10 FGCDLP COc1c(O)c(C[N@H+]2CCC[C@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000373207991 499457529 /nfs/dbraw/zinc/45/75/29/499457529.db2.gz FXKWPBMHNLUEBY-HNNXBMFYSA-N 2 2 374.441 3.466 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C[C@@H](C)C3CC[NH2+]CC3)CC2)cc1 ZINC000378206925 499490350 /nfs/dbraw/zinc/49/03/50/499490350.db2.gz BKFFPDIPLZFVRN-QGZVFWFLSA-N 2 2 373.541 3.148 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CC[C@@H](c3[nH+]ccn3C)C2)c1O ZINC000377886714 499745420 /nfs/dbraw/zinc/74/54/20/499745420.db2.gz AGLCRHSQKUIPJJ-GFCCVEGCSA-N 2 2 350.260 3.186 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](c3[nH+]ccn3C)C2)c1O ZINC000377886714 499745422 /nfs/dbraw/zinc/74/54/22/499745422.db2.gz AGLCRHSQKUIPJJ-GFCCVEGCSA-N 2 2 350.260 3.186 20 10 FGCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500390 723996511 /nfs/dbraw/zinc/99/65/11/723996511.db2.gz JEDLBPFJMXZRFQ-IRXDYDNUSA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500390 723996512 /nfs/dbraw/zinc/99/65/12/723996512.db2.gz JEDLBPFJMXZRFQ-IRXDYDNUSA-N 2 2 367.921 3.029 20 10 FGCDLP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1O ZINC000788755906 725085996 /nfs/dbraw/zinc/08/59/96/725085996.db2.gz SYNFYPOBAUCDCI-UONOGXRCSA-N 2 2 359.436 3.088 20 10 FGCDLP C[NH+](C)[C@H]1CCN(c2ccc(NCc3cc(Cl)c(F)cc3O)[nH+]c2)C1 ZINC000816558664 727175859 /nfs/dbraw/zinc/17/58/59/727175859.db2.gz IOUAZBBAILLDKR-AWEZNQCLSA-N 2 2 364.852 3.332 20 10 FGCDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756164 730270951 /nfs/dbraw/zinc/27/09/51/730270951.db2.gz UMBDVFPJLSISAY-YWZLYKJASA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756164 730270955 /nfs/dbraw/zinc/27/09/55/730270955.db2.gz UMBDVFPJLSISAY-YWZLYKJASA-N 2 2 360.885 3.333 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843044778 730573552 /nfs/dbraw/zinc/57/35/52/730573552.db2.gz IYFYHTARGZTXTJ-WFASDCNBSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843044778 730573555 /nfs/dbraw/zinc/57/35/55/730573555.db2.gz IYFYHTARGZTXTJ-WFASDCNBSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+]CCCn2cc[nH+]c2)c1O ZINC000848514434 731173729 /nfs/dbraw/zinc/17/37/29/731173729.db2.gz OHISNBLJZNAKSU-NSHDSACASA-N 2 2 354.248 3.101 20 10 FGCDLP C[N@@H+]1CC[C@@H](N[C@@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137228 732184608 /nfs/dbraw/zinc/18/46/08/732184608.db2.gz KBHUYCIHMSQWDD-QZTJIDSGSA-N 2 2 365.949 3.472 20 10 FGCDLP C[N@H+]1CC[C@@H](N[C@@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137228 732184609 /nfs/dbraw/zinc/18/46/09/732184609.db2.gz KBHUYCIHMSQWDD-QZTJIDSGSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@@H](N[C@@H]2CCC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137228 732184610 /nfs/dbraw/zinc/18/46/10/732184610.db2.gz KBHUYCIHMSQWDD-QZTJIDSGSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@@H](N[C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137228 732184611 /nfs/dbraw/zinc/18/46/11/732184611.db2.gz KBHUYCIHMSQWDD-QZTJIDSGSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ncc(C(F)(F)F)s3)cc2)CC1 ZINC000883283864 737546792 /nfs/dbraw/zinc/54/67/92/737546792.db2.gz WETHBACZTRSSNA-UHFFFAOYSA-N 2 2 370.444 3.204 20 10 FGCDLP c1cncc(C[NH+]2CCC([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)c1 ZINC000177975922 496273562 /nfs/dbraw/zinc/27/35/62/496273562.db2.gz ZIFCDXACEFDQIC-UHFFFAOYSA-N 2 2 350.510 3.436 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278894998 497259131 /nfs/dbraw/zinc/25/91/31/497259131.db2.gz YVQPYOIXZZFCJX-CHWSQXEVSA-N 2 2 360.329 3.376 20 10 FGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccccc1C[NH+]1CCOCC1 ZINC000294445363 498694474 /nfs/dbraw/zinc/69/44/74/498694474.db2.gz XZJWVBOAMCWOSK-UHFFFAOYSA-N 2 2 364.848 3.307 20 10 FGCDLP CC[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287565264 498798892 /nfs/dbraw/zinc/79/88/92/498798892.db2.gz GKHTXANMUOKMPV-SFHVURJKSA-N 2 2 374.916 3.433 20 10 FGCDLP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287798901 498866594 /nfs/dbraw/zinc/86/65/94/498866594.db2.gz TZSIMEDTXNRADO-WBMJQRKESA-N 2 2 360.329 3.376 20 10 FGCDLP CN1CCc2cc(C[N@H+](C)C[C@@H]3CC[NH+](C)[C@H]3c3cccnc3)ccc21 ZINC000328628476 498881861 /nfs/dbraw/zinc/88/18/61/498881861.db2.gz HHVGARFZFSLYMA-UNMCSNQZSA-N 2 2 350.510 3.199 20 10 FGCDLP CN1CCc2cc(C[N@@H+](C)C[C@@H]3CC[NH+](C)[C@H]3c3cccnc3)ccc21 ZINC000328628476 498881870 /nfs/dbraw/zinc/88/18/70/498881870.db2.gz HHVGARFZFSLYMA-UNMCSNQZSA-N 2 2 350.510 3.199 20 10 FGCDLP CN1CCc2cc(C[NH+](C)C[C@@H]3CC[N@H+](C)[C@H]3c3cccnc3)ccc21 ZINC000328628476 498881873 /nfs/dbraw/zinc/88/18/73/498881873.db2.gz HHVGARFZFSLYMA-UNMCSNQZSA-N 2 2 350.510 3.199 20 10 FGCDLP CN1CCc2cc(C[NH+](C)C[C@@H]3CC[N@@H+](C)[C@H]3c3cccnc3)ccc21 ZINC000328628476 498881877 /nfs/dbraw/zinc/88/18/77/498881877.db2.gz HHVGARFZFSLYMA-UNMCSNQZSA-N 2 2 350.510 3.199 20 10 FGCDLP CN1CC[NH+](CC2(C)CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)CC1 ZINC000366787365 499073967 /nfs/dbraw/zinc/07/39/67/499073967.db2.gz GFHMVYVPKOJKPB-UHFFFAOYSA-N 2 2 369.912 3.034 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3C[C@@H]4CCCC[C@H]4[NH2+]3)CC2)cc1 ZINC000370766345 499252675 /nfs/dbraw/zinc/25/26/75/499252675.db2.gz LRZUXHMVGJUQBY-DQLDELGASA-N 2 2 371.525 3.043 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469047 499331254 /nfs/dbraw/zinc/33/12/54/499331254.db2.gz CTZPHLVYDRRENI-VNQPRFMTSA-N 2 2 359.297 3.383 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469047 499331255 /nfs/dbraw/zinc/33/12/55/499331255.db2.gz CTZPHLVYDRRENI-VNQPRFMTSA-N 2 2 359.297 3.383 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C[C@H](C)C3CC[NH2+]CC3)CC2)cc1 ZINC000378206921 499490364 /nfs/dbraw/zinc/49/03/64/499490364.db2.gz BKFFPDIPLZFVRN-KRWDZBQOSA-N 2 2 373.541 3.148 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@H+](C)C[C@@H]2CCC[NH+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699471 499722069 /nfs/dbraw/zinc/72/20/69/499722069.db2.gz MNJXWXKHESFXBH-VWKPWSFCSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@@H+](C)C[C@@H]2CCC[NH+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699471 499722070 /nfs/dbraw/zinc/72/20/70/499722070.db2.gz MNJXWXKHESFXBH-VWKPWSFCSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH+](C)C[C@@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699471 499722071 /nfs/dbraw/zinc/72/20/71/499722071.db2.gz MNJXWXKHESFXBH-VWKPWSFCSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH+](C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699471 499722072 /nfs/dbraw/zinc/72/20/72/499722072.db2.gz MNJXWXKHESFXBH-VWKPWSFCSA-N 2 2 372.513 3.210 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000779060080 724385803 /nfs/dbraw/zinc/38/58/03/724385803.db2.gz CWHNGADHQAQQDV-WCQYABFASA-N 2 2 350.260 3.325 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](c4ccsc4)C3)cc2)CC1 ZINC000775726746 724031757 /nfs/dbraw/zinc/03/17/57/724031757.db2.gz YQNNTEQURVURAR-HXUWFJFHSA-N 2 2 357.523 3.073 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](c4ccsc4)C3)cc2)CC1 ZINC000775726746 724031764 /nfs/dbraw/zinc/03/17/64/724031764.db2.gz YQNNTEQURVURAR-HXUWFJFHSA-N 2 2 357.523 3.073 20 10 FGCDLP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816547775 727174120 /nfs/dbraw/zinc/17/41/20/727174120.db2.gz IQXRVTIVXPSBEO-UHFFFAOYSA-N 2 2 366.864 3.457 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH+]3CCOCC3)cc2)c(Cl)c1 ZINC000840877442 730186924 /nfs/dbraw/zinc/18/69/24/730186924.db2.gz XPWIPCHOKJBFMR-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP Oc1ccc(Br)cc1C[NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccccc1 ZINC000849349667 731251172 /nfs/dbraw/zinc/25/11/72/731251172.db2.gz HIYTZGNEZCNFQB-IAGOWNOFSA-N 2 2 361.283 3.390 20 10 FGCDLP COc1cc(Cl)cc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c1O ZINC000849350120 731251516 /nfs/dbraw/zinc/25/15/16/731251516.db2.gz QKFRUBWOYOBRQO-IAGOWNOFSA-N 2 2 364.848 3.429 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(Cl)cn3)cc2F)CC1 ZINC000885972945 739205039 /nfs/dbraw/zinc/20/50/39/739205039.db2.gz MHJUEPNMMPTYGX-UHFFFAOYSA-N 2 2 362.880 3.306 20 10 FGCDLP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(Br)cc1O)c1cccnc1 ZINC000896716379 742588543 /nfs/dbraw/zinc/58/85/43/742588543.db2.gz IAGSMXAQCVFIFE-MRXNPFEDSA-N 2 2 364.287 3.332 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Br)c(F)cc1O ZINC000925778162 759535828 /nfs/dbraw/zinc/53/58/28/759535828.db2.gz RRHHCCFFZQXPTK-RKDXNWHRSA-N 2 2 367.209 3.189 20 10 FGCDLP Oc1ccccc1C[N@@H+](Cc1ccc(-n2cc[nH+]c2)nc1)C[C@H]1CCCO1 ZINC000177153377 495950567 /nfs/dbraw/zinc/95/05/67/495950567.db2.gz RSLWXQOLNQOHEU-LJQANCHMSA-N 2 2 364.449 3.154 20 10 FGCDLP Oc1ccccc1C[N@H+](Cc1ccc(-n2cc[nH+]c2)nc1)C[C@H]1CCCO1 ZINC000177153377 495950575 /nfs/dbraw/zinc/95/05/75/495950575.db2.gz RSLWXQOLNQOHEU-LJQANCHMSA-N 2 2 364.449 3.154 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(F)cc1O ZINC000185084806 496653364 /nfs/dbraw/zinc/65/33/64/496653364.db2.gz TXDYBZKDJICQEV-MRXNPFEDSA-N 2 2 357.473 3.130 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc(F)cc1O ZINC000185084806 496653366 /nfs/dbraw/zinc/65/33/66/496653366.db2.gz TXDYBZKDJICQEV-MRXNPFEDSA-N 2 2 357.473 3.130 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1OCC[NH+]1CCOCC1)c1ccc(F)cc1O ZINC000185197603 496700990 /nfs/dbraw/zinc/70/09/90/496700990.db2.gz GVAFLCAKXVNAPB-INIZCTEOSA-N 2 2 374.456 3.093 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Br)cc1O ZINC000279007600 497300498 /nfs/dbraw/zinc/30/04/98/497300498.db2.gz SKNNDMZQQGQPQB-NEPJUHHUSA-N 2 2 350.260 3.264 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(F)c(F)c1[O-] ZINC000191209024 497743822 /nfs/dbraw/zinc/74/38/22/497743822.db2.gz KTUULPCTNZZYQS-AWEZNQCLSA-N 2 2 362.420 3.353 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(F)c(F)c1O ZINC000191209024 497743829 /nfs/dbraw/zinc/74/38/29/497743829.db2.gz KTUULPCTNZZYQS-AWEZNQCLSA-N 2 2 362.420 3.353 20 10 FGCDLP Cn1cc([C@H]2[C@@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@@H+]2C)cn1 ZINC000363176196 498686805 /nfs/dbraw/zinc/68/68/05/498686805.db2.gz GMRVDHVEAZNQSI-VGOFRKELSA-N 2 2 364.493 3.452 20 10 FGCDLP Cn1cc([C@H]2[C@@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@H+]2C)cn1 ZINC000363176196 498686807 /nfs/dbraw/zinc/68/68/07/498686807.db2.gz GMRVDHVEAZNQSI-VGOFRKELSA-N 2 2 364.493 3.452 20 10 FGCDLP CC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(Cl)c1O ZINC000287626908 498818567 /nfs/dbraw/zinc/81/85/67/498818567.db2.gz KCRVAUNPBJGCEC-SFHVURJKSA-N 2 2 374.916 3.433 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3C[C@H]4CCCC[C@@H]4[NH2+]3)CC2)cc1 ZINC000370766344 499252661 /nfs/dbraw/zinc/25/26/61/499252661.db2.gz LRZUXHMVGJUQBY-CZAAIQMYSA-N 2 2 371.525 3.043 20 10 FGCDLP COc1cccc(O)c1C[NH2+]C1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000793233958 723414627 /nfs/dbraw/zinc/41/46/27/723414627.db2.gz XBKXTWWKCULMAW-UHFFFAOYSA-N 2 2 358.404 3.296 20 10 FGCDLP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Br)cc1O ZINC000817941688 727288872 /nfs/dbraw/zinc/28/88/72/727288872.db2.gz VHDILPQYGDVQSP-ZDUSSCGKSA-N 2 2 364.287 3.380 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)c1 ZINC000827856428 729436094 /nfs/dbraw/zinc/43/60/94/729436094.db2.gz OUJKUKCUNHDCQM-OAHLLOKOSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)c1 ZINC000827856428 729436095 /nfs/dbraw/zinc/43/60/95/729436095.db2.gz OUJKUKCUNHDCQM-OAHLLOKOSA-N 2 2 371.319 3.006 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(Br)s2)cc1 ZINC000841042025 730205515 /nfs/dbraw/zinc/20/55/15/730205515.db2.gz GUTYBLMELYAEOL-AWEZNQCLSA-N 2 2 354.317 3.366 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cc1 ZINC000841043275 730205793 /nfs/dbraw/zinc/20/57/93/730205793.db2.gz QKMGZVFVZCEZIC-GOSISDBHSA-N 2 2 355.511 3.004 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087437 730209249 /nfs/dbraw/zinc/20/92/49/730209249.db2.gz NMTMPLFWHSLBOU-CZUORRHYSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)c1 ZINC000841087437 730209251 /nfs/dbraw/zinc/20/92/51/730209251.db2.gz NMTMPLFWHSLBOU-CZUORRHYSA-N 2 2 353.304 3.427 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Br)c(F)cc1O ZINC000925778161 759535326 /nfs/dbraw/zinc/53/53/26/759535326.db2.gz RRHHCCFFZQXPTK-IUCAKERBSA-N 2 2 367.209 3.189 20 10 FGCDLP CC[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1cc(Br)ccc1O ZINC000155280172 495902907 /nfs/dbraw/zinc/90/29/07/495902907.db2.gz ZRVIODPRUSDFCI-MRXNPFEDSA-N 2 2 371.319 3.042 20 10 FGCDLP COc1c(O)c(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000278531851 497144963 /nfs/dbraw/zinc/14/49/63/497144963.db2.gz VGKQGAIWZXTUAE-UHFFFAOYSA-N 2 2 363.458 3.196 20 10 FGCDLP CCc1cc(NCc2ccc(N3CC[NH+](CC)CC3)c(F)c2)nc(C)[nH+]1 ZINC000302042432 498381225 /nfs/dbraw/zinc/38/12/25/498381225.db2.gz ITXACTQYGWHYNE-UHFFFAOYSA-N 2 2 357.477 3.241 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@H]2CC[N@H+](Cc3cnc(C)s3)C[C@@H]2C)c1 ZINC000373185436 499456102 /nfs/dbraw/zinc/45/61/02/499456102.db2.gz IMPUTFXOGRVVJD-UGSOOPFHSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@@H]2C)c1 ZINC000373185436 499456103 /nfs/dbraw/zinc/45/61/03/499456103.db2.gz IMPUTFXOGRVVJD-UGSOOPFHSA-N 2 2 361.511 3.166 20 10 FGCDLP CC[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc(Br)ccc1O ZINC000779065798 724386708 /nfs/dbraw/zinc/38/67/08/724386708.db2.gz PUBAEYRYEBZPKE-TZMCWYRMSA-N 2 2 350.260 3.407 20 10 FGCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500391 723996333 /nfs/dbraw/zinc/99/63/33/723996333.db2.gz JEDLBPFJMXZRFQ-SJORKVTESA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500391 723996335 /nfs/dbraw/zinc/99/63/35/723996335.db2.gz JEDLBPFJMXZRFQ-SJORKVTESA-N 2 2 367.921 3.029 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788755903 725086119 /nfs/dbraw/zinc/08/61/19/725086119.db2.gz SYNFYPOBAUCDCI-KGLIPLIRSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000810252223 725299971 /nfs/dbraw/zinc/29/99/71/725299971.db2.gz AMPBKARKTIRIGT-KBPBESRZSA-N 2 2 360.889 3.108 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc(Br)cs2)cc1 ZINC000841040793 730205315 /nfs/dbraw/zinc/20/53/15/730205315.db2.gz UDNJFTWFPIITSH-OAHLLOKOSA-N 2 2 354.317 3.366 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000843044409 730573130 /nfs/dbraw/zinc/57/31/30/730573130.db2.gz BFVTVOXLNOSZTB-CJNGLKHVSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000843044409 730573131 /nfs/dbraw/zinc/57/31/31/730573131.db2.gz BFVTVOXLNOSZTB-CJNGLKHVSA-N 2 2 353.304 3.427 20 10 FGCDLP COc1ccc(N2CC[C@H]([NH2+]Cc3cc(-n4cc[nH+]c4)cs3)C2)cc1 ZINC000850346053 731344892 /nfs/dbraw/zinc/34/48/92/731344892.db2.gz BPHYCCZDKMUJGU-HNNXBMFYSA-N 2 2 354.479 3.311 20 10 FGCDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2c(O)cccc2Br)C1 ZINC000862251027 732799188 /nfs/dbraw/zinc/79/91/88/732799188.db2.gz YXEHGMKGJSIIBV-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2c(O)cccc2Br)C1 ZINC000862251027 732799192 /nfs/dbraw/zinc/79/91/92/732799192.db2.gz YXEHGMKGJSIIBV-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000862251027 732799196 /nfs/dbraw/zinc/79/91/96/732799196.db2.gz YXEHGMKGJSIIBV-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862251027 732799198 /nfs/dbraw/zinc/79/91/98/732799198.db2.gz YXEHGMKGJSIIBV-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@@]3(C)CCCS3)CC2)cc1 ZINC000862263214 732801664 /nfs/dbraw/zinc/80/16/64/732801664.db2.gz RUGLWBAOHGHNAD-HXUWFJFHSA-N 2 2 363.571 3.083 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1 ZINC000873228087 735740342 /nfs/dbraw/zinc/74/03/42/735740342.db2.gz PFASZCUFTGJNOR-QWRGUYRKSA-N 2 2 367.209 3.032 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1 ZINC000873228087 735740343 /nfs/dbraw/zinc/74/03/43/735740343.db2.gz PFASZCUFTGJNOR-QWRGUYRKSA-N 2 2 367.209 3.032 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(F)cn3)cc2F)CC1 ZINC000092747363 494735989 /nfs/dbraw/zinc/73/59/89/494735989.db2.gz JWFLSXTWMALWMM-OAHLLOKOSA-N 2 2 360.452 3.353 20 10 FGCDLP C[C@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000130584177 495414528 /nfs/dbraw/zinc/41/45/28/495414528.db2.gz YKTOPZSPQZLULU-INIZCTEOSA-N 2 2 368.456 3.203 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1O ZINC000187911336 496617074 /nfs/dbraw/zinc/61/70/74/496617074.db2.gz UHRYWNNNPMWAAL-BBRMVZONSA-N 2 2 362.420 3.088 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1O ZINC000187911336 496617077 /nfs/dbraw/zinc/61/70/77/496617077.db2.gz UHRYWNNNPMWAAL-BBRMVZONSA-N 2 2 362.420 3.088 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c(O)c1 ZINC000363176235 498686176 /nfs/dbraw/zinc/68/61/76/498686176.db2.gz GZDJDGMXUMPKLH-LAUBAEHRSA-N 2 2 372.513 3.087 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c(O)c1 ZINC000363176235 498686183 /nfs/dbraw/zinc/68/61/83/498686183.db2.gz GZDJDGMXUMPKLH-LAUBAEHRSA-N 2 2 372.513 3.087 20 10 FGCDLP Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c1O ZINC000368402226 499292555 /nfs/dbraw/zinc/29/25/55/499292555.db2.gz JODBLJQYFGAUJG-KSSFIOAISA-N 2 2 362.905 3.260 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469046 499331246 /nfs/dbraw/zinc/33/12/46/499331246.db2.gz CTZPHLVYDRRENI-KBMXLJTQSA-N 2 2 359.297 3.383 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469046 499331247 /nfs/dbraw/zinc/33/12/47/499331247.db2.gz CTZPHLVYDRRENI-KBMXLJTQSA-N 2 2 359.297 3.383 20 10 FGCDLP C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024982 499655059 /nfs/dbraw/zinc/65/50/59/499655059.db2.gz NCZDAPLJQPCJON-DVOMOZLQSA-N 2 2 356.869 3.164 20 10 FGCDLP C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024982 499655061 /nfs/dbraw/zinc/65/50/61/499655061.db2.gz NCZDAPLJQPCJON-DVOMOZLQSA-N 2 2 356.869 3.164 20 10 FGCDLP COc1ccc2ccc(O)c(C[NH+]3CCC(C)([NH+]4CCOCC4)CC3)c2c1 ZINC000530105052 503838343 /nfs/dbraw/zinc/83/83/43/503838343.db2.gz PCKPBPLCIKDGLC-UHFFFAOYSA-N 2 2 370.493 3.241 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000775521822 723997807 /nfs/dbraw/zinc/99/78/07/723997807.db2.gz BIUMYRKDUNEUAT-SCTDSRPQSA-N 2 2 352.906 3.464 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1cc(Cl)ccc1O ZINC000775521823 723997890 /nfs/dbraw/zinc/99/78/90/723997890.db2.gz BIUMYRKDUNEUAT-YQVWRLOYSA-N 2 2 352.906 3.464 20 10 FGCDLP CC[C@@H]([NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1cccc(Cl)c1O ZINC000806155941 725118723 /nfs/dbraw/zinc/11/87/23/725118723.db2.gz WIMDXUOXELYVLL-SJORKVTESA-N 2 2 369.937 3.179 20 10 FGCDLP C[C@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 ZINC000817931302 727288418 /nfs/dbraw/zinc/28/84/18/727288418.db2.gz QLHHPAOOTQHRJJ-JFIYKMOQSA-N 2 2 365.949 3.433 20 10 FGCDLP C[C@@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817982674 727290360 /nfs/dbraw/zinc/29/03/60/727290360.db2.gz VIMBEUAEENNHTG-AUUYWEPGSA-N 2 2 351.922 3.345 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000826815670 729416169 /nfs/dbraw/zinc/41/61/69/729416169.db2.gz NUXBLQQRHFENIK-UHFFFAOYSA-N 2 2 356.869 3.165 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c(Cl)c1 ZINC000840909134 730189959 /nfs/dbraw/zinc/18/99/59/730189959.db2.gz PQKIJQRWVRXGFR-ZWKOTPCHSA-N 2 2 352.906 3.212 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@@H](C)Cn2cc[nH+]c2)c1O ZINC000848517936 731174288 /nfs/dbraw/zinc/17/42/88/731174288.db2.gz HSJTVKPCSWGYSM-QWRGUYRKSA-N 2 2 354.248 3.099 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H](C[NH3+])[C@H](C(F)(F)F)C2)c1 ZINC000873228088 735740844 /nfs/dbraw/zinc/74/08/44/735740844.db2.gz PFASZCUFTGJNOR-WDEREUQCSA-N 2 2 367.209 3.032 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@H](C[NH3+])[C@H](C(F)(F)F)C2)c1 ZINC000873228088 735740847 /nfs/dbraw/zinc/74/08/47/735740847.db2.gz PFASZCUFTGJNOR-WDEREUQCSA-N 2 2 367.209 3.032 20 10 FGCDLP CC[C@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1ccccc1O ZINC000155321402 495919295 /nfs/dbraw/zinc/91/92/95/495919295.db2.gz YWGIYLJZCNEFBQ-NRFANRHFSA-N 2 2 370.493 3.344 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(F)c1O ZINC000187680370 496532653 /nfs/dbraw/zinc/53/26/53/496532653.db2.gz IWWPACVEHJMHJU-CYBMUJFWSA-N 2 2 350.409 3.462 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Br)cc1O ZINC000279007606 497300609 /nfs/dbraw/zinc/30/06/09/497300609.db2.gz SKNNDMZQQGQPQB-VXGBXAGGSA-N 2 2 350.260 3.264 20 10 FGCDLP COc1cc(O)c(C[N@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cc1OC ZINC000282027152 498362675 /nfs/dbraw/zinc/36/26/75/498362675.db2.gz WIKIHQYTUHGQSD-HNNXBMFYSA-N 2 2 371.481 3.322 20 10 FGCDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)c1ccc(N3CCC(O)CC3)cc1)CCC2 ZINC000363756969 498976860 /nfs/dbraw/zinc/97/68/60/498976860.db2.gz JFBYJBNZFRGLQJ-MJGOQNOKSA-N 2 2 368.525 3.381 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614354 499217780 /nfs/dbraw/zinc/21/77/80/499217780.db2.gz GTTQBTNHCDSIIY-DCPHZVHLSA-N 2 2 360.477 3.389 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614354 499217782 /nfs/dbraw/zinc/21/77/82/499217782.db2.gz GTTQBTNHCDSIIY-DCPHZVHLSA-N 2 2 360.477 3.389 20 10 FGCDLP CC[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1O ZINC000367909419 499244202 /nfs/dbraw/zinc/24/42/02/499244202.db2.gz GNIQWLKENYBRIJ-RDTXWAMCSA-N 2 2 351.922 3.255 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@@H](C)c1cc(Br)cc(F)c1O)C2 ZINC000368314724 499284527 /nfs/dbraw/zinc/28/45/27/499284527.db2.gz FHTPCORHIPXQBW-CMPLNLGQSA-N 2 2 368.250 3.464 20 10 FGCDLP COc1cc(Br)cc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c1O ZINC000093643858 700452977 /nfs/dbraw/zinc/45/29/77/700452977.db2.gz HCWBTVIFXKWHAS-SMDDNHRTSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c1O ZINC000093643858 700452979 /nfs/dbraw/zinc/45/29/79/700452979.db2.gz HCWBTVIFXKWHAS-SMDDNHRTSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1O ZINC000093643858 700452981 /nfs/dbraw/zinc/45/29/81/700452981.db2.gz HCWBTVIFXKWHAS-SMDDNHRTSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1O ZINC000093643858 700452983 /nfs/dbraw/zinc/45/29/83/700452983.db2.gz HCWBTVIFXKWHAS-SMDDNHRTSA-N 2 2 357.292 3.078 20 10 FGCDLP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741990 700453937 /nfs/dbraw/zinc/45/39/37/700453937.db2.gz VDVJDEODVGDEOO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741990 700453938 /nfs/dbraw/zinc/45/39/38/700453938.db2.gz VDVJDEODVGDEOO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741990 700453940 /nfs/dbraw/zinc/45/39/40/700453940.db2.gz VDVJDEODVGDEOO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741990 700453942 /nfs/dbraw/zinc/45/39/42/700453942.db2.gz VDVJDEODVGDEOO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cc(F)cc(F)c1O ZINC000756765052 722969822 /nfs/dbraw/zinc/96/98/22/722969822.db2.gz NDAGJCPZXXFPRK-UYHISHBKSA-N 2 2 354.441 3.089 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](N[C@H]2CC[NH+]3CCC[C@@H]3C2)C1 ZINC000754795924 722945981 /nfs/dbraw/zinc/94/59/81/722945981.db2.gz RDIOMYUCSKBWES-GBESFXJTSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](N[C@H]2CC[NH+]3CCC[C@@H]3C2)C1 ZINC000754795924 722945982 /nfs/dbraw/zinc/94/59/82/722945982.db2.gz RDIOMYUCSKBWES-GBESFXJTSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000754795924 722945983 /nfs/dbraw/zinc/94/59/83/722945983.db2.gz RDIOMYUCSKBWES-GBESFXJTSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000754795924 722945984 /nfs/dbraw/zinc/94/59/84/722945984.db2.gz RDIOMYUCSKBWES-GBESFXJTSA-N 2 2 363.933 3.226 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cc(Cl)ccc1O ZINC000775504064 723996836 /nfs/dbraw/zinc/99/68/36/723996836.db2.gz RPOWRFOQBOPNER-KRWDZBQOSA-N 2 2 367.921 3.029 20 10 FGCDLP Cc1cc(Br)cc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816642666 727184453 /nfs/dbraw/zinc/18/44/53/727184453.db2.gz HCWNNNCLPKLGKS-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816642666 727184455 /nfs/dbraw/zinc/18/44/55/727184455.db2.gz HCWNNNCLPKLGKS-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642666 727184458 /nfs/dbraw/zinc/18/44/58/727184458.db2.gz HCWNNNCLPKLGKS-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642666 727184459 /nfs/dbraw/zinc/18/44/59/727184459.db2.gz HCWNNNCLPKLGKS-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc(Br)cs2)cc1 ZINC000841040792 730205486 /nfs/dbraw/zinc/20/54/86/730205486.db2.gz UDNJFTWFPIITSH-HNNXBMFYSA-N 2 2 354.317 3.366 20 10 FGCDLP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843051632 730574183 /nfs/dbraw/zinc/57/41/83/730574183.db2.gz APTBVQYAQFNJLS-MRXNPFEDSA-N 2 2 366.347 3.481 20 10 FGCDLP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843051632 730574187 /nfs/dbraw/zinc/57/41/87/730574187.db2.gz APTBVQYAQFNJLS-MRXNPFEDSA-N 2 2 366.347 3.481 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)cc1Cl ZINC000925781983 759537672 /nfs/dbraw/zinc/53/76/72/759537672.db2.gz JPWWPHXTOMYPPX-ZIAGYGMSSA-N 2 2 373.875 3.072 20 10 FGCDLP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2OCC[NH+]2CCOCC2)c1 ZINC000185197576 496701129 /nfs/dbraw/zinc/70/11/29/496701129.db2.gz TUHOQQPHBJVWRZ-SFHVURJKSA-N 2 2 370.493 3.262 20 10 FGCDLP C[C@@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)c[nH+]1)c1cc([N+](=O)[O-])ccc1O ZINC000273527161 496830972 /nfs/dbraw/zinc/83/09/72/496830972.db2.gz VOOVBSFWECBXAG-CJNGLKHVSA-N 2 2 371.441 3.009 20 10 FGCDLP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(Cl)c1O ZINC000287708835 498843247 /nfs/dbraw/zinc/84/32/47/498843247.db2.gz NZZVDXARBSPUKT-SFHVURJKSA-N 2 2 374.916 3.433 20 10 FGCDLP CCC[NH+]1CCN(C2CC[NH+](Cc3cccc(Cl)c3O)CC2)CC1 ZINC000372922061 499195154 /nfs/dbraw/zinc/19/51/54/499195154.db2.gz ATCCLRCOMQHQNO-UHFFFAOYSA-N 2 2 351.922 3.038 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)CC3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC000378211209 499490562 /nfs/dbraw/zinc/49/05/62/499490562.db2.gz OZUCTCQJCONICU-AYHJJNSGSA-N 2 2 371.525 3.043 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377865549 499743520 /nfs/dbraw/zinc/74/35/20/499743520.db2.gz SORRPHGUKXEINE-KRWDZBQOSA-N 2 2 369.509 3.496 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377865549 499743522 /nfs/dbraw/zinc/74/35/22/499743522.db2.gz SORRPHGUKXEINE-KRWDZBQOSA-N 2 2 369.509 3.496 20 10 FGCDLP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000123044289 700699522 /nfs/dbraw/zinc/69/95/22/700699522.db2.gz WLSSZVHJOIBPHG-IYBDPMFKSA-N 2 2 351.922 3.036 20 10 FGCDLP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000123044289 700699525 /nfs/dbraw/zinc/69/95/25/700699525.db2.gz WLSSZVHJOIBPHG-IYBDPMFKSA-N 2 2 351.922 3.036 20 10 FGCDLP C[C@H]([NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000756341199 722963033 /nfs/dbraw/zinc/96/30/33/722963033.db2.gz ICEZVLLLOLKFTO-YOEHRIQHSA-N 2 2 363.502 3.232 20 10 FGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470989 723686637 /nfs/dbraw/zinc/68/66/37/723686637.db2.gz PQUODXDWBJGIRB-DOMZBBRYSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470989 723686638 /nfs/dbraw/zinc/68/66/38/723686638.db2.gz PQUODXDWBJGIRB-DOMZBBRYSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470989 723686639 /nfs/dbraw/zinc/68/66/39/723686639.db2.gz PQUODXDWBJGIRB-DOMZBBRYSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470989 723686641 /nfs/dbraw/zinc/68/66/41/723686641.db2.gz PQUODXDWBJGIRB-DOMZBBRYSA-N 2 2 371.319 3.468 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cc1 ZINC000841043276 730205875 /nfs/dbraw/zinc/20/58/75/730205875.db2.gz QKMGZVFVZCEZIC-SFHVURJKSA-N 2 2 355.511 3.004 20 10 FGCDLP [NH3+]C[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C(F)(F)F ZINC000863646852 732989886 /nfs/dbraw/zinc/98/98/86/732989886.db2.gz QDGQZFOCDVCYMI-JQWIXIFHSA-N 2 2 367.209 3.114 20 10 FGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C(F)(F)F ZINC000863646852 732989891 /nfs/dbraw/zinc/98/98/91/732989891.db2.gz QDGQZFOCDVCYMI-JQWIXIFHSA-N 2 2 367.209 3.114 20 10 FGCDLP C[C@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)c[nH+]1)c1cc([N+](=O)[O-])ccc1O ZINC000273527172 496830190 /nfs/dbraw/zinc/83/01/90/496830190.db2.gz VOOVBSFWECBXAG-XJKSGUPXSA-N 2 2 371.441 3.009 20 10 FGCDLP COc1c(O)c(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000278838088 497237526 /nfs/dbraw/zinc/23/75/26/497237526.db2.gz JOIUNXOVUATQGV-UHFFFAOYSA-N 2 2 363.458 3.053 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccnc3)C2)c1 ZINC000363862386 499029300 /nfs/dbraw/zinc/02/93/00/499029300.db2.gz ITIAZRLUGWPIIF-WMZOPIPTSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)c1 ZINC000363862386 499029306 /nfs/dbraw/zinc/02/93/06/499029306.db2.gz ITIAZRLUGWPIIF-WMZOPIPTSA-N 2 2 355.482 3.359 20 10 FGCDLP CC(=O)c1cc(F)cc(C[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1O ZINC000372522041 499138683 /nfs/dbraw/zinc/13/86/83/499138683.db2.gz MJPVFWAYLCYAGE-JXFKEZNVSA-N 2 2 371.456 3.254 20 10 FGCDLP CC(=O)c1cc(F)cc(C[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1O ZINC000372522041 499138685 /nfs/dbraw/zinc/13/86/85/499138685.db2.gz MJPVFWAYLCYAGE-JXFKEZNVSA-N 2 2 371.456 3.254 20 10 FGCDLP CC(=O)c1cc(F)cc(C[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1O ZINC000372522041 499138686 /nfs/dbraw/zinc/13/86/86/499138686.db2.gz MJPVFWAYLCYAGE-JXFKEZNVSA-N 2 2 371.456 3.254 20 10 FGCDLP CC(=O)c1cc(F)cc(C[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1O ZINC000372522041 499138688 /nfs/dbraw/zinc/13/86/88/499138688.db2.gz MJPVFWAYLCYAGE-JXFKEZNVSA-N 2 2 371.456 3.254 20 10 FGCDLP CC[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1O ZINC000367909416 499244271 /nfs/dbraw/zinc/24/42/71/499244271.db2.gz GNIQWLKENYBRIJ-KBXCAEBGSA-N 2 2 351.922 3.255 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@H](C)c1cc(Br)cc(F)c1O)C2 ZINC000368314726 499284531 /nfs/dbraw/zinc/28/45/31/499284531.db2.gz FHTPCORHIPXQBW-PWSUYJOCSA-N 2 2 368.250 3.464 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000377803574 499736573 /nfs/dbraw/zinc/73/65/73/499736573.db2.gz YAUUTHMJZYMGMV-JQWIXIFHSA-N 2 2 350.260 3.394 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CCc3[nH]c[nH+]c3C2)c1O ZINC000377803574 499736575 /nfs/dbraw/zinc/73/65/75/499736575.db2.gz YAUUTHMJZYMGMV-JQWIXIFHSA-N 2 2 350.260 3.394 20 10 FGCDLP COc1cc(Br)cc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c1O ZINC000093643860 700453008 /nfs/dbraw/zinc/45/30/08/700453008.db2.gz HCWBTVIFXKWHAS-FZMZJTMJSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c1O ZINC000093643860 700453009 /nfs/dbraw/zinc/45/30/09/700453009.db2.gz HCWBTVIFXKWHAS-FZMZJTMJSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1O ZINC000093643860 700453010 /nfs/dbraw/zinc/45/30/10/700453010.db2.gz HCWBTVIFXKWHAS-FZMZJTMJSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1O ZINC000093643860 700453011 /nfs/dbraw/zinc/45/30/11/700453011.db2.gz HCWBTVIFXKWHAS-FZMZJTMJSA-N 2 2 357.292 3.078 20 10 FGCDLP CC[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc(Br)ccc1O ZINC000779065796 724386562 /nfs/dbraw/zinc/38/65/62/724386562.db2.gz PUBAEYRYEBZPKE-JSGCOSHPSA-N 2 2 350.260 3.407 20 10 FGCDLP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1cccc(Cl)c1O ZINC000806138322 725117506 /nfs/dbraw/zinc/11/75/06/725117506.db2.gz UBUNLHDKDXYZHC-MAUKXSAKSA-N 2 2 353.938 3.360 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]Cc3ccsc3C)CC2)cc1 ZINC000815113209 727039561 /nfs/dbraw/zinc/03/95/61/727039561.db2.gz SOTQNRREFLWQLI-UHFFFAOYSA-N 2 2 359.539 3.367 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000848551321 731180189 /nfs/dbraw/zinc/18/01/89/731180189.db2.gz JPKAYTQVFHVRCO-ONGXEEELSA-N 2 2 366.259 3.095 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1cc(Br)ccc1O ZINC000850556875 731372758 /nfs/dbraw/zinc/37/27/58/731372758.db2.gz KJTKFCYQJSRJTR-SWLSCSKDSA-N 2 2 369.303 3.059 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(F)c(F)c1[O-] ZINC000191209041 497743668 /nfs/dbraw/zinc/74/36/68/497743668.db2.gz KTUULPCTNZZYQS-CQSZACIVSA-N 2 2 362.420 3.353 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(F)c(F)c1O ZINC000191209041 497743672 /nfs/dbraw/zinc/74/36/72/497743672.db2.gz KTUULPCTNZZYQS-CQSZACIVSA-N 2 2 362.420 3.353 20 10 FGCDLP COc1c(O)c(C[N@@H+]2CCC[C@@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000365826982 498657565 /nfs/dbraw/zinc/65/75/65/498657565.db2.gz RFBBHAPAGZBMDJ-OAHLLOKOSA-N 2 2 374.441 3.294 20 10 FGCDLP COc1c(O)c(C[N@H+]2CCC[C@@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000365826982 498657568 /nfs/dbraw/zinc/65/75/68/498657568.db2.gz RFBBHAPAGZBMDJ-OAHLLOKOSA-N 2 2 374.441 3.294 20 10 FGCDLP Cc1c[nH+]ccc1OC1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000365833729 498662023 /nfs/dbraw/zinc/66/20/23/498662023.db2.gz RRMKFOGOZOZLML-UHFFFAOYSA-N 2 2 367.493 3.270 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@H+](C[C@@H]2CCCO2)C[C@@H]1C)c1ccc(F)cc1O ZINC000375800910 499556777 /nfs/dbraw/zinc/55/67/77/499556777.db2.gz FTQRCWBEYZUVIF-OYSPMZIOSA-N 2 2 350.478 3.461 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@@H]2CCCO2)C[C@@H]1C)c1ccc(F)cc1O ZINC000375800910 499556778 /nfs/dbraw/zinc/55/67/78/499556778.db2.gz FTQRCWBEYZUVIF-OYSPMZIOSA-N 2 2 350.478 3.461 20 10 FGCDLP C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024983 499655202 /nfs/dbraw/zinc/65/52/02/499655202.db2.gz NCZDAPLJQPCJON-IOASZLSFSA-N 2 2 356.869 3.164 20 10 FGCDLP C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024983 499655203 /nfs/dbraw/zinc/65/52/03/499655203.db2.gz NCZDAPLJQPCJON-IOASZLSFSA-N 2 2 356.869 3.164 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000377709040 499723476 /nfs/dbraw/zinc/72/34/76/499723476.db2.gz UDMHCXAWQMLOTQ-KUDFPVQQSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000377709040 499723477 /nfs/dbraw/zinc/72/34/77/499723477.db2.gz UDMHCXAWQMLOTQ-KUDFPVQQSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1 ZINC000377709040 499723478 /nfs/dbraw/zinc/72/34/78/499723478.db2.gz UDMHCXAWQMLOTQ-KUDFPVQQSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1 ZINC000377709040 499723479 /nfs/dbraw/zinc/72/34/79/499723479.db2.gz UDMHCXAWQMLOTQ-KUDFPVQQSA-N 2 2 355.482 3.482 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000781909813 724611355 /nfs/dbraw/zinc/61/13/55/724611355.db2.gz QUSXGYDDSZZBLL-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000781909813 724611358 /nfs/dbraw/zinc/61/13/58/724611358.db2.gz QUSXGYDDSZZBLL-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC000781909813 724611359 /nfs/dbraw/zinc/61/13/59/724611359.db2.gz QUSXGYDDSZZBLL-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC000781909813 724611362 /nfs/dbraw/zinc/61/13/62/724611362.db2.gz QUSXGYDDSZZBLL-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP C[C@@H]([NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000756341197 722963065 /nfs/dbraw/zinc/96/30/65/722963065.db2.gz ICEZVLLLOLKFTO-RHSMWYFYSA-N 2 2 363.502 3.232 20 10 FGCDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3cccc(Cl)c3O)CC2)CC1 ZINC000817413961 727248972 /nfs/dbraw/zinc/24/89/72/727248972.db2.gz NPMVAVZKYDTFAK-UHFFFAOYSA-N 2 2 351.922 3.038 20 10 FGCDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3cccc(Cl)c3O)CC2)CC1 ZINC000817413961 727248975 /nfs/dbraw/zinc/24/89/75/727248975.db2.gz NPMVAVZKYDTFAK-UHFFFAOYSA-N 2 2 351.922 3.038 20 10 FGCDLP COc1cc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cc(Cl)c1OC ZINC000841040017 730205505 /nfs/dbraw/zinc/20/55/05/730205505.db2.gz GSNKLCXKFWARBV-KRWDZBQOSA-N 2 2 363.889 3.213 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(OC(F)(F)F)cc2)cc1 ZINC000841042475 730205621 /nfs/dbraw/zinc/20/56/21/730205621.db2.gz KECUOPRJBFYVCL-KRWDZBQOSA-N 2 2 353.388 3.441 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@H](C)Cn2cc[nH+]c2)c1O ZINC000848517933 731174201 /nfs/dbraw/zinc/17/42/01/731174201.db2.gz HSJTVKPCSWGYSM-GHMZBOCLSA-N 2 2 354.248 3.099 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Br)cc(F)c1O ZINC000366732095 499052762 /nfs/dbraw/zinc/05/27/62/499052762.db2.gz WBZGVFMCSCSBIY-MNOVXSKESA-N 2 2 368.250 3.404 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Br)cc(F)c1O ZINC000366732094 499053079 /nfs/dbraw/zinc/05/30/79/499053079.db2.gz WBZGVFMCSCSBIY-GHMZBOCLSA-N 2 2 368.250 3.404 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](N[C@@H]2CC[NH+]3CCC[C@H]3C2)C1 ZINC000754795925 722945952 /nfs/dbraw/zinc/94/59/52/722945952.db2.gz RDIOMYUCSKBWES-QYZOEREBSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](N[C@@H]2CC[NH+]3CCC[C@H]3C2)C1 ZINC000754795925 722945953 /nfs/dbraw/zinc/94/59/53/722945953.db2.gz RDIOMYUCSKBWES-QYZOEREBSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000754795925 722945954 /nfs/dbraw/zinc/94/59/54/722945954.db2.gz RDIOMYUCSKBWES-QYZOEREBSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000754795925 722945955 /nfs/dbraw/zinc/94/59/55/722945955.db2.gz RDIOMYUCSKBWES-QYZOEREBSA-N 2 2 363.933 3.226 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1cc(Cl)ccc1O ZINC000775521820 723997953 /nfs/dbraw/zinc/99/79/53/723997953.db2.gz BIUMYRKDUNEUAT-JENIJYKNSA-N 2 2 352.906 3.464 20 10 FGCDLP C[C@H]1CCCN(c2ccc(C[NH2+]C[C@H](O)C[N@H+](C)C3CC3)cc2Cl)C1 ZINC000819289607 727364681 /nfs/dbraw/zinc/36/46/81/727364681.db2.gz FTLFKGZOGVJGCV-YJBOKZPZSA-N 2 2 365.949 3.121 20 10 FGCDLP C[C@H]1CCCN(c2ccc(C[NH2+]C[C@H](O)C[N@@H+](C)C3CC3)cc2Cl)C1 ZINC000819289607 727364683 /nfs/dbraw/zinc/36/46/83/727364683.db2.gz FTLFKGZOGVJGCV-YJBOKZPZSA-N 2 2 365.949 3.121 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH+]3CCOCC3)cc2)cc1Cl ZINC000825058982 729369256 /nfs/dbraw/zinc/36/92/56/729369256.db2.gz QEWXWTBMXCMBSY-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(OC(F)(F)F)cc2)cc1 ZINC000841042477 730205833 /nfs/dbraw/zinc/20/58/33/730205833.db2.gz KECUOPRJBFYVCL-QGZVFWFLSA-N 2 2 353.388 3.441 20 10 FGCDLP Oc1c(F)cc(Br)cc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000882903492 737502461 /nfs/dbraw/zinc/50/24/61/737502461.db2.gz DGVZBUHAVLTGAR-UHFFFAOYSA-N 2 2 357.267 3.258 20 10 FGCDLP c1cc(NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)nc(C2CC2)[nH+]1 ZINC000121846475 494873546 /nfs/dbraw/zinc/87/35/46/494873546.db2.gz CIVFOGUZCFUGQJ-UHFFFAOYSA-N 2 2 363.509 3.498 20 10 FGCDLP COc1cc(O)c(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1OC ZINC000278078265 496996123 /nfs/dbraw/zinc/99/61/23/496996123.db2.gz NORHGMADEKDDJK-UHFFFAOYSA-N 2 2 358.438 3.156 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000248480900 497023601 /nfs/dbraw/zinc/02/36/01/497023601.db2.gz AUVPTIZINMCYNY-GQIGUUNPSA-N 2 2 355.482 3.357 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000248480900 497023607 /nfs/dbraw/zinc/02/36/07/497023607.db2.gz AUVPTIZINMCYNY-GQIGUUNPSA-N 2 2 355.482 3.357 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)C2 ZINC000363862446 499029921 /nfs/dbraw/zinc/02/99/21/499029921.db2.gz YYZVBSHVMPKNGQ-AAEUAGOBSA-N 2 2 350.260 3.325 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C[C@@H]2CCCO2)C[C@H]1C)c1ccc(F)c(F)c1O ZINC000372617035 499154509 /nfs/dbraw/zinc/15/45/09/499154509.db2.gz HIEMQPFARZROAY-XJIUQZFPSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@@H]2CCCO2)C[C@H]1C)c1ccc(F)c(F)c1O ZINC000372617035 499154511 /nfs/dbraw/zinc/15/45/11/499154511.db2.gz HIEMQPFARZROAY-XJIUQZFPSA-N 2 2 354.441 3.210 20 10 FGCDLP C[NH+](C)CCCN(CCC[NH+](C)C)Cc1cc(Cl)cc(Cl)c1O ZINC000004988155 695545065 /nfs/dbraw/zinc/54/50/65/695545065.db2.gz VFSCRAXGHBRLMI-UHFFFAOYSA-N 2 2 362.345 3.404 20 10 FGCDLP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093692909 700453602 /nfs/dbraw/zinc/45/36/02/700453602.db2.gz WJULMBMTWNOSQO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093692909 700453603 /nfs/dbraw/zinc/45/36/03/700453603.db2.gz WJULMBMTWNOSQO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217029 725297588 /nfs/dbraw/zinc/29/75/88/725297588.db2.gz VDZHJAMPVQCKSZ-LZWOXQAQSA-N 2 2 358.404 3.315 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217029 725297590 /nfs/dbraw/zinc/29/75/90/725297590.db2.gz VDZHJAMPVQCKSZ-LZWOXQAQSA-N 2 2 358.404 3.315 20 10 FGCDLP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815558941 727084059 /nfs/dbraw/zinc/08/40/59/727084059.db2.gz SDSDTHJNVIKDST-AWEZNQCLSA-N 2 2 359.436 3.089 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(Br)cc(F)c1O ZINC000817987563 727290690 /nfs/dbraw/zinc/29/06/90/727290690.db2.gz UITXSUNGYSCSNR-SRRSOLGSSA-N 2 2 357.267 3.333 20 10 FGCDLP Brc1cc(C[NH2+][C@H]2CCC[NH2+]C2)ccc1N1CCCCC1 ZINC000841042280 730205512 /nfs/dbraw/zinc/20/55/12/730205512.db2.gz IKHTVGXDBPASQK-HNNXBMFYSA-N 2 2 352.320 3.281 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cnc(-c3ccccn3)s2)cc1 ZINC000841045576 730205565 /nfs/dbraw/zinc/20/55/65/730205565.db2.gz NAIVTEXVIBZLDB-KRWDZBQOSA-N 2 2 353.495 3.061 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843044777 730573358 /nfs/dbraw/zinc/57/33/58/730573358.db2.gz IYFYHTARGZTXTJ-SWLSCSKDSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843044777 730573362 /nfs/dbraw/zinc/57/33/62/730573362.db2.gz IYFYHTARGZTXTJ-SWLSCSKDSA-N 2 2 369.303 3.127 20 10 FGCDLP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843048253 730573932 /nfs/dbraw/zinc/57/39/32/730573932.db2.gz GWVXQRGWDZMYQG-HNNXBMFYSA-N 2 2 352.320 3.220 20 10 FGCDLP [NH3+]C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843048253 730573939 /nfs/dbraw/zinc/57/39/39/730573939.db2.gz GWVXQRGWDZMYQG-HNNXBMFYSA-N 2 2 352.320 3.220 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2(NCc3ccc4c(c3)CCO4)CCCC2)no1 ZINC000124060609 495228469 /nfs/dbraw/zinc/22/84/69/495228469.db2.gz POVYCVXZYRWZAD-UHFFFAOYSA-N 2 2 370.497 3.405 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCCC2)no1 ZINC000124060609 495228474 /nfs/dbraw/zinc/22/84/74/495228474.db2.gz POVYCVXZYRWZAD-UHFFFAOYSA-N 2 2 370.497 3.405 20 10 FGCDLP COCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000187066442 496276909 /nfs/dbraw/zinc/27/69/09/496276909.db2.gz ASRAUQPFLQWSQP-ZDUSSCGKSA-N 2 2 371.319 3.225 20 10 FGCDLP CCOc1cccc(CNc2ccc(N3CCC([NH+](C)C)CC3)c[nH+]2)c1O ZINC000269135673 496879126 /nfs/dbraw/zinc/87/91/26/496879126.db2.gz KBBPPPNRITXQDE-UHFFFAOYSA-N 2 2 370.497 3.328 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccn3)C[C@@H]2C)c1 ZINC000248480901 497024295 /nfs/dbraw/zinc/02/42/95/497024295.db2.gz AUVPTIZINMCYNY-TWOQFEAHSA-N 2 2 355.482 3.357 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccn3)C[C@@H]2C)c1 ZINC000248480901 497024303 /nfs/dbraw/zinc/02/43/03/497024303.db2.gz AUVPTIZINMCYNY-TWOQFEAHSA-N 2 2 355.482 3.357 20 10 FGCDLP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287612028 498813614 /nfs/dbraw/zinc/81/36/14/498813614.db2.gz JIMJXVQNGJTIIN-MLGOLLRUSA-N 2 2 360.329 3.376 20 10 FGCDLP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287798862 498866958 /nfs/dbraw/zinc/86/69/58/498866958.db2.gz TZSIMEDTXNRADO-BLLLJJGKSA-N 2 2 360.329 3.376 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614353 499217940 /nfs/dbraw/zinc/21/79/40/499217940.db2.gz GTTQBTNHCDSIIY-ADLFWFRXSA-N 2 2 360.477 3.389 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614353 499217942 /nfs/dbraw/zinc/21/79/42/499217942.db2.gz GTTQBTNHCDSIIY-ADLFWFRXSA-N 2 2 360.477 3.389 20 10 FGCDLP C[C@H]([NH2+]C[C@H](c1cccs1)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000756341198 722963072 /nfs/dbraw/zinc/96/30/72/722963072.db2.gz ICEZVLLLOLKFTO-WMLDXEAASA-N 2 2 363.502 3.232 20 10 FGCDLP COc1cc(Br)cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000768229744 723651146 /nfs/dbraw/zinc/65/11/46/723651146.db2.gz PAJAIPMLSNWTCI-UHFFFAOYSA-N 2 2 371.319 3.468 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000768229744 723651149 /nfs/dbraw/zinc/65/11/49/723651149.db2.gz PAJAIPMLSNWTCI-UHFFFAOYSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1cccc(Cl)c1O ZINC000806138323 725117563 /nfs/dbraw/zinc/11/75/63/725117563.db2.gz UBUNLHDKDXYZHC-QAPCUYQASA-N 2 2 353.938 3.360 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000810252227 725300061 /nfs/dbraw/zinc/30/00/61/725300061.db2.gz AMPBKARKTIRIGT-UONOGXRCSA-N 2 2 360.889 3.108 20 10 FGCDLP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815559404 727083858 /nfs/dbraw/zinc/08/38/58/727083858.db2.gz FZCJGGLNMSKOSR-ZIAGYGMSSA-N 2 2 359.436 3.088 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816549014 727174280 /nfs/dbraw/zinc/17/42/80/727174280.db2.gz AGMYOWGENFFYLI-DYVFJYSZSA-N 2 2 358.885 3.411 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816549014 727174282 /nfs/dbraw/zinc/17/42/82/727174282.db2.gz AGMYOWGENFFYLI-DYVFJYSZSA-N 2 2 358.885 3.411 20 10 FGCDLP Brc1cc(C[NH2+]C[C@H]2CCC[NH2+]2)ccc1N1CCCCC1 ZINC000841035263 730205144 /nfs/dbraw/zinc/20/51/44/730205144.db2.gz JLCFESFDESRXEY-OAHLLOKOSA-N 2 2 352.320 3.281 20 10 FGCDLP C[C@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817938001 727288642 /nfs/dbraw/zinc/28/86/42/727288642.db2.gz BCLNGNYHBVSCMT-HNNXBMFYSA-N 2 2 351.922 3.489 20 10 FGCDLP C[C@@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817982676 727290447 /nfs/dbraw/zinc/29/04/47/727290447.db2.gz VIMBEUAEENNHTG-KUHUBIRLSA-N 2 2 351.922 3.345 20 10 FGCDLP Oc1cc2c(cc1C[N@@H+]1CCC[C@@H](c3[nH+]cc4n3CCCC4)C1)OCO2 ZINC000281960446 498335505 /nfs/dbraw/zinc/33/55/05/498335505.db2.gz QSUVCOKOOWROCH-CQSZACIVSA-N 2 2 355.438 3.033 20 10 FGCDLP Oc1cc2c(cc1C[N@H+]1CCC[C@@H](c3[nH+]cc4n3CCCC4)C1)OCO2 ZINC000281960446 498335509 /nfs/dbraw/zinc/33/55/09/498335509.db2.gz QSUVCOKOOWROCH-CQSZACIVSA-N 2 2 355.438 3.033 20 10 FGCDLP COc1c(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000365828043 498658836 /nfs/dbraw/zinc/65/88/36/498658836.db2.gz TZTNSNKGCOFWSM-YJBOKZPZSA-N 2 2 371.437 3.092 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@H](C)c1cc(Br)ccc1O)C2 ZINC000363862453 499030028 /nfs/dbraw/zinc/03/00/28/499030028.db2.gz YYZVBSHVMPKNGQ-YPMHNXCESA-N 2 2 350.260 3.325 20 10 FGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470995 723686662 /nfs/dbraw/zinc/68/66/62/723686662.db2.gz PQUODXDWBJGIRB-WFASDCNBSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470995 723686663 /nfs/dbraw/zinc/68/66/63/723686663.db2.gz PQUODXDWBJGIRB-WFASDCNBSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470995 723686664 /nfs/dbraw/zinc/68/66/64/723686664.db2.gz PQUODXDWBJGIRB-WFASDCNBSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470995 723686666 /nfs/dbraw/zinc/68/66/66/723686666.db2.gz PQUODXDWBJGIRB-WFASDCNBSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000775521821 723997861 /nfs/dbraw/zinc/99/78/61/723997861.db2.gz BIUMYRKDUNEUAT-LNLFQRSKSA-N 2 2 352.906 3.464 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000848551320 731180113 /nfs/dbraw/zinc/18/01/13/731180113.db2.gz JPKAYTQVFHVRCO-MWLCHTKSSA-N 2 2 366.259 3.095 20 10 FGCDLP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185367439 495551043 /nfs/dbraw/zinc/55/10/43/495551043.db2.gz AEYRVGRWPIPREO-CYBMUJFWSA-N 2 2 360.329 3.377 20 10 FGCDLP C[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185367439 495551045 /nfs/dbraw/zinc/55/10/45/495551045.db2.gz AEYRVGRWPIPREO-CYBMUJFWSA-N 2 2 360.329 3.377 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)[C@H](C)C1 ZINC000187722474 496546683 /nfs/dbraw/zinc/54/66/83/496546683.db2.gz ZPXICJMOWZXGQR-JKIFEVAISA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)[C@H](C)C1 ZINC000187722474 496546688 /nfs/dbraw/zinc/54/66/88/496546688.db2.gz ZPXICJMOWZXGQR-JKIFEVAISA-N 2 2 356.457 3.458 20 10 FGCDLP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000187737305 496551237 /nfs/dbraw/zinc/55/12/37/496551237.db2.gz VSBXXQXKLKODFP-OAHLLOKOSA-N 2 2 367.484 3.271 20 10 FGCDLP COc1ccc(O)c([C@@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)c[nH+]2)c1 ZINC000273517951 496828341 /nfs/dbraw/zinc/82/83/41/496828341.db2.gz SXFNRAPCAHOBGT-OAHLLOKOSA-N 2 2 370.497 3.499 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Br)cc1O ZINC000279007604 497300713 /nfs/dbraw/zinc/30/07/13/497300713.db2.gz SKNNDMZQQGQPQB-RYUDHWBXSA-N 2 2 350.260 3.264 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@@H+]2CCCN(Cc3[nH+]ccn3C(C)C)CC2)c1 ZINC000372710238 499164642 /nfs/dbraw/zinc/16/46/42/499164642.db2.gz CEEPYWSDEGQNMX-QGZVFWFLSA-N 2 2 372.513 3.447 20 10 FGCDLP Cc1[nH+]c(C[NH2+]Cc2cc(Br)ccc2O)c2n1CCCC2 ZINC000373135784 499453138 /nfs/dbraw/zinc/45/31/38/499453138.db2.gz AJCKTINKBJTFNH-UHFFFAOYSA-N 2 2 350.260 3.286 20 10 FGCDLP CC[C@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)ccc1O ZINC000377757152 499729335 /nfs/dbraw/zinc/72/93/35/499729335.db2.gz UHUOUBKDTVZDTL-AAEUAGOBSA-N 2 2 350.260 3.476 20 10 FGCDLP CC[C@H]([NH2+][C@H]1CCc2[nH]c[nH+]c2C1)c1cc(Br)ccc1O ZINC000377757152 499729336 /nfs/dbraw/zinc/72/93/36/499729336.db2.gz UHUOUBKDTVZDTL-AAEUAGOBSA-N 2 2 350.260 3.476 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000781909799 724611161 /nfs/dbraw/zinc/61/11/61/724611161.db2.gz QUSXGYDDSZZBLL-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000781909799 724611165 /nfs/dbraw/zinc/61/11/65/724611165.db2.gz QUSXGYDDSZZBLL-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC000781909799 724611168 /nfs/dbraw/zinc/61/11/68/724611168.db2.gz QUSXGYDDSZZBLL-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c1 ZINC000781909799 724611172 /nfs/dbraw/zinc/61/11/72/724611172.db2.gz QUSXGYDDSZZBLL-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470993 723686573 /nfs/dbraw/zinc/68/65/73/723686573.db2.gz PQUODXDWBJGIRB-SWLSCSKDSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470993 723686574 /nfs/dbraw/zinc/68/65/74/723686574.db2.gz PQUODXDWBJGIRB-SWLSCSKDSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470993 723686575 /nfs/dbraw/zinc/68/65/75/723686575.db2.gz PQUODXDWBJGIRB-SWLSCSKDSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@@H]1C ZINC000769470993 723686576 /nfs/dbraw/zinc/68/65/76/723686576.db2.gz PQUODXDWBJGIRB-SWLSCSKDSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815559403 727083907 /nfs/dbraw/zinc/08/39/07/727083907.db2.gz FZCJGGLNMSKOSR-UONOGXRCSA-N 2 2 359.436 3.088 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2c(C3CC3)nc3sccn23)cc1 ZINC000841045465 730205602 /nfs/dbraw/zinc/20/56/02/730205602.db2.gz LFWKEJXTDDRBKE-MRXNPFEDSA-N 2 2 355.511 3.129 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cnc(-c3ccccn3)s2)cc1 ZINC000841045577 730205808 /nfs/dbraw/zinc/20/58/08/730205808.db2.gz NAIVTEXVIBZLDB-QGZVFWFLSA-N 2 2 353.495 3.061 20 10 FGCDLP CCOc1cccc(C[N@H+](C)C2CC[NH+](CCc3ccccn3)CC2)c1O ZINC000092645234 494694112 /nfs/dbraw/zinc/69/41/12/494694112.db2.gz LFYFYHIUSDMCLE-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP CCOc1cccc(C[N@@H+](C)C2CC[NH+](CCc3ccccn3)CC2)c1O ZINC000092645234 494694121 /nfs/dbraw/zinc/69/41/21/494694121.db2.gz LFYFYHIUSDMCLE-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc([N+](=O)[O-])ccc1O ZINC000273573451 496844355 /nfs/dbraw/zinc/84/43/55/496844355.db2.gz LDDGCGVQEDWFTD-CQSZACIVSA-N 2 2 359.426 3.092 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H](C)c3cscn3)CC2)cc1 ZINC000271152043 497274498 /nfs/dbraw/zinc/27/44/98/497274498.db2.gz QOKDOKRXOWSXAW-MRXNPFEDSA-N 2 2 360.527 3.015 20 10 FGCDLP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3cnc(C)s3)C[C@H]2C)c1O ZINC000369591953 499423715 /nfs/dbraw/zinc/42/37/15/499423715.db2.gz PAOIXIJPZJCNJC-DYVFJYSZSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@H]2C)c1O ZINC000369591953 499423716 /nfs/dbraw/zinc/42/37/16/499423716.db2.gz PAOIXIJPZJCNJC-DYVFJYSZSA-N 2 2 361.511 3.166 20 10 FGCDLP Cn1cc([C@H]2[C@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@@H+]2C)cn1 ZINC000372976207 499445523 /nfs/dbraw/zinc/44/55/23/499445523.db2.gz IZDWBVAWKJFYSX-KPZWWZAWSA-N 2 2 366.868 3.091 20 10 FGCDLP Cn1cc([C@H]2[C@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@H+]2C)cn1 ZINC000372976207 499445524 /nfs/dbraw/zinc/44/55/24/499445524.db2.gz IZDWBVAWKJFYSX-KPZWWZAWSA-N 2 2 366.868 3.091 20 10 FGCDLP COc1cc(Br)cc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c1O ZINC000093643859 700452712 /nfs/dbraw/zinc/45/27/12/700452712.db2.gz HCWBTVIFXKWHAS-RISCZKNCSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c1O ZINC000093643859 700452717 /nfs/dbraw/zinc/45/27/17/700452717.db2.gz HCWBTVIFXKWHAS-RISCZKNCSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1O ZINC000093643859 700452720 /nfs/dbraw/zinc/45/27/20/700452720.db2.gz HCWBTVIFXKWHAS-RISCZKNCSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1O ZINC000093643859 700452724 /nfs/dbraw/zinc/45/27/24/700452724.db2.gz HCWBTVIFXKWHAS-RISCZKNCSA-N 2 2 357.292 3.078 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](N[C@H]2CC[NH+]3CCC[C@H]3C2)C1 ZINC000754795923 722945987 /nfs/dbraw/zinc/94/59/87/722945987.db2.gz RDIOMYUCSKBWES-FHWLQOOXSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](N[C@H]2CC[NH+]3CCC[C@H]3C2)C1 ZINC000754795923 722945988 /nfs/dbraw/zinc/94/59/88/722945988.db2.gz RDIOMYUCSKBWES-FHWLQOOXSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000754795923 722945989 /nfs/dbraw/zinc/94/59/89/722945989.db2.gz RDIOMYUCSKBWES-FHWLQOOXSA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000754795923 722945990 /nfs/dbraw/zinc/94/59/90/722945990.db2.gz RDIOMYUCSKBWES-FHWLQOOXSA-N 2 2 363.933 3.226 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165401 723559152 /nfs/dbraw/zinc/55/91/52/723559152.db2.gz HQAPOVXFWNLTIJ-OWCLPIDISA-N 2 2 351.922 3.310 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165401 723559154 /nfs/dbraw/zinc/55/91/54/723559154.db2.gz HQAPOVXFWNLTIJ-OWCLPIDISA-N 2 2 351.922 3.310 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1O ZINC000806149890 725118136 /nfs/dbraw/zinc/11/81/36/725118136.db2.gz YOMHESPXCQLLET-KSZLIROESA-N 2 2 352.906 3.464 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642759 727184434 /nfs/dbraw/zinc/18/44/34/727184434.db2.gz KCKMNEOCMBZFFQ-KRWDZBQOSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642759 727184437 /nfs/dbraw/zinc/18/44/37/727184437.db2.gz KCKMNEOCMBZFFQ-KRWDZBQOSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816642759 727184438 /nfs/dbraw/zinc/18/44/38/727184438.db2.gz KCKMNEOCMBZFFQ-KRWDZBQOSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816642759 727184440 /nfs/dbraw/zinc/18/44/40/727184440.db2.gz KCKMNEOCMBZFFQ-KRWDZBQOSA-N 2 2 369.303 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC000840876058 730186692 /nfs/dbraw/zinc/18/66/92/730186692.db2.gz JJKRZEFRAOIMOB-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Br)c(F)cc1O ZINC000925778158 759536294 /nfs/dbraw/zinc/53/62/94/759536294.db2.gz RRHHCCFFZQXPTK-BDAKNGLRSA-N 2 2 367.209 3.189 20 10 FGCDLP CCOc1ccc(O)c(C[N@H+](C)C2CC[NH+](CCc3ccccn3)CC2)c1 ZINC000092645340 494694610 /nfs/dbraw/zinc/69/46/10/494694610.db2.gz UDRHDRPMBRJNMJ-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP CCOc1ccc(O)c(C[N@@H+](C)C2CC[NH+](CCc3ccccn3)CC2)c1 ZINC000092645340 494694617 /nfs/dbraw/zinc/69/46/17/494694617.db2.gz UDRHDRPMBRJNMJ-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+]1CCOCC1)c1ccc(F)cc1O ZINC000185197616 496700745 /nfs/dbraw/zinc/70/07/45/496700745.db2.gz GVAFLCAKXVNAPB-MRXNPFEDSA-N 2 2 374.456 3.093 20 10 FGCDLP C[C@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)c[nH+]1)c1cc([N+](=O)[O-])ccc1O ZINC000273527156 496830303 /nfs/dbraw/zinc/83/03/03/496830303.db2.gz VOOVBSFWECBXAG-BBRMVZONSA-N 2 2 371.441 3.009 20 10 FGCDLP C[NH+]1CCN(C[C@@H]2CCC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377624057 499712388 /nfs/dbraw/zinc/71/23/88/499712388.db2.gz KNDKKPFIOFWLQG-AWEZNQCLSA-N 2 2 372.340 3.158 20 10 FGCDLP C[NH+]1CCN(C[C@@H]2CCC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377624057 499712390 /nfs/dbraw/zinc/71/23/90/499712390.db2.gz KNDKKPFIOFWLQG-AWEZNQCLSA-N 2 2 372.340 3.158 20 10 FGCDLP COc1cc(Br)cc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c1O ZINC000093643857 700452932 /nfs/dbraw/zinc/45/29/32/700452932.db2.gz HCWBTVIFXKWHAS-BXUZGUMPSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c1O ZINC000093643857 700452934 /nfs/dbraw/zinc/45/29/34/700452934.db2.gz HCWBTVIFXKWHAS-BXUZGUMPSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1O ZINC000093643857 700452938 /nfs/dbraw/zinc/45/29/38/700452938.db2.gz HCWBTVIFXKWHAS-BXUZGUMPSA-N 2 2 357.292 3.078 20 10 FGCDLP COc1cc(Br)cc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1O ZINC000093643857 700452941 /nfs/dbraw/zinc/45/29/41/700452941.db2.gz HCWBTVIFXKWHAS-BXUZGUMPSA-N 2 2 357.292 3.078 20 10 FGCDLP C[N@H+](Cc1c(O)cccc1Cl)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000779225706 724400849 /nfs/dbraw/zinc/40/08/49/724400849.db2.gz VCPLWBBYLSMBJV-HXUWFJFHSA-N 2 2 360.885 3.114 20 10 FGCDLP C[N@@H+](Cc1c(O)cccc1Cl)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000779225706 724400850 /nfs/dbraw/zinc/40/08/50/724400850.db2.gz VCPLWBBYLSMBJV-HXUWFJFHSA-N 2 2 360.885 3.114 20 10 FGCDLP C[NH+](Cc1c(O)cccc1Cl)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000779225706 724400852 /nfs/dbraw/zinc/40/08/52/724400852.db2.gz VCPLWBBYLSMBJV-HXUWFJFHSA-N 2 2 360.885 3.114 20 10 FGCDLP C[NH+](Cc1c(O)cccc1Cl)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000779225706 724400854 /nfs/dbraw/zinc/40/08/54/724400854.db2.gz VCPLWBBYLSMBJV-HXUWFJFHSA-N 2 2 360.885 3.114 20 10 FGCDLP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774114582 723860744 /nfs/dbraw/zinc/86/07/44/723860744.db2.gz GNMDYLVAGFCNIA-LBPRGKRZSA-N 2 2 360.329 3.376 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(Br)s2)cc1 ZINC000841042026 730205499 /nfs/dbraw/zinc/20/54/99/730205499.db2.gz GUTYBLMELYAEOL-CQSZACIVSA-N 2 2 354.317 3.366 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000848548074 731179333 /nfs/dbraw/zinc/17/93/33/731179333.db2.gz ULLNFWSDQBXYFZ-PWSUYJOCSA-N 2 2 366.259 3.025 20 10 FGCDLP C[N@@H+]1CC[C@H](N[C@@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137230 732184671 /nfs/dbraw/zinc/18/46/71/732184671.db2.gz KBHUYCIHMSQWDD-ZWKOTPCHSA-N 2 2 365.949 3.472 20 10 FGCDLP C[N@H+]1CC[C@H](N[C@@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137230 732184673 /nfs/dbraw/zinc/18/46/73/732184673.db2.gz KBHUYCIHMSQWDD-ZWKOTPCHSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@H](N[C@@H]2CCC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137230 732184674 /nfs/dbraw/zinc/18/46/74/732184674.db2.gz KBHUYCIHMSQWDD-ZWKOTPCHSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@H](N[C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137230 732184675 /nfs/dbraw/zinc/18/46/75/732184675.db2.gz KBHUYCIHMSQWDD-ZWKOTPCHSA-N 2 2 365.949 3.472 20 10 FGCDLP CC[NH+]1CCN(c2ccc(CNc3cc[nH+]c(C4CC4)n3)cc2F)CC1 ZINC000110586742 494992511 /nfs/dbraw/zinc/99/25/11/494992511.db2.gz JTFQIWZJPHYCRS-UHFFFAOYSA-N 2 2 355.461 3.247 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H](C)c3cncs3)CC2)cc1 ZINC000162803340 496415609 /nfs/dbraw/zinc/41/56/09/496415609.db2.gz SZYRKBIQVAHPTO-MRXNPFEDSA-N 2 2 360.527 3.015 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1O ZINC000187798581 496575822 /nfs/dbraw/zinc/57/58/22/496575822.db2.gz OOGWCWZAYQQBQT-DQYPLSBCSA-N 2 2 354.441 3.089 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278895001 497259075 /nfs/dbraw/zinc/25/90/75/497259075.db2.gz YVQPYOIXZZFCJX-OLZOCXBDSA-N 2 2 360.329 3.376 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(F)c2O)[C@@H]1c1cnn(C)c1 ZINC000364714334 498108348 /nfs/dbraw/zinc/10/83/48/498108348.db2.gz HKUXJIVAESNYGO-HNAYVOBHSA-N 2 2 360.477 3.170 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(F)c2O)[C@@H]1c1cnn(C)c1 ZINC000364714334 498108351 /nfs/dbraw/zinc/10/83/51/498108351.db2.gz HKUXJIVAESNYGO-HNAYVOBHSA-N 2 2 360.477 3.170 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cccc(F)c2O)[C@@H]1c1cnn(C)c1 ZINC000364714334 498108355 /nfs/dbraw/zinc/10/83/55/498108355.db2.gz HKUXJIVAESNYGO-HNAYVOBHSA-N 2 2 360.477 3.170 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cccc(F)c2O)[C@@H]1c1cnn(C)c1 ZINC000364714334 498108359 /nfs/dbraw/zinc/10/83/59/498108359.db2.gz HKUXJIVAESNYGO-HNAYVOBHSA-N 2 2 360.477 3.170 20 10 FGCDLP CN1CC[NH+](CC2CC[NH+](Cc3cc(Cl)cc(Cl)c3O)CC2)CC1 ZINC000289440399 498146684 /nfs/dbraw/zinc/14/66/84/498146684.db2.gz LVAVARAZHZLSMU-UHFFFAOYSA-N 2 2 372.340 3.158 20 10 FGCDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)c1ccc(N3CCC(O)CC3)cc1)CCC2 ZINC000363756965 498976913 /nfs/dbraw/zinc/97/69/13/498976913.db2.gz JFBYJBNZFRGLQJ-HKUYNNGSSA-N 2 2 368.525 3.381 20 10 FGCDLP CCOc1cccc(C[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1O ZINC000370405624 499217024 /nfs/dbraw/zinc/21/70/24/499217024.db2.gz KZGIFEHJCZKVJM-PXNSSMCTSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1cccc(C[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1O ZINC000370405624 499217027 /nfs/dbraw/zinc/21/70/27/499217027.db2.gz KZGIFEHJCZKVJM-PXNSSMCTSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1cccc(C[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1O ZINC000370405624 499217028 /nfs/dbraw/zinc/21/70/28/499217028.db2.gz KZGIFEHJCZKVJM-PXNSSMCTSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1cccc(C[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1O ZINC000370405624 499217030 /nfs/dbraw/zinc/21/70/30/499217030.db2.gz KZGIFEHJCZKVJM-PXNSSMCTSA-N 2 2 355.482 3.311 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000373036877 499448432 /nfs/dbraw/zinc/44/84/32/499448432.db2.gz NOJVJXSARZIMOD-CQSZACIVSA-N 2 2 357.292 3.079 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000373036877 499448433 /nfs/dbraw/zinc/44/84/33/499448433.db2.gz NOJVJXSARZIMOD-CQSZACIVSA-N 2 2 357.292 3.079 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000779060083 724385743 /nfs/dbraw/zinc/38/57/43/724385743.db2.gz CWHNGADHQAQQDV-YPMHNXCESA-N 2 2 350.260 3.325 20 10 FGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470991 723686673 /nfs/dbraw/zinc/68/66/73/723686673.db2.gz PQUODXDWBJGIRB-IUODEOHRSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470991 723686674 /nfs/dbraw/zinc/68/66/74/723686674.db2.gz PQUODXDWBJGIRB-IUODEOHRSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470991 723686676 /nfs/dbraw/zinc/68/66/76/723686676.db2.gz PQUODXDWBJGIRB-IUODEOHRSA-N 2 2 371.319 3.468 20 10 FGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Br)cc(OC)c2O)C[C@H]1C ZINC000769470991 723686677 /nfs/dbraw/zinc/68/66/77/723686677.db2.gz PQUODXDWBJGIRB-IUODEOHRSA-N 2 2 371.319 3.468 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(Cl)cc1O ZINC000841748391 730270475 /nfs/dbraw/zinc/27/04/75/730270475.db2.gz XOUWVWGSURSLFU-CQSZACIVSA-N 2 2 360.889 3.043 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1ccc(Br)cc1O ZINC000850557060 731372858 /nfs/dbraw/zinc/37/28/58/731372858.db2.gz KPJQNZYIISRDQT-IUODEOHRSA-N 2 2 369.303 3.059 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@@H](C[NH3+])[C@H](C(F)(F)F)C2)c1 ZINC000873228085 735740217 /nfs/dbraw/zinc/74/02/17/735740217.db2.gz PFASZCUFTGJNOR-GHMZBOCLSA-N 2 2 367.209 3.032 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@@H](C[NH3+])[C@H](C(F)(F)F)C2)c1 ZINC000873228085 735740219 /nfs/dbraw/zinc/74/02/19/735740219.db2.gz PFASZCUFTGJNOR-GHMZBOCLSA-N 2 2 367.209 3.032 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc([N+](=O)[O-])ccc1O ZINC000273417086 496800747 /nfs/dbraw/zinc/80/07/47/496800747.db2.gz RAZOPGWXHFPUDE-CQSZACIVSA-N 2 2 359.426 3.092 20 10 FGCDLP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1O ZINC000282205170 498422613 /nfs/dbraw/zinc/42/26/13/498422613.db2.gz HARQGNGWFOBOLA-LBPRGKRZSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1O ZINC000282205170 498422621 /nfs/dbraw/zinc/42/26/21/498422621.db2.gz HARQGNGWFOBOLA-LBPRGKRZSA-N 2 2 360.329 3.376 20 10 FGCDLP Cn1cc([C@H]2[C@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@@H+]2C)cn1 ZINC000363176194 498686991 /nfs/dbraw/zinc/68/69/91/498686991.db2.gz GMRVDHVEAZNQSI-HTAPYJJXSA-N 2 2 364.493 3.452 20 10 FGCDLP Cn1cc([C@H]2[C@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@H+]2C)cn1 ZINC000363176194 498686996 /nfs/dbraw/zinc/68/69/96/498686996.db2.gz GMRVDHVEAZNQSI-HTAPYJJXSA-N 2 2 364.493 3.452 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1C ZINC000363860961 499029058 /nfs/dbraw/zinc/02/90/58/499029058.db2.gz VXMWMMSPONPHCQ-ZWOKBUDYSA-N 2 2 356.514 3.476 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1C ZINC000363860961 499029065 /nfs/dbraw/zinc/02/90/65/499029065.db2.gz VXMWMMSPONPHCQ-ZWOKBUDYSA-N 2 2 356.514 3.476 20 10 FGCDLP C[C@@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(N2CCC(O)CC2)cc1 ZINC000367439210 499199104 /nfs/dbraw/zinc/19/91/04/499199104.db2.gz SERGCPOTUNDWIO-MRXNPFEDSA-N 2 2 354.498 3.031 20 10 FGCDLP CCOc1ccc(O)c(C[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000370409695 499218111 /nfs/dbraw/zinc/21/81/11/499218111.db2.gz IBYVQXQXCOXTOJ-UWJYYQICSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1ccc(O)c(C[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000370409695 499218112 /nfs/dbraw/zinc/21/81/12/499218112.db2.gz IBYVQXQXCOXTOJ-UWJYYQICSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1ccc(O)c(C[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1 ZINC000370409695 499218113 /nfs/dbraw/zinc/21/81/13/499218113.db2.gz IBYVQXQXCOXTOJ-UWJYYQICSA-N 2 2 355.482 3.311 20 10 FGCDLP CCOc1ccc(O)c(C[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1 ZINC000370409695 499218114 /nfs/dbraw/zinc/21/81/14/499218114.db2.gz IBYVQXQXCOXTOJ-UWJYYQICSA-N 2 2 355.482 3.311 20 10 FGCDLP C[C@@H]([NH2+]CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1ccc(F)cc1O ZINC000368225995 499275653 /nfs/dbraw/zinc/27/56/53/499275653.db2.gz YQHZOHNMQPKQQZ-MRXNPFEDSA-N 3 2 363.521 3.378 20 10 FGCDLP Oc1c(Cl)cc(Cl)cc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000530248087 503893319 /nfs/dbraw/zinc/89/33/19/503893319.db2.gz FQYKWQLFFJBQQB-HNNXBMFYSA-N 2 2 359.297 3.290 20 10 FGCDLP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000788817216 725089629 /nfs/dbraw/zinc/08/96/29/725089629.db2.gz XWCMHBSHVSUIGR-ZDUSSCGKSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000788817216 725089630 /nfs/dbraw/zinc/08/96/30/725089630.db2.gz XWCMHBSHVSUIGR-ZDUSSCGKSA-N 2 2 359.436 3.088 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000809767541 725266620 /nfs/dbraw/zinc/26/66/20/725266620.db2.gz NMAVSKLBASQPBT-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000809767541 725266621 /nfs/dbraw/zinc/26/66/21/725266621.db2.gz NMAVSKLBASQPBT-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)c1 ZINC000809767541 725266622 /nfs/dbraw/zinc/26/66/22/725266622.db2.gz NMAVSKLBASQPBT-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)c1 ZINC000809767541 725266623 /nfs/dbraw/zinc/26/66/23/725266623.db2.gz NMAVSKLBASQPBT-XJKSGUPXSA-N 2 2 353.304 3.379 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cnc(-c3ccncc3)s2)cc1 ZINC000841046296 730205969 /nfs/dbraw/zinc/20/59/69/730205969.db2.gz ZLPGRLWDGFEVMV-GOSISDBHSA-N 2 2 353.495 3.061 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+]CCCn2cc[nH+]c2)c1O ZINC000848514433 731173739 /nfs/dbraw/zinc/17/37/39/731173739.db2.gz OHISNBLJZNAKSU-LLVKDONJSA-N 2 2 354.248 3.101 20 10 FGCDLP CC(C)OCC[NH+]1CCC([NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000858148062 732186006 /nfs/dbraw/zinc/18/60/06/732186006.db2.gz JVKBORXNFWTDMQ-UHFFFAOYSA-N 2 2 355.473 3.010 20 10 FGCDLP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2O)CC1 ZINC000185014210 496623189 /nfs/dbraw/zinc/62/31/89/496623189.db2.gz NPELRYZYVSXOCO-ZDUSSCGKSA-N 2 2 360.329 3.377 20 10 FGCDLP CC[NH+]1CCN(c2ccc(CNc3[nH]c4ccccc4[nH+]3)cc2F)CC1 ZINC000301865020 498300909 /nfs/dbraw/zinc/30/09/09/498300909.db2.gz GXPWOAVORXDESI-UHFFFAOYSA-N 2 2 353.445 3.456 20 10 FGCDLP C[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(F)c(F)c1O ZINC000290209558 498465521 /nfs/dbraw/zinc/46/55/21/498465521.db2.gz HGBCBMWTRHOVEU-ZDUSSCGKSA-N 2 2 365.424 3.247 20 10 FGCDLP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287612019 498813903 /nfs/dbraw/zinc/81/39/03/498813903.db2.gz JIMJXVQNGJTIIN-BLLLJJGKSA-N 2 2 360.329 3.376 20 10 FGCDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)c1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000366233562 498834755 /nfs/dbraw/zinc/83/47/55/498834755.db2.gz RMDFSTMMRGPAGF-SJLPKXTDSA-N 2 2 372.488 3.395 20 10 FGCDLP COC1CCN(c2ccc(C[N@@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)cc2)CC1 ZINC000294949250 498859682 /nfs/dbraw/zinc/85/96/82/498859682.db2.gz MKIQHCUTHVRMMJ-GOSISDBHSA-N 2 2 354.498 3.405 20 10 FGCDLP COC1CCN(c2ccc(C[N@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)cc2)CC1 ZINC000294949250 498859688 /nfs/dbraw/zinc/85/96/88/498859688.db2.gz MKIQHCUTHVRMMJ-GOSISDBHSA-N 2 2 354.498 3.405 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c(O)c1C ZINC000363860959 499029334 /nfs/dbraw/zinc/02/93/34/499029334.db2.gz VXMWMMSPONPHCQ-SQGPQFPESA-N 2 2 356.514 3.476 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c(O)c1C ZINC000363860959 499029339 /nfs/dbraw/zinc/02/93/39/499029339.db2.gz VXMWMMSPONPHCQ-SQGPQFPESA-N 2 2 356.514 3.476 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccnc3)C2)c1 ZINC000363862385 499029568 /nfs/dbraw/zinc/02/95/68/499029568.db2.gz ITIAZRLUGWPIIF-SJLPKXTDSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccnc3)C2)c1 ZINC000363862385 499029576 /nfs/dbraw/zinc/02/95/76/499029576.db2.gz ITIAZRLUGWPIIF-SJLPKXTDSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccnc3)C2)c1 ZINC000363862383 499029634 /nfs/dbraw/zinc/02/96/34/499029634.db2.gz ITIAZRLUGWPIIF-AEFFLSMTSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)c1 ZINC000363862383 499029641 /nfs/dbraw/zinc/02/96/41/499029641.db2.gz ITIAZRLUGWPIIF-AEFFLSMTSA-N 2 2 355.482 3.359 20 10 FGCDLP CC[C@@H](c1ccccc1O)[N@H+](C)C[C@@H]1C[C@H](F)CN1Cc1[nH+]ccn1C ZINC000367376459 499191077 /nfs/dbraw/zinc/19/10/77/499191077.db2.gz ATXLZXUNYYLGQS-BQFCYCMXSA-N 2 2 360.477 3.121 20 10 FGCDLP CC[C@@H](c1ccccc1O)[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1[nH+]ccn1C ZINC000367376459 499191080 /nfs/dbraw/zinc/19/10/80/499191080.db2.gz ATXLZXUNYYLGQS-BQFCYCMXSA-N 2 2 360.477 3.121 20 10 FGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000373232984 499459088 /nfs/dbraw/zinc/45/90/88/499459088.db2.gz RTJKMRARPGXDKM-GFCCVEGCSA-N 2 2 350.260 3.268 20 10 FGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000373232984 499459089 /nfs/dbraw/zinc/45/90/89/499459089.db2.gz RTJKMRARPGXDKM-GFCCVEGCSA-N 2 2 350.260 3.268 20 10 FGCDLP C[N@H+](Cc1c(O)cccc1Cl)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000779225705 724400821 /nfs/dbraw/zinc/40/08/21/724400821.db2.gz VCPLWBBYLSMBJV-FQEVSTJZSA-N 2 2 360.885 3.114 20 10 FGCDLP C[N@@H+](Cc1c(O)cccc1Cl)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000779225705 724400823 /nfs/dbraw/zinc/40/08/23/724400823.db2.gz VCPLWBBYLSMBJV-FQEVSTJZSA-N 2 2 360.885 3.114 20 10 FGCDLP C[NH+](Cc1c(O)cccc1Cl)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000779225705 724400824 /nfs/dbraw/zinc/40/08/24/724400824.db2.gz VCPLWBBYLSMBJV-FQEVSTJZSA-N 2 2 360.885 3.114 20 10 FGCDLP C[NH+](Cc1c(O)cccc1Cl)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000779225705 724400826 /nfs/dbraw/zinc/40/08/26/724400826.db2.gz VCPLWBBYLSMBJV-FQEVSTJZSA-N 2 2 360.885 3.114 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)[C@@H](C)C1 ZINC000756582421 722967205 /nfs/dbraw/zinc/96/72/05/722967205.db2.gz INUUUXAFIIXHFW-IYOUNJFTSA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)[C@@H](C)C1 ZINC000756582421 722967206 /nfs/dbraw/zinc/96/72/06/722967206.db2.gz INUUUXAFIIXHFW-IYOUNJFTSA-N 2 2 356.457 3.458 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217028 725297701 /nfs/dbraw/zinc/29/77/01/725297701.db2.gz VDZHJAMPVQCKSZ-FMKPAKJESA-N 2 2 358.404 3.315 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217028 725297703 /nfs/dbraw/zinc/29/77/03/725297703.db2.gz VDZHJAMPVQCKSZ-FMKPAKJESA-N 2 2 358.404 3.315 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(Br)cc(F)c1O ZINC000817987557 727290774 /nfs/dbraw/zinc/29/07/74/727290774.db2.gz UITXSUNGYSCSNR-MEWQQHAOSA-N 2 2 357.267 3.333 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2ccccc2C[NH+]2CCOCC2)cc1Cl ZINC000825058962 729369250 /nfs/dbraw/zinc/36/92/50/729369250.db2.gz PFKATWFMDYWTSU-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP Oc1cccc(Br)c1C[NH2+]C1CCN(c2cccc[nH+]2)CC1 ZINC000858099105 732180213 /nfs/dbraw/zinc/18/02/13/732180213.db2.gz WBRTZKKWIFYMAE-UHFFFAOYSA-N 2 2 362.271 3.308 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CCC([NH+]3CCCC3)CC2)c1O ZINC000127701600 494983844 /nfs/dbraw/zinc/98/38/44/494983844.db2.gz LSAMVWVVKJQAFF-UHFFFAOYSA-N 2 2 369.303 3.224 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000186126735 495865488 /nfs/dbraw/zinc/86/54/88/495865488.db2.gz UFHASMNEOJYTKJ-XVSDVWIESA-N 2 2 352.906 3.464 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1O ZINC000186566136 496049025 /nfs/dbraw/zinc/04/90/25/496049025.db2.gz VOFHZWWWJVSLMA-CHWSQXEVSA-N 2 2 360.329 3.376 20 10 FGCDLP COc1ccc(O)c([C@@H](C)Nc2ccc(N3CC[C@H]([NH+](C)C)C3)c[nH+]2)c1 ZINC000273545535 496835650 /nfs/dbraw/zinc/83/56/50/496835650.db2.gz ZIRNOIMDXWVEPO-ZBFHGGJFSA-N 2 2 356.470 3.109 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc([N+](=O)[O-])ccc1O ZINC000273573447 496843755 /nfs/dbraw/zinc/84/37/55/496843755.db2.gz LDDGCGVQEDWFTD-AWEZNQCLSA-N 2 2 359.426 3.092 20 10 FGCDLP COc1c(O)c(C[NH2+]CCCn2c(C)[nH+]c3ccccc32)ccc1[N+](=O)[O-] ZINC000278931244 497271984 /nfs/dbraw/zinc/27/19/84/497271984.db2.gz WIUGUVYIHHZGQG-UHFFFAOYSA-N 2 2 370.409 3.147 20 10 FGCDLP Oc1cc2c(cc1C[N@@H+]1CCC[C@H](c3[nH+]cc4n3CCCC4)C1)OCO2 ZINC000281960440 498334278 /nfs/dbraw/zinc/33/42/78/498334278.db2.gz QSUVCOKOOWROCH-AWEZNQCLSA-N 2 2 355.438 3.033 20 10 FGCDLP Oc1cc2c(cc1C[N@H+]1CCC[C@H](c3[nH+]cc4n3CCCC4)C1)OCO2 ZINC000281960440 498334286 /nfs/dbraw/zinc/33/42/86/498334286.db2.gz QSUVCOKOOWROCH-AWEZNQCLSA-N 2 2 355.438 3.033 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c(O)c1 ZINC000363176234 498686932 /nfs/dbraw/zinc/68/69/32/498686932.db2.gz GZDJDGMXUMPKLH-DYESRHJHSA-N 2 2 372.513 3.087 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c(O)c1 ZINC000363176234 498686936 /nfs/dbraw/zinc/68/69/36/498686936.db2.gz GZDJDGMXUMPKLH-DYESRHJHSA-N 2 2 372.513 3.087 20 10 FGCDLP COc1c(O)c(C[NH+]2CCC(Nc3cccc(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000370527177 499228967 /nfs/dbraw/zinc/22/89/67/499228967.db2.gz HVRVFESZLVTDHK-UHFFFAOYSA-N 2 2 372.425 3.089 20 10 FGCDLP C[N@H+](Cc1c(O)ccc(Cl)c1F)C1CC[NH+](C2CCOCC2)CC1 ZINC000375462857 499522096 /nfs/dbraw/zinc/52/20/96/499522096.db2.gz UWDCXCFACBWSRG-UHFFFAOYSA-N 2 2 356.869 3.260 20 10 FGCDLP C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CC[NH+](C2CCOCC2)CC1 ZINC000375462857 499522098 /nfs/dbraw/zinc/52/20/98/499522098.db2.gz UWDCXCFACBWSRG-UHFFFAOYSA-N 2 2 356.869 3.260 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](CCc3ccncc3)CC2)cc1F ZINC000377925083 499748669 /nfs/dbraw/zinc/74/86/69/499748669.db2.gz UCMCSOMMRYPPGL-UHFFFAOYSA-N 2 2 370.516 3.426 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C2CC[NH+](CCc3ccncc3)CC2)cc1F ZINC000377925083 499748671 /nfs/dbraw/zinc/74/86/71/499748671.db2.gz UCMCSOMMRYPPGL-UHFFFAOYSA-N 2 2 370.516 3.426 20 10 FGCDLP C[NH+]1CCN(C[C@@H]([NH2+]Cc2c(O)cccc2Cl)c2ccccc2)CC1 ZINC000733327039 722495737 /nfs/dbraw/zinc/49/57/37/722495737.db2.gz LQGRMXARRXYPON-LJQANCHMSA-N 2 2 359.901 3.124 20 10 FGCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500389 723996535 /nfs/dbraw/zinc/99/65/35/723996535.db2.gz JEDLBPFJMXZRFQ-IAGOWNOFSA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500389 723996537 /nfs/dbraw/zinc/99/65/37/723996537.db2.gz JEDLBPFJMXZRFQ-IAGOWNOFSA-N 2 2 367.921 3.029 20 10 FGCDLP Cc1cc(Br)cc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816642667 727184369 /nfs/dbraw/zinc/18/43/69/727184369.db2.gz HCWNNNCLPKLGKS-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816642667 727184370 /nfs/dbraw/zinc/18/43/70/727184370.db2.gz HCWNNNCLPKLGKS-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642667 727184371 /nfs/dbraw/zinc/18/43/71/727184371.db2.gz HCWNNNCLPKLGKS-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642667 727184373 /nfs/dbraw/zinc/18/43/73/727184373.db2.gz HCWNNNCLPKLGKS-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)c1O ZINC000827857148 729436044 /nfs/dbraw/zinc/43/60/44/729436044.db2.gz WYRMRCOLSPZALP-MRXNPFEDSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)c1O ZINC000827857148 729436045 /nfs/dbraw/zinc/43/60/45/729436045.db2.gz WYRMRCOLSPZALP-MRXNPFEDSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000840900988 730189266 /nfs/dbraw/zinc/18/92/66/730189266.db2.gz VVWCMNWBMNNYCD-FQEVSTJZSA-N 2 2 360.885 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000840900988 730189267 /nfs/dbraw/zinc/18/92/67/730189267.db2.gz VVWCMNWBMNNYCD-FQEVSTJZSA-N 2 2 360.885 3.081 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c1O ZINC000092071669 494778655 /nfs/dbraw/zinc/77/86/55/494778655.db2.gz AOLMHJUHANJAMD-NSHDSACASA-N 2 2 366.259 3.266 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c1O ZINC000092071669 494778657 /nfs/dbraw/zinc/77/86/57/494778657.db2.gz AOLMHJUHANJAMD-NSHDSACASA-N 2 2 366.259 3.266 20 10 FGCDLP C[C@H](C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1O)CN1CC[NH+](C)CC1 ZINC000185344586 495539741 /nfs/dbraw/zinc/53/97/41/495539741.db2.gz QQASHFSVYRCMAL-CHWSQXEVSA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)c(F)c1O ZINC000187680354 496532896 /nfs/dbraw/zinc/53/28/96/496532896.db2.gz IWWPACVEHJMHJU-ZDUSSCGKSA-N 2 2 350.409 3.462 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2([NH2+]Cc3cc(OC)ccc3O)CCCC2)no1 ZINC000271833418 497463544 /nfs/dbraw/zinc/46/35/44/497463544.db2.gz FKRQVTPPBRIJKZ-UHFFFAOYSA-N 2 2 374.485 3.185 20 10 FGCDLP CC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(Cl)c1O ZINC000287626905 498819171 /nfs/dbraw/zinc/81/91/71/498819171.db2.gz KCRVAUNPBJGCEC-GOSISDBHSA-N 2 2 374.916 3.433 20 10 FGCDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)c1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000366233550 498834913 /nfs/dbraw/zinc/83/49/13/498834913.db2.gz RMDFSTMMRGPAGF-AEFFLSMTSA-N 2 2 372.488 3.395 20 10 FGCDLP COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1O ZINC000370176150 499193246 /nfs/dbraw/zinc/19/32/46/499193246.db2.gz VGRMVJSDFBDHHM-KSSFIOAISA-N 2 2 361.873 3.232 20 10 FGCDLP COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1O ZINC000370176150 499193248 /nfs/dbraw/zinc/19/32/48/499193248.db2.gz VGRMVJSDFBDHHM-KSSFIOAISA-N 2 2 361.873 3.232 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000373251109 499459790 /nfs/dbraw/zinc/45/97/90/499459790.db2.gz CNLKMVALEQUINJ-INIZCTEOSA-N 2 2 355.482 3.154 20 10 FGCDLP CC[C@@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)ccc1O ZINC000377757154 499729212 /nfs/dbraw/zinc/72/92/12/499729212.db2.gz UHUOUBKDTVZDTL-WCQYABFASA-N 2 2 350.260 3.476 20 10 FGCDLP CC[C@@H]([NH2+][C@H]1CCc2[nH]c[nH+]c2C1)c1cc(Br)ccc1O ZINC000377757154 499729214 /nfs/dbraw/zinc/72/92/14/499729214.db2.gz UHUOUBKDTVZDTL-WCQYABFASA-N 2 2 350.260 3.476 20 10 FGCDLP CC[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1cc(Cl)ccc1O ZINC000775498025 723995988 /nfs/dbraw/zinc/99/59/88/723995988.db2.gz FXYHAVFDWZDCPL-GOSISDBHSA-N 2 2 353.938 3.360 20 10 FGCDLP CC[C@@H]([NH2+]CC1CCN(CC[NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000775498025 723995992 /nfs/dbraw/zinc/99/59/92/723995992.db2.gz FXYHAVFDWZDCPL-GOSISDBHSA-N 2 2 353.938 3.360 20 10 FGCDLP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815557006 727084048 /nfs/dbraw/zinc/08/40/48/727084048.db2.gz KHTWYYUAZCGJCU-CYBMUJFWSA-N 2 2 359.436 3.088 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000841041218 730205395 /nfs/dbraw/zinc/20/53/95/730205395.db2.gz BZRYCMWNOLLDFQ-MRXNPFEDSA-N 2 2 364.287 3.010 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093280 731664317 /nfs/dbraw/zinc/66/43/17/731664317.db2.gz HRCAEFFAKLTCKF-CQSZACIVSA-N 2 2 353.304 3.366 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853093280 731664320 /nfs/dbraw/zinc/66/43/20/731664320.db2.gz HRCAEFFAKLTCKF-CQSZACIVSA-N 2 2 353.304 3.366 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3nc(C)c(C)s3)cc2F)CC1 ZINC000892905509 740056381 /nfs/dbraw/zinc/05/63/81/740056381.db2.gz MMXIPACASBVHOJ-UHFFFAOYSA-N 2 2 362.518 3.331 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1O ZINC000092071670 494778069 /nfs/dbraw/zinc/77/80/69/494778069.db2.gz AOLMHJUHANJAMD-LLVKDONJSA-N 2 2 366.259 3.266 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1O ZINC000092071670 494778077 /nfs/dbraw/zinc/77/80/77/494778077.db2.gz AOLMHJUHANJAMD-LLVKDONJSA-N 2 2 366.259 3.266 20 10 FGCDLP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185367414 495550714 /nfs/dbraw/zinc/55/07/14/495550714.db2.gz AEYRVGRWPIPREO-ZDUSSCGKSA-N 2 2 360.329 3.377 20 10 FGCDLP C[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185367414 495550719 /nfs/dbraw/zinc/55/07/19/495550719.db2.gz AEYRVGRWPIPREO-ZDUSSCGKSA-N 2 2 360.329 3.377 20 10 FGCDLP CC[C@@H]([NH2+]C1CC[NH+](CCOC)CC1)c1cc(Br)ccc1O ZINC000155317140 495915983 /nfs/dbraw/zinc/91/59/83/495915983.db2.gz HTXNLUOFVZPMAK-MRXNPFEDSA-N 2 2 371.319 3.306 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@H](C)c1cc(Br)cc(F)c1O)C2 ZINC000368314727 499284501 /nfs/dbraw/zinc/28/45/01/499284501.db2.gz FHTPCORHIPXQBW-ZYHUDNBSSA-N 2 2 368.250 3.464 20 10 FGCDLP C[NH+]1CCN([C@@H](C[NH2+]Cc2c(O)cccc2Cl)c2cccs2)CC1 ZINC000733322892 722495730 /nfs/dbraw/zinc/49/57/30/722495730.db2.gz VAOGDSBCTKABKZ-INIZCTEOSA-N 2 2 365.930 3.185 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[N@H+](CC(C)C)CCO2)cc1F ZINC000740001813 722534681 /nfs/dbraw/zinc/53/46/81/722534681.db2.gz JGPJRITXHSDFHV-GOSISDBHSA-N 2 2 351.510 3.118 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1F ZINC000740001813 722534682 /nfs/dbraw/zinc/53/46/82/722534682.db2.gz JGPJRITXHSDFHV-GOSISDBHSA-N 2 2 351.510 3.118 20 10 FGCDLP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000809787000 725268726 /nfs/dbraw/zinc/26/87/26/725268726.db2.gz PZGIVHFOPPKEKS-UHFFFAOYSA-N 2 2 367.852 3.200 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc(Br)ccc2O)cc1 ZINC000841041217 730205491 /nfs/dbraw/zinc/20/54/91/730205491.db2.gz BZRYCMWNOLLDFQ-INIZCTEOSA-N 2 2 364.287 3.010 20 10 FGCDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756161 730271127 /nfs/dbraw/zinc/27/11/27/730271127.db2.gz UMBDVFPJLSISAY-FOIQADDNSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756161 730271129 /nfs/dbraw/zinc/27/11/29/730271129.db2.gz UMBDVFPJLSISAY-FOIQADDNSA-N 2 2 360.885 3.333 20 10 FGCDLP COc1cc(Cl)cc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1O ZINC000849350238 731251495 /nfs/dbraw/zinc/25/14/95/731251495.db2.gz VIOYDNHRCMHLNU-IAGOWNOFSA-N 2 2 364.848 3.429 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Br)cc(F)c1O ZINC000925785624 759537800 /nfs/dbraw/zinc/53/78/00/759537800.db2.gz VCCAMOLJRWWJPK-IUCAKERBSA-N 2 2 367.209 3.189 20 10 FGCDLP COc1c(O)c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000278926288 497269332 /nfs/dbraw/zinc/26/93/32/497269332.db2.gz VMSYUPADWJUPHO-UHFFFAOYSA-N 2 2 371.437 3.063 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Br)ccc1O ZINC000279017257 497305020 /nfs/dbraw/zinc/30/50/20/497305020.db2.gz UKKLQRNKLJAYBS-RYUDHWBXSA-N 2 2 350.260 3.264 20 10 FGCDLP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287612033 498813329 /nfs/dbraw/zinc/81/33/29/498813329.db2.gz JIMJXVQNGJTIIN-WBMJQRKESA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(N2CCC(O)CC2)cc1 ZINC000367439209 499198872 /nfs/dbraw/zinc/19/88/72/499198872.db2.gz SERGCPOTUNDWIO-INIZCTEOSA-N 2 2 354.498 3.031 20 10 FGCDLP CC[NH+]1CCC([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 ZINC000765993193 723550633 /nfs/dbraw/zinc/55/06/33/723550633.db2.gz LQXDPFNEADIOHT-SFHVURJKSA-N 2 2 351.922 3.084 20 10 FGCDLP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165400 723559072 /nfs/dbraw/zinc/55/90/72/723559072.db2.gz HQAPOVXFWNLTIJ-JYJNAYRXSA-N 2 2 351.922 3.310 20 10 FGCDLP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165400 723559075 /nfs/dbraw/zinc/55/90/75/723559075.db2.gz HQAPOVXFWNLTIJ-JYJNAYRXSA-N 2 2 351.922 3.310 20 10 FGCDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc(Br)ccc2O)C1 ZINC000769513829 723688324 /nfs/dbraw/zinc/68/83/24/723688324.db2.gz FPVHQSUJEQRZKO-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc(Br)ccc2O)C1 ZINC000769513829 723688325 /nfs/dbraw/zinc/68/83/25/723688325.db2.gz FPVHQSUJEQRZKO-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000769513829 723688326 /nfs/dbraw/zinc/68/83/26/723688326.db2.gz FPVHQSUJEQRZKO-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(Br)c(F)cc1O ZINC000817987847 727290646 /nfs/dbraw/zinc/29/06/46/727290646.db2.gz YUBSVTJOJBIEMO-WHOHXGKFSA-N 2 2 357.267 3.333 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc(OC(F)(F)F)c2)cc1 ZINC000841042864 730205699 /nfs/dbraw/zinc/20/56/99/730205699.db2.gz MGANBLKVBZZJFE-QGZVFWFLSA-N 2 2 353.388 3.441 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000848548075 731179456 /nfs/dbraw/zinc/17/94/56/731179456.db2.gz ULLNFWSDQBXYFZ-ZYHUDNBSSA-N 2 2 366.259 3.025 20 10 FGCDLP Brc1cc(C[NH2+]CC23CC(C2)C[NH2+]3)ccc1N1CCCCC1 ZINC000853246178 731687506 /nfs/dbraw/zinc/68/75/06/731687506.db2.gz HWVHKPNFALNAHT-UHFFFAOYSA-N 2 2 364.331 3.281 20 10 FGCDLP C[C@@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(N2CCOCC2)c(F)c1 ZINC000130584394 495414628 /nfs/dbraw/zinc/41/46/28/495414628.db2.gz YKTOPZSPQZLULU-MRXNPFEDSA-N 2 2 368.456 3.203 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(F)c(F)c1O ZINC000290209555 498465679 /nfs/dbraw/zinc/46/56/79/498465679.db2.gz HGBCBMWTRHOVEU-CYBMUJFWSA-N 2 2 365.424 3.247 20 10 FGCDLP COc1c(O)c(C[NH2+]C[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000365828033 498658408 /nfs/dbraw/zinc/65/84/08/498658408.db2.gz TZTNSNKGCOFWSM-CRAIPNDOSA-N 2 2 371.437 3.092 20 10 FGCDLP C[NH+]1CCC([N@H+](Cc2ccco2)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000368136208 499268286 /nfs/dbraw/zinc/26/82/86/499268286.db2.gz TYOWDESXAUPMON-UHFFFAOYSA-N 2 2 369.509 3.213 20 10 FGCDLP C[NH+]1CCC([N@@H+](Cc2ccco2)Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000368136208 499268287 /nfs/dbraw/zinc/26/82/87/499268287.db2.gz TYOWDESXAUPMON-UHFFFAOYSA-N 2 2 369.509 3.213 20 10 FGCDLP C[C@@H]([NH2+]CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1cc(F)ccc1O ZINC000368221041 499275522 /nfs/dbraw/zinc/27/55/22/499275522.db2.gz GVICIHFXYNDPSQ-MRXNPFEDSA-N 3 2 363.521 3.378 20 10 FGCDLP CCOc1ccc(O)c(C[N@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377917951 499748054 /nfs/dbraw/zinc/74/80/54/499748054.db2.gz KXKPVBONZJSWRY-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP CCOc1ccc(O)c(C[N@@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377917951 499748057 /nfs/dbraw/zinc/74/80/57/499748057.db2.gz KXKPVBONZJSWRY-UHFFFAOYSA-N 2 2 369.509 3.325 20 10 FGCDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788755902 725086031 /nfs/dbraw/zinc/08/60/31/725086031.db2.gz SYNFYPOBAUCDCI-KBPBESRZSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Br)ccc1O ZINC000817939922 727289023 /nfs/dbraw/zinc/28/90/23/727289023.db2.gz IFPTVTFUENXRGR-CYBMUJFWSA-N 2 2 364.287 3.380 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(Br)cc(F)c1O ZINC000817987559 727290731 /nfs/dbraw/zinc/29/07/31/727290731.db2.gz UITXSUNGYSCSNR-MRBYEJRBSA-N 2 2 357.267 3.333 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000825303318 729377804 /nfs/dbraw/zinc/37/78/04/729377804.db2.gz HIKMFPOSDUYEQR-HXUWFJFHSA-N 2 2 360.885 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000825303318 729377805 /nfs/dbraw/zinc/37/78/05/729377805.db2.gz HIKMFPOSDUYEQR-HXUWFJFHSA-N 2 2 360.885 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c(Cl)c1 ZINC000840909133 730189978 /nfs/dbraw/zinc/18/99/78/730189978.db2.gz PQKIJQRWVRXGFR-ROUUACIJSA-N 2 2 352.906 3.212 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H]3CC[C@@H](C)SC3)CC2)cc1 ZINC000848516177 731173829 /nfs/dbraw/zinc/17/38/29/731173829.db2.gz AKWOIUGKNHJNGE-QZTJIDSGSA-N 2 2 363.571 3.081 20 10 FGCDLP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(F)cc(F)c1O ZINC000850483941 731361726 /nfs/dbraw/zinc/36/17/26/731361726.db2.gz YXMVOSWNHJHNIA-ZDUSSCGKSA-N 2 2 354.441 3.212 20 10 FGCDLP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(OCC[NH+]3CCOCC3)c2)c1 ZINC000185146989 496680975 /nfs/dbraw/zinc/68/09/75/496680975.db2.gz LTCCVLJJLULOSX-GOSISDBHSA-N 2 2 370.493 3.262 20 10 FGCDLP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccc(F)c(F)c1O ZINC000191187431 497737818 /nfs/dbraw/zinc/73/78/18/497737818.db2.gz WDXJWZCMQAXEQZ-AWEZNQCLSA-N 2 2 362.420 3.353 20 10 FGCDLP Cc1ncc(C[N@@H+]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@@H](C)C2)s1 ZINC000377777495 499731863 /nfs/dbraw/zinc/73/18/63/499731863.db2.gz BFXZAXQFUAEFNU-IFXJQAMLSA-N 2 2 357.523 3.387 20 10 FGCDLP Cc1ncc(C[N@H+]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@@H](C)C2)s1 ZINC000377777495 499731864 /nfs/dbraw/zinc/73/18/64/499731864.db2.gz BFXZAXQFUAEFNU-IFXJQAMLSA-N 2 2 357.523 3.387 20 10 FGCDLP Cc1ncc(C[N@@H+]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@@H](C)C2)s1 ZINC000377777497 499732048 /nfs/dbraw/zinc/73/20/48/499732048.db2.gz BFXZAXQFUAEFNU-LIRRHRJNSA-N 2 2 357.523 3.387 20 10 FGCDLP Cc1ncc(C[N@H+]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@@H](C)C2)s1 ZINC000377777497 499732050 /nfs/dbraw/zinc/73/20/50/499732050.db2.gz BFXZAXQFUAEFNU-LIRRHRJNSA-N 2 2 357.523 3.387 20 10 FGCDLP C[NH+]1CCC(C[NH2+]Cc2cc(Cl)c(F)cc2O)(N2CCCCC2)CC1 ZINC000816553958 727175039 /nfs/dbraw/zinc/17/50/39/727175039.db2.gz LCPNELNEDFRDOI-UHFFFAOYSA-N 2 2 369.912 3.225 20 10 FGCDLP C[C@@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 ZINC000817931312 727288448 /nfs/dbraw/zinc/28/84/48/727288448.db2.gz QLHHPAOOTQHRJJ-SOLBZPMBSA-N 2 2 365.949 3.433 20 10 FGCDLP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Br)ccc1O ZINC000817939923 727288842 /nfs/dbraw/zinc/28/88/42/727288842.db2.gz IFPTVTFUENXRGR-ZDUSSCGKSA-N 2 2 364.287 3.380 20 10 FGCDLP C[C@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817982675 727290531 /nfs/dbraw/zinc/29/05/31/727290531.db2.gz VIMBEUAEENNHTG-IFXJQAMLSA-N 2 2 351.922 3.345 20 10 FGCDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(Br)cc2O)C1 ZINC000824894807 729364037 /nfs/dbraw/zinc/36/40/37/729364037.db2.gz KFZVBBREKIXFEH-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(Br)cc2O)C1 ZINC000824894807 729364039 /nfs/dbraw/zinc/36/40/39/729364039.db2.gz KFZVBBREKIXFEH-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000824894807 729364040 /nfs/dbraw/zinc/36/40/40/729364040.db2.gz KFZVBBREKIXFEH-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000824894807 729364041 /nfs/dbraw/zinc/36/40/41/729364041.db2.gz KFZVBBREKIXFEH-AWEZNQCLSA-N 2 2 353.304 3.318 20 10 FGCDLP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(Cl)cc1O ZINC000841748390 730270378 /nfs/dbraw/zinc/27/03/78/730270378.db2.gz XOUWVWGSURSLFU-AWEZNQCLSA-N 2 2 360.889 3.043 20 10 FGCDLP C[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N2CCOCC2)c(F)c1 ZINC000152756250 496247618 /nfs/dbraw/zinc/24/76/18/496247618.db2.gz XFDCSFYFTFVQHP-MRXNPFEDSA-N 2 2 372.488 3.088 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H](C)c3cncs3)CC2)cc1 ZINC000162803210 496414366 /nfs/dbraw/zinc/41/43/66/496414366.db2.gz SZYRKBIQVAHPTO-INIZCTEOSA-N 2 2 360.527 3.015 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@@H+]1C1CC1 ZINC000157745972 496544380 /nfs/dbraw/zinc/54/43/80/496544380.db2.gz YXMWRPBZQBRSJV-ZBFHGGJFSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@H+]1C1CC1 ZINC000157745972 496544386 /nfs/dbraw/zinc/54/43/86/496544386.db2.gz YXMWRPBZQBRSJV-ZBFHGGJFSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1ccc(F)cc1O ZINC000185147030 496681218 /nfs/dbraw/zinc/68/12/18/496681218.db2.gz AMNNCGDNSXIJRT-INIZCTEOSA-N 2 2 374.456 3.093 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cc(OC)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370304968 499207590 /nfs/dbraw/zinc/20/75/90/499207590.db2.gz DQBILBUFVKTNQW-HRAATJIYSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cc(OC)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370304968 499207591 /nfs/dbraw/zinc/20/75/91/499207591.db2.gz DQBILBUFVKTNQW-HRAATJIYSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cc(OC)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370304968 499207592 /nfs/dbraw/zinc/20/75/92/499207592.db2.gz DQBILBUFVKTNQW-HRAATJIYSA-N 2 2 372.513 3.039 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cc(OC)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370304968 499207594 /nfs/dbraw/zinc/20/75/94/499207594.db2.gz DQBILBUFVKTNQW-HRAATJIYSA-N 2 2 372.513 3.039 20 10 FGCDLP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1cc(F)ccc1O ZINC000368592434 499311481 /nfs/dbraw/zinc/31/14/81/499311481.db2.gz QEHRUPLTTJETHC-UHFFFAOYSA-N 3 2 363.521 3.159 20 10 FGCDLP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)Cc1cc(F)ccc1O ZINC000368592434 499311483 /nfs/dbraw/zinc/31/14/83/499311483.db2.gz QEHRUPLTTJETHC-UHFFFAOYSA-N 3 2 363.521 3.159 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[N@H+](CC(C)C)CCO2)cc1F ZINC000740001817 722534656 /nfs/dbraw/zinc/53/46/56/722534656.db2.gz JGPJRITXHSDFHV-SFHVURJKSA-N 2 2 351.510 3.118 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[N@@H+](CC(C)C)CCO2)cc1F ZINC000740001817 722534657 /nfs/dbraw/zinc/53/46/57/722534657.db2.gz JGPJRITXHSDFHV-SFHVURJKSA-N 2 2 351.510 3.118 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](N[C@@H]2CC[NH+]3CCC[C@@H]3C2)C1 ZINC000754795922 722945939 /nfs/dbraw/zinc/94/59/39/722945939.db2.gz RDIOMYUCSKBWES-CEXWTWQISA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](N[C@@H]2CC[NH+]3CCC[C@@H]3C2)C1 ZINC000754795922 722945940 /nfs/dbraw/zinc/94/59/40/722945940.db2.gz RDIOMYUCSKBWES-CEXWTWQISA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000754795922 722945941 /nfs/dbraw/zinc/94/59/41/722945941.db2.gz RDIOMYUCSKBWES-CEXWTWQISA-N 2 2 363.933 3.226 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC[C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000754795922 722945942 /nfs/dbraw/zinc/94/59/42/722945942.db2.gz RDIOMYUCSKBWES-CEXWTWQISA-N 2 2 363.933 3.226 20 10 FGCDLP C[NH+](C)[C@@H]1CCN(c2ccc(NCc3c(O)ccc(Cl)c3F)[nH+]c2)C1 ZINC000790240911 723115937 /nfs/dbraw/zinc/11/59/37/723115937.db2.gz NFMQKNOOOWQNRC-CYBMUJFWSA-N 2 2 364.852 3.332 20 10 FGCDLP CC[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810213095 725297098 /nfs/dbraw/zinc/29/70/98/725297098.db2.gz LPKANLQDBAYVIM-INIZCTEOSA-N 2 2 360.420 3.299 20 10 FGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000826816748 729416175 /nfs/dbraw/zinc/41/61/75/729416175.db2.gz ZNQQJLQGANMAFV-UHFFFAOYSA-N 2 2 356.869 3.165 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c1 ZINC000827856427 729436075 /nfs/dbraw/zinc/43/60/75/729436075.db2.gz OUJKUKCUNHDCQM-HNNXBMFYSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c1 ZINC000827856427 729436076 /nfs/dbraw/zinc/43/60/76/729436076.db2.gz OUJKUKCUNHDCQM-HNNXBMFYSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1c[nH+]ccc1NC(=O)Cn1c2ccccc2c2c1CC[N@@H+](C(C)C)C2 ZINC000577045767 505651790 /nfs/dbraw/zinc/65/17/90/505651790.db2.gz GXRCRTPLCYWIOT-UHFFFAOYSA-N 2 2 362.477 3.172 20 10 FGCDLP Cc1c[nH+]ccc1NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2 ZINC000577045767 505651794 /nfs/dbraw/zinc/65/17/94/505651794.db2.gz GXRCRTPLCYWIOT-UHFFFAOYSA-N 2 2 362.477 3.172 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](CCc3ccccn3)CC2)cc1F ZINC000122352751 494962121 /nfs/dbraw/zinc/96/21/21/494962121.db2.gz MOVGXFCVUHTSJR-UHFFFAOYSA-N 2 2 370.516 3.426 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C2CC[NH+](CCc3ccccn3)CC2)cc1F ZINC000122352751 494962125 /nfs/dbraw/zinc/96/21/25/494962125.db2.gz MOVGXFCVUHTSJR-UHFFFAOYSA-N 2 2 370.516 3.426 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1cc(F)ccc1O ZINC000185147207 496680722 /nfs/dbraw/zinc/68/07/22/496680722.db2.gz IWFDGTITJTXEAB-MRXNPFEDSA-N 2 2 374.456 3.093 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Br)ccc1O ZINC000279017253 497304846 /nfs/dbraw/zinc/30/48/46/497304846.db2.gz UKKLQRNKLJAYBS-NEPJUHHUSA-N 2 2 350.260 3.264 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2ccnn2C)c(O)c1 ZINC000284695091 497870227 /nfs/dbraw/zinc/87/02/27/497870227.db2.gz YIGQGYAUTKHZLE-LAUBAEHRSA-N 2 2 372.513 3.087 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)c(O)c1 ZINC000284695091 497870231 /nfs/dbraw/zinc/87/02/31/497870231.db2.gz YIGQGYAUTKHZLE-LAUBAEHRSA-N 2 2 372.513 3.087 20 10 FGCDLP COc1ccc(N2CCC([N@H+](C)Cc3cccc4[nH+]ccn43)CC2)cc1 ZINC000362046097 498457906 /nfs/dbraw/zinc/45/79/06/498457906.db2.gz NCOUQYGUKXYEHG-UHFFFAOYSA-N 2 2 350.466 3.444 20 10 FGCDLP COc1ccc(N2CCC([N@@H+](C)Cc3cccc4[nH+]ccn43)CC2)cc1 ZINC000362046097 498457910 /nfs/dbraw/zinc/45/79/10/498457910.db2.gz NCOUQYGUKXYEHG-UHFFFAOYSA-N 2 2 350.466 3.444 20 10 FGCDLP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287798875 498866761 /nfs/dbraw/zinc/86/67/61/498866761.db2.gz TZSIMEDTXNRADO-LRDDRELGSA-N 2 2 360.329 3.376 20 10 FGCDLP CC[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1O ZINC000367909418 499244208 /nfs/dbraw/zinc/24/42/08/499244208.db2.gz GNIQWLKENYBRIJ-KSSFIOAISA-N 2 2 351.922 3.255 20 10 FGCDLP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3cnc(C)s3)C[C@@H]2C)c1O ZINC000369591954 499423798 /nfs/dbraw/zinc/42/37/98/499423798.db2.gz PAOIXIJPZJCNJC-GUYCJALGSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@@H]2C)c1O ZINC000369591954 499423800 /nfs/dbraw/zinc/42/38/00/499423800.db2.gz PAOIXIJPZJCNJC-GUYCJALGSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@@H]2CC[N@H+](Cc3cnc(C)s3)C[C@@H]2C)c1 ZINC000373185435 499456116 /nfs/dbraw/zinc/45/61/16/499456116.db2.gz IMPUTFXOGRVVJD-SCLBCKFNSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@@H]2C)c1 ZINC000373185435 499456117 /nfs/dbraw/zinc/45/61/17/499456117.db2.gz IMPUTFXOGRVVJD-SCLBCKFNSA-N 2 2 361.511 3.166 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403282 722964068 /nfs/dbraw/zinc/96/40/68/722964068.db2.gz XNXLXQONHUKQFG-QWRGUYRKSA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403282 722964069 /nfs/dbraw/zinc/96/40/69/722964069.db2.gz XNXLXQONHUKQFG-QWRGUYRKSA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000810252225 725300076 /nfs/dbraw/zinc/30/00/76/725300076.db2.gz AMPBKARKTIRIGT-KGLIPLIRSA-N 2 2 360.889 3.108 20 10 FGCDLP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815558915 727083776 /nfs/dbraw/zinc/08/37/76/727083776.db2.gz RPBALQWXVJRLBH-CQSZACIVSA-N 2 2 359.436 3.089 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816549016 727174149 /nfs/dbraw/zinc/17/41/49/727174149.db2.gz AGMYOWGENFFYLI-SUMWQHHRSA-N 2 2 358.885 3.411 20 10 FGCDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816549016 727174151 /nfs/dbraw/zinc/17/41/51/727174151.db2.gz AGMYOWGENFFYLI-SUMWQHHRSA-N 2 2 358.885 3.411 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cn(C)nc2-c2cccs2)cc1 ZINC000841045163 730205721 /nfs/dbraw/zinc/20/57/21/730205721.db2.gz JAAZGKONPYJUFN-KRWDZBQOSA-N 2 2 355.511 3.004 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000848548070 731179381 /nfs/dbraw/zinc/17/93/81/731179381.db2.gz ULLNFWSDQBXYFZ-CMPLNLGQSA-N 2 2 366.259 3.025 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1cc(Br)ccc1O ZINC000850556873 731372940 /nfs/dbraw/zinc/37/29/40/731372940.db2.gz KJTKFCYQJSRJTR-DOMZBBRYSA-N 2 2 369.303 3.059 20 10 FGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000882979506 737508429 /nfs/dbraw/zinc/50/84/29/737508429.db2.gz BVNQUZVPIQUHOY-JTQLQIEISA-N 2 2 356.239 3.225 20 10 FGCDLP Cc1cc(Br)cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1O ZINC000179902704 495777048 /nfs/dbraw/zinc/77/70/48/495777048.db2.gz RILSFMQIYQJYAQ-UHFFFAOYSA-N 2 2 350.260 3.497 20 10 FGCDLP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1ccccc1O ZINC000155321490 495919598 /nfs/dbraw/zinc/91/95/98/495919598.db2.gz YWGIYLJZCNEFBQ-OAQYLSRUSA-N 2 2 370.493 3.344 20 10 FGCDLP C[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N2CCC(O)CC2)cc1 ZINC000152736965 496240007 /nfs/dbraw/zinc/24/00/07/496240007.db2.gz NUVCLJZAYGRUBK-QGZVFWFLSA-N 2 2 368.525 3.074 20 10 FGCDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)c1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000366235747 498834317 /nfs/dbraw/zinc/83/43/17/498834317.db2.gz RMDFSTMMRGPAGF-WMZOPIPTSA-N 2 2 372.488 3.395 20 10 FGCDLP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(Cl)c1O ZINC000287708833 498843486 /nfs/dbraw/zinc/84/34/86/498843486.db2.gz NZZVDXARBSPUKT-GOSISDBHSA-N 2 2 374.916 3.433 20 10 FGCDLP C[C@H]([NH2+]CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1ccc(F)cc1O ZINC000368225994 499275706 /nfs/dbraw/zinc/27/57/06/499275706.db2.gz YQHZOHNMQPKQQZ-INIZCTEOSA-N 3 2 363.521 3.378 20 10 FGCDLP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3cnc(C)s3)C[C@@H]2C)c1O ZINC000369591955 499423894 /nfs/dbraw/zinc/42/38/94/499423894.db2.gz PAOIXIJPZJCNJC-SUMWQHHRSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@@H]2C)c1O ZINC000369591955 499423895 /nfs/dbraw/zinc/42/38/95/499423895.db2.gz PAOIXIJPZJCNJC-SUMWQHHRSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]Cc3ccc(C)s3)CC2)cc1 ZINC000237271605 713590252 /nfs/dbraw/zinc/59/02/52/713590252.db2.gz IHXVHFMCVAVXBM-UHFFFAOYSA-N 2 2 359.539 3.367 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788755908 725086024 /nfs/dbraw/zinc/08/60/24/725086024.db2.gz SYNFYPOBAUCDCI-ZIAGYGMSSA-N 2 2 359.436 3.088 20 10 FGCDLP C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815557007 727083875 /nfs/dbraw/zinc/08/38/75/727083875.db2.gz KHTWYYUAZCGJCU-ZDUSSCGKSA-N 2 2 359.436 3.088 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1 ZINC000841046150 730205984 /nfs/dbraw/zinc/20/59/84/730205984.db2.gz XCPUDNGXDRJAOW-INIZCTEOSA-N 2 2 353.388 3.283 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2)c1O ZINC000848519799 731174864 /nfs/dbraw/zinc/17/48/64/731174864.db2.gz FBIXPHMVNTXREK-GFCCVEGCSA-N 2 2 368.275 3.491 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850419375 731354977 /nfs/dbraw/zinc/35/49/77/731354977.db2.gz DGPDESVFHZLUEM-UHFFFAOYSA-N 2 2 353.304 3.366 20 10 FGCDLP CC[C@H]([NH2+]C1CCN(C(=O)CCC[NH2+]C)CC1)c1cccc(Cl)c1O ZINC000854232610 731806539 /nfs/dbraw/zinc/80/65/39/731806539.db2.gz VLQSGLZPMORIPG-KRWDZBQOSA-N 2 2 367.921 3.077 20 10 FGCDLP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(Br)cc1O)c1cccnc1 ZINC000896716378 742588658 /nfs/dbraw/zinc/58/86/58/742588658.db2.gz IAGSMXAQCVFIFE-INIZCTEOSA-N 2 2 364.287 3.332 20 10 FGCDLP COCCC[NH+]1CCC([NH2+][C@H](C)c2cc(Br)ccc2O)CC1 ZINC000185314241 496727873 /nfs/dbraw/zinc/72/78/73/496727873.db2.gz WEYMZOPZEZFMJD-CYBMUJFWSA-N 2 2 371.319 3.306 20 10 FGCDLP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)cc2O)CC1 ZINC000185314704 496728297 /nfs/dbraw/zinc/72/82/97/496728297.db2.gz QHMNICVDWRUENA-CYBMUJFWSA-N 2 2 371.319 3.306 20 10 FGCDLP COc1ccc(O)c([C@H](C)Nc2ccc(N3CC[C@H]([NH+](C)C)C3)c[nH+]2)c1 ZINC000273545533 496835556 /nfs/dbraw/zinc/83/55/56/496835556.db2.gz ZIRNOIMDXWVEPO-HOCLYGCPSA-N 2 2 356.470 3.109 20 10 FGCDLP C[NH+]1CCC([NH+]2CCC(CC[NH2+]Cc3cc(Cl)ccc3O)CC2)CC1 ZINC000363662665 498930549 /nfs/dbraw/zinc/93/05/49/498930549.db2.gz OVGQLUAPZOMLHM-UHFFFAOYSA-N 3 2 365.949 3.332 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614355 499217880 /nfs/dbraw/zinc/21/78/80/499217880.db2.gz GTTQBTNHCDSIIY-HEFCMCLBSA-N 2 2 360.477 3.389 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614355 499217882 /nfs/dbraw/zinc/21/78/82/499217882.db2.gz GTTQBTNHCDSIIY-HEFCMCLBSA-N 2 2 360.477 3.389 20 10 FGCDLP C[NH+]1CCN([C@@H]2CCCC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377698027 499721451 /nfs/dbraw/zinc/72/14/51/499721451.db2.gz PGFUDXHMCUCYDX-MRXNPFEDSA-N 2 2 372.340 3.301 20 10 FGCDLP C[NH+]1CCN([C@@H]2CCCC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377698027 499721453 /nfs/dbraw/zinc/72/14/53/499721453.db2.gz PGFUDXHMCUCYDX-MRXNPFEDSA-N 2 2 372.340 3.301 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]CCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1F ZINC000740000443 722534684 /nfs/dbraw/zinc/53/46/84/722534684.db2.gz CMKVKIZLZNZHQW-IRXDYDNUSA-N 2 2 351.510 3.261 20 10 FGCDLP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000750056302 722753156 /nfs/dbraw/zinc/75/31/56/722753156.db2.gz GSFLZBZRUXPLCM-QGZVFWFLSA-N 2 2 368.905 3.181 20 10 FGCDLP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000750056302 722753157 /nfs/dbraw/zinc/75/31/57/722753157.db2.gz GSFLZBZRUXPLCM-QGZVFWFLSA-N 2 2 368.905 3.181 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)[C@H](C)C1 ZINC000756582417 722967217 /nfs/dbraw/zinc/96/72/17/722967217.db2.gz INUUUXAFIIXHFW-GLJUWKHASA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)[C@H](C)C1 ZINC000756582417 722967218 /nfs/dbraw/zinc/96/72/18/722967218.db2.gz INUUUXAFIIXHFW-GLJUWKHASA-N 2 2 356.457 3.458 20 10 FGCDLP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815559401 727083943 /nfs/dbraw/zinc/08/39/43/727083943.db2.gz FZCJGGLNMSKOSR-KBPBESRZSA-N 2 2 359.436 3.088 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000826943742 729419617 /nfs/dbraw/zinc/41/96/17/729419617.db2.gz ZQJDGEHUSBJIRX-QGZVFWFLSA-N 2 2 364.848 3.041 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000826943742 729419620 /nfs/dbraw/zinc/41/96/20/729419620.db2.gz ZQJDGEHUSBJIRX-QGZVFWFLSA-N 2 2 364.848 3.041 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@H](C)Cn2cc[nH+]c2)c1O ZINC000848517934 731174241 /nfs/dbraw/zinc/17/42/41/731174241.db2.gz HSJTVKPCSWGYSM-MNOVXSKESA-N 2 2 354.248 3.099 20 10 FGCDLP CC(C)OCC[NH+]1CCC([NH2+]Cc2c(O)cccc2Br)CC1 ZINC000858147939 732186132 /nfs/dbraw/zinc/18/61/32/732186132.db2.gz DZTKUGHXCOTFGO-UHFFFAOYSA-N 2 2 371.319 3.134 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+](CCOC)CC1)c1cc(Br)ccc1O ZINC000155317019 495916580 /nfs/dbraw/zinc/91/65/80/495916580.db2.gz HTXNLUOFVZPMAK-INIZCTEOSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1O ZINC000186566083 496048875 /nfs/dbraw/zinc/04/88/75/496048875.db2.gz VOFHZWWWJVSLMA-STQMWFEESA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1cc(F)ccc1O ZINC000185147189 496681371 /nfs/dbraw/zinc/68/13/71/496681371.db2.gz IWFDGTITJTXEAB-INIZCTEOSA-N 2 2 374.456 3.093 20 10 FGCDLP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)cc2O)CC1 ZINC000185314687 496728199 /nfs/dbraw/zinc/72/81/99/496728199.db2.gz QHMNICVDWRUENA-ZDUSSCGKSA-N 2 2 371.319 3.306 20 10 FGCDLP Cc1cc(N2CCC([NH2+]Cc3cc(Cl)c(F)cc3O)CC2)nc(C)[nH+]1 ZINC000293626574 498434183 /nfs/dbraw/zinc/43/41/83/498434183.db2.gz MWGNKYFRZPHOEY-UHFFFAOYSA-N 2 2 364.852 3.350 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(C)c2O)[C@@H]1c1cnn(C)c1 ZINC000372537765 499142733 /nfs/dbraw/zinc/14/27/33/499142733.db2.gz CQGBNGVXIZUDNT-FXAWDEMLSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cccc(C)c2O)[C@@H]1c1cnn(C)c1 ZINC000372537765 499142735 /nfs/dbraw/zinc/14/27/35/499142735.db2.gz CQGBNGVXIZUDNT-FXAWDEMLSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cccc(C)c2O)[C@@H]1c1cnn(C)c1 ZINC000372537765 499142736 /nfs/dbraw/zinc/14/27/36/499142736.db2.gz CQGBNGVXIZUDNT-FXAWDEMLSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cccc(C)c2O)[C@@H]1c1cnn(C)c1 ZINC000372537765 499142738 /nfs/dbraw/zinc/14/27/38/499142738.db2.gz CQGBNGVXIZUDNT-FXAWDEMLSA-N 2 2 356.514 3.339 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C[C@H]2CCCO2)C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000372617033 499154440 /nfs/dbraw/zinc/15/44/40/499154440.db2.gz HIEMQPFARZROAY-SZOQZIPDSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@H]2CCCO2)C[C@@H]1C)c1ccc(F)c(F)c1O ZINC000372617033 499154442 /nfs/dbraw/zinc/15/44/42/499154442.db2.gz HIEMQPFARZROAY-SZOQZIPDSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CCCn2cc[nH+]c21)c1ccc(N2CCC(O)CC2)cc1 ZINC000375877095 499563904 /nfs/dbraw/zinc/56/39/04/499563904.db2.gz WXDMSDIYXNHBEI-AEFFLSMTSA-N 2 2 354.498 3.072 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)ccc1O ZINC000377757155 499729343 /nfs/dbraw/zinc/72/93/43/499729343.db2.gz UHUOUBKDTVZDTL-YPMHNXCESA-N 2 2 350.260 3.476 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CCc2[nH]c[nH+]c2C1)c1cc(Br)ccc1O ZINC000377757155 499729344 /nfs/dbraw/zinc/72/93/44/499729344.db2.gz UHUOUBKDTVZDTL-YPMHNXCESA-N 2 2 350.260 3.476 20 10 FGCDLP CC(C)(C)c1cc(O)c(O)c(C[NH+]2CCC(C)([NH+]3CCOCC3)CC2)c1 ZINC000530106085 503839666 /nfs/dbraw/zinc/83/96/66/503839666.db2.gz SZKKPKSAMKUMCQ-UHFFFAOYSA-N 2 2 362.514 3.082 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000779060078 724385574 /nfs/dbraw/zinc/38/55/74/724385574.db2.gz CWHNGADHQAQQDV-DGCLKSJQSA-N 2 2 350.260 3.325 20 10 FGCDLP C[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000779067302 724387053 /nfs/dbraw/zinc/38/70/53/724387053.db2.gz UOGZXPRKYKBNDB-HUUCEWRRSA-N 2 2 360.889 3.039 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000781911429 724611248 /nfs/dbraw/zinc/61/12/48/724611248.db2.gz MNYLAACEOYRVPR-AWEZNQCLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000781911429 724611252 /nfs/dbraw/zinc/61/12/52/724611252.db2.gz MNYLAACEOYRVPR-AWEZNQCLSA-N 2 2 353.304 3.381 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]CCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1F ZINC000740000441 722534694 /nfs/dbraw/zinc/53/46/94/722534694.db2.gz CMKVKIZLZNZHQW-IAGOWNOFSA-N 2 2 351.510 3.261 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165399 723559143 /nfs/dbraw/zinc/55/91/43/723559143.db2.gz HQAPOVXFWNLTIJ-HRCADAONSA-N 2 2 351.922 3.310 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165399 723559144 /nfs/dbraw/zinc/55/91/44/723559144.db2.gz HQAPOVXFWNLTIJ-HRCADAONSA-N 2 2 351.922 3.310 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217027 725297516 /nfs/dbraw/zinc/29/75/16/725297516.db2.gz VDZHJAMPVQCKSZ-DZKIICNBSA-N 2 2 358.404 3.315 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217027 725297518 /nfs/dbraw/zinc/29/75/18/725297518.db2.gz VDZHJAMPVQCKSZ-DZKIICNBSA-N 2 2 358.404 3.315 20 10 FGCDLP C[C@@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000810252229 725299978 /nfs/dbraw/zinc/29/99/78/725299978.db2.gz AMPBKARKTIRIGT-ZIAGYGMSSA-N 2 2 360.889 3.108 20 10 FGCDLP C[C@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1ccc(N2CCOCC2)cc1Cl ZINC000817982677 727290245 /nfs/dbraw/zinc/29/02/45/727290245.db2.gz VIMBEUAEENNHTG-LIRRHRJNSA-N 2 2 351.922 3.345 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H]3CC[C@@H](C)SC3)CC2)cc1 ZINC000848516176 731173863 /nfs/dbraw/zinc/17/38/63/731173863.db2.gz AKWOIUGKNHJNGE-MSOLQXFVSA-N 2 2 363.571 3.081 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H]3CCCSCC3)CC2)cc1 ZINC000850422525 731355454 /nfs/dbraw/zinc/35/54/54/731355454.db2.gz TVAKUAGUDUFXJP-SFHVURJKSA-N 2 2 363.571 3.083 20 10 FGCDLP Oc1cccc(Br)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000862248004 732797922 /nfs/dbraw/zinc/79/79/22/732797922.db2.gz GLBAQHZEBBYVTP-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1cccc(Br)c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000862248004 732797927 /nfs/dbraw/zinc/79/79/27/732797927.db2.gz GLBAQHZEBBYVTP-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(Br)cc(F)c1O ZINC000873263057 735744380 /nfs/dbraw/zinc/74/43/80/735744380.db2.gz FAISCHKHFGHJQM-VCDKRKBESA-N 2 2 357.267 3.475 20 10 FGCDLP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2O)CC1 ZINC000185014227 496623403 /nfs/dbraw/zinc/62/34/03/496623403.db2.gz NPELRYZYVSXOCO-CYBMUJFWSA-N 2 2 360.329 3.377 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc([N+](=O)[O-])ccc1O ZINC000273387931 496790816 /nfs/dbraw/zinc/79/08/16/496790816.db2.gz KAESHYUUTQUEKN-CQSZACIVSA-N 2 2 359.426 3.092 20 10 FGCDLP Cn1cc[nH+]c1-c1cccc(C[NH2+]Cc2ccc(N3CCOCC3)cc2)c1 ZINC000360056339 498240911 /nfs/dbraw/zinc/24/09/11/498240911.db2.gz IFDGFGZRYIULMK-UHFFFAOYSA-N 2 2 362.477 3.214 20 10 FGCDLP CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000297710110 498543831 /nfs/dbraw/zinc/54/38/31/498543831.db2.gz MSIJAWJGSUJVTC-MRXNPFEDSA-N 2 2 359.493 3.035 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Br)cc(F)c1O ZINC000366732097 499052793 /nfs/dbraw/zinc/05/27/93/499052793.db2.gz WBZGVFMCSCSBIY-WDEREUQCSA-N 2 2 368.250 3.404 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000373036876 499448186 /nfs/dbraw/zinc/44/81/86/499448186.db2.gz NOJVJXSARZIMOD-AWEZNQCLSA-N 2 2 357.292 3.079 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000377709041 499723765 /nfs/dbraw/zinc/72/37/65/499723765.db2.gz UDMHCXAWQMLOTQ-WJPUGNRLSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)c1 ZINC000377709041 499723766 /nfs/dbraw/zinc/72/37/66/499723766.db2.gz UDMHCXAWQMLOTQ-WJPUGNRLSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c1 ZINC000377709041 499723767 /nfs/dbraw/zinc/72/37/67/499723767.db2.gz UDMHCXAWQMLOTQ-WJPUGNRLSA-N 2 2 355.482 3.482 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c1 ZINC000377709041 499723768 /nfs/dbraw/zinc/72/37/68/499723768.db2.gz UDMHCXAWQMLOTQ-WJPUGNRLSA-N 2 2 355.482 3.482 20 10 FGCDLP Oc1c(Cl)cc(Cl)cc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000530248088 503894674 /nfs/dbraw/zinc/89/46/74/503894674.db2.gz FQYKWQLFFJBQQB-OAHLLOKOSA-N 2 2 359.297 3.290 20 10 FGCDLP C[C@@H]1CC[C@H](C)[N@H+]1CCN1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000092665214 700439459 /nfs/dbraw/zinc/43/94/59/700439459.db2.gz OLFPFJREXSLKLW-IYBDPMFKSA-N 2 2 351.922 3.036 20 10 FGCDLP C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000092665214 700439461 /nfs/dbraw/zinc/43/94/61/700439461.db2.gz OLFPFJREXSLKLW-IYBDPMFKSA-N 2 2 351.922 3.036 20 10 FGCDLP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc(Br)ccc1O ZINC000762652749 723267756 /nfs/dbraw/zinc/26/77/56/723267756.db2.gz XZTSYJYANBMDRX-KBPBESRZSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc(Br)ccc1O ZINC000762652749 723267758 /nfs/dbraw/zinc/26/77/58/723267758.db2.gz XZTSYJYANBMDRX-KBPBESRZSA-N 2 2 371.319 3.306 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+]CCCCn2cc[nH+]c2)c1O ZINC000848519801 731174835 /nfs/dbraw/zinc/17/48/35/731174835.db2.gz FBIXPHMVNTXREK-LBPRGKRZSA-N 2 2 368.275 3.491 20 10 FGCDLP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185648196 495659991 /nfs/dbraw/zinc/65/99/91/495659991.db2.gz IZNDUBSFYZJJPI-LBPRGKRZSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000186126750 495866530 /nfs/dbraw/zinc/86/65/30/495866530.db2.gz UFHASMNEOJYTKJ-IXDGSTSKSA-N 2 2 352.906 3.464 20 10 FGCDLP COc1ccc(O)c([C@@H](C)Nc2ccc(N3CC[C@@H]([NH+](C)C)C3)c[nH+]2)c1 ZINC000273545528 496835579 /nfs/dbraw/zinc/83/55/79/496835579.db2.gz ZIRNOIMDXWVEPO-GDBMZVCRSA-N 2 2 356.470 3.109 20 10 FGCDLP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1O ZINC000282205166 498423046 /nfs/dbraw/zinc/42/30/46/498423046.db2.gz HARQGNGWFOBOLA-GFCCVEGCSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1O ZINC000282205166 498423052 /nfs/dbraw/zinc/42/30/52/498423052.db2.gz HARQGNGWFOBOLA-GFCCVEGCSA-N 2 2 360.329 3.376 20 10 FGCDLP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000371335996 499312603 /nfs/dbraw/zinc/31/26/03/499312603.db2.gz MYNKVAMMJCZOPK-MRXNPFEDSA-N 2 2 372.340 3.299 20 10 FGCDLP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000371335996 499312604 /nfs/dbraw/zinc/31/26/04/499312604.db2.gz MYNKVAMMJCZOPK-MRXNPFEDSA-N 2 2 372.340 3.299 20 10 FGCDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601788 722967537 /nfs/dbraw/zinc/96/75/37/722967537.db2.gz BADPGFIOTVPZFW-MGPUTAFESA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601788 722967538 /nfs/dbraw/zinc/96/75/38/722967538.db2.gz BADPGFIOTVPZFW-MGPUTAFESA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc(Br)ccc1O ZINC000762652751 723267892 /nfs/dbraw/zinc/26/78/92/723267892.db2.gz XZTSYJYANBMDRX-UONOGXRCSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc(Br)ccc1O ZINC000762652751 723267893 /nfs/dbraw/zinc/26/78/93/723267893.db2.gz XZTSYJYANBMDRX-UONOGXRCSA-N 2 2 371.319 3.306 20 10 FGCDLP COc1c(O)c(C[NH2+]CCC[N@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774943515 723944698 /nfs/dbraw/zinc/94/46/98/723944698.db2.gz UXYSZIQFVSHKNH-UHFFFAOYSA-N 2 2 351.447 3.053 20 10 FGCDLP COc1c(O)c(C[NH2+]CCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774943515 723944700 /nfs/dbraw/zinc/94/47/00/723944700.db2.gz UXYSZIQFVSHKNH-UHFFFAOYSA-N 2 2 351.447 3.053 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843044775 730573561 /nfs/dbraw/zinc/57/35/61/730573561.db2.gz IYFYHTARGZTXTJ-DOMZBBRYSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1O ZINC000843044775 730573565 /nfs/dbraw/zinc/57/35/65/730573565.db2.gz IYFYHTARGZTXTJ-DOMZBBRYSA-N 2 2 369.303 3.127 20 10 FGCDLP C[N@@H+]1CC[C@H](N[C@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137229 732184693 /nfs/dbraw/zinc/18/46/93/732184693.db2.gz KBHUYCIHMSQWDD-ROUUACIJSA-N 2 2 365.949 3.472 20 10 FGCDLP C[N@H+]1CC[C@H](N[C@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137229 732184694 /nfs/dbraw/zinc/18/46/94/732184694.db2.gz KBHUYCIHMSQWDD-ROUUACIJSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@H](N[C@H]2CCC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137229 732184698 /nfs/dbraw/zinc/18/46/98/732184698.db2.gz KBHUYCIHMSQWDD-ROUUACIJSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@H](N[C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137229 732184699 /nfs/dbraw/zinc/18/46/99/732184699.db2.gz KBHUYCIHMSQWDD-ROUUACIJSA-N 2 2 365.949 3.472 20 10 FGCDLP CC(C)[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)N1CC[NH+](C)CC1 ZINC000064620229 494138266 /nfs/dbraw/zinc/13/82/66/494138266.db2.gz LRJYUSRVBQNTAR-MRXNPFEDSA-N 2 2 360.329 3.061 20 10 FGCDLP CC(=O)c1cc(F)cc(C[N@@H+](C)C2CCN(c3cccc[nH+]3)CC2)c1O ZINC000079440807 494455030 /nfs/dbraw/zinc/45/50/30/494455030.db2.gz MCWWENGGWABNKY-UHFFFAOYSA-N 2 2 357.429 3.230 20 10 FGCDLP CC(=O)c1cc(F)cc(C[N@H+](C)C2CCN(c3cccc[nH+]3)CC2)c1O ZINC000079440807 494455035 /nfs/dbraw/zinc/45/50/35/494455035.db2.gz MCWWENGGWABNKY-UHFFFAOYSA-N 2 2 357.429 3.230 20 10 FGCDLP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(OCC[NH+]3CCOCC3)c2)c1 ZINC000185147006 496680843 /nfs/dbraw/zinc/68/08/43/496680843.db2.gz LTCCVLJJLULOSX-SFHVURJKSA-N 2 2 370.493 3.262 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cc(F)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000364713200 498106998 /nfs/dbraw/zinc/10/69/98/498106998.db2.gz FXTCLMONHLLPKW-MGPUTAFESA-N 2 2 360.477 3.170 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cc(F)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000364713200 498107001 /nfs/dbraw/zinc/10/70/01/498107001.db2.gz FXTCLMONHLLPKW-MGPUTAFESA-N 2 2 360.477 3.170 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cc(F)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000364713200 498107006 /nfs/dbraw/zinc/10/70/06/498107006.db2.gz FXTCLMONHLLPKW-MGPUTAFESA-N 2 2 360.477 3.170 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cc(F)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000364713200 498107009 /nfs/dbraw/zinc/10/70/09/498107009.db2.gz FXTCLMONHLLPKW-MGPUTAFESA-N 2 2 360.477 3.170 20 10 FGCDLP Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c1O ZINC000368402227 499292646 /nfs/dbraw/zinc/29/26/46/499292646.db2.gz JODBLJQYFGAUJG-RDTXWAMCSA-N 2 2 362.905 3.260 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000377803573 499736703 /nfs/dbraw/zinc/73/67/03/499736703.db2.gz YAUUTHMJZYMGMV-CMPLNLGQSA-N 2 2 350.260 3.394 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CCc3[nH]c[nH+]c3C2)c1O ZINC000377803573 499736705 /nfs/dbraw/zinc/73/67/05/499736705.db2.gz YAUUTHMJZYMGMV-CMPLNLGQSA-N 2 2 350.260 3.394 20 10 FGCDLP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000123044483 700699444 /nfs/dbraw/zinc/69/94/44/700699444.db2.gz WLSSZVHJOIBPHG-HOTGVXAUSA-N 2 2 351.922 3.036 20 10 FGCDLP Oc1cc(Br)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000824870223 729363116 /nfs/dbraw/zinc/36/31/16/729363116.db2.gz OFPMEPSOGSMDQE-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1cc(Br)ccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000824870223 729363118 /nfs/dbraw/zinc/36/31/18/729363118.db2.gz OFPMEPSOGSMDQE-AWEZNQCLSA-N 2 2 353.304 3.463 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000843044411 730573028 /nfs/dbraw/zinc/57/30/28/730573028.db2.gz BFVTVOXLNOSZTB-CZUORRHYSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000843044411 730573033 /nfs/dbraw/zinc/57/30/33/730573033.db2.gz BFVTVOXLNOSZTB-CZUORRHYSA-N 2 2 353.304 3.427 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853093279 731664407 /nfs/dbraw/zinc/66/44/07/731664407.db2.gz HRCAEFFAKLTCKF-AWEZNQCLSA-N 2 2 353.304 3.366 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853093279 731664410 /nfs/dbraw/zinc/66/44/10/731664410.db2.gz HRCAEFFAKLTCKF-AWEZNQCLSA-N 2 2 353.304 3.366 20 10 FGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)CC[C@H]1C(F)(F)F ZINC000863646855 732989981 /nfs/dbraw/zinc/98/99/81/732989981.db2.gz QDGQZFOCDVCYMI-ZYHUDNBSSA-N 2 2 367.209 3.114 20 10 FGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cc(Br)ccc2O)CC[C@H]1C(F)(F)F ZINC000863646855 732989985 /nfs/dbraw/zinc/98/99/85/732989985.db2.gz QDGQZFOCDVCYMI-ZYHUDNBSSA-N 2 2 367.209 3.114 20 10 FGCDLP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000185344566 495539653 /nfs/dbraw/zinc/53/96/53/495539653.db2.gz QQASHFSVYRCMAL-QWHCGFSZSA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000185165729 496688733 /nfs/dbraw/zinc/68/87/33/496688733.db2.gz SYVRLCJWYYKPJE-CQSZACIVSA-N 2 2 360.889 3.043 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Br)ccc1O ZINC000279017255 497304830 /nfs/dbraw/zinc/30/48/30/497304830.db2.gz UKKLQRNKLJAYBS-NWDGAFQWSA-N 2 2 350.260 3.264 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3C[C@H]4CCCC[C@H]4[NH2+]3)CC2)cc1 ZINC000370766446 499252677 /nfs/dbraw/zinc/25/26/77/499252677.db2.gz LRZUXHMVGJUQBY-HBGVWJBISA-N 2 2 371.525 3.043 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C[C@H]([NH3+])c3ccccc3)CC2)cc1 ZINC000370861334 499263556 /nfs/dbraw/zinc/26/35/56/499263556.db2.gz MIRVPCBVIHTQGO-NRFANRHFSA-N 2 2 367.493 3.213 20 10 FGCDLP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3cnc(C)s3)C[C@H]2C)c1O ZINC000369591952 499423670 /nfs/dbraw/zinc/42/36/70/499423670.db2.gz PAOIXIJPZJCNJC-CXAGYDPISA-N 2 2 361.511 3.166 20 10 FGCDLP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@H]2C)c1O ZINC000369591952 499423671 /nfs/dbraw/zinc/42/36/71/499423671.db2.gz PAOIXIJPZJCNJC-CXAGYDPISA-N 2 2 361.511 3.166 20 10 FGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000781628803 724580102 /nfs/dbraw/zinc/58/01/02/724580102.db2.gz AGMOSJGDXFKLOM-GFCCVEGCSA-N 2 2 352.276 3.394 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]Cc2ncc(C[NH+](C)C)s2)cc1F ZINC000796296344 723631168 /nfs/dbraw/zinc/63/11/68/723631168.db2.gz SSBUYPXKXBLHRE-UHFFFAOYSA-N 2 2 350.507 3.480 20 10 FGCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500383 723996527 /nfs/dbraw/zinc/99/65/27/723996527.db2.gz JEDLBPFJMXZRFQ-DLBZAZTESA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1cc(Cl)ccc1O ZINC000775500383 723996528 /nfs/dbraw/zinc/99/65/28/723996528.db2.gz JEDLBPFJMXZRFQ-DLBZAZTESA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Cl)c1O ZINC000806139202 725117666 /nfs/dbraw/zinc/11/76/66/725117666.db2.gz LLOYOWHGYAXUNO-QGZVFWFLSA-N 2 2 367.921 3.029 20 10 FGCDLP CC[C@H]([NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C)c1cccc(Cl)c1O ZINC000806155940 725118584 /nfs/dbraw/zinc/11/85/84/725118584.db2.gz WIMDXUOXELYVLL-IRXDYDNUSA-N 2 2 369.937 3.179 20 10 FGCDLP C[NH+](C)[C@@H]1CCN(c2ccc(NCc3cc(Cl)c(F)cc3O)[nH+]c2)C1 ZINC000816558665 727175760 /nfs/dbraw/zinc/17/57/60/727175760.db2.gz IOUAZBBAILLDKR-CQSZACIVSA-N 2 2 364.852 3.332 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642760 727184378 /nfs/dbraw/zinc/18/43/78/727184378.db2.gz KCKMNEOCMBZFFQ-QGZVFWFLSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816642760 727184380 /nfs/dbraw/zinc/18/43/80/727184380.db2.gz KCKMNEOCMBZFFQ-QGZVFWFLSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816642760 727184382 /nfs/dbraw/zinc/18/43/82/727184382.db2.gz KCKMNEOCMBZFFQ-QGZVFWFLSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816642760 727184383 /nfs/dbraw/zinc/18/43/83/727184383.db2.gz KCKMNEOCMBZFFQ-QGZVFWFLSA-N 2 2 369.303 3.081 20 10 FGCDLP Brc1cc(C[NH2+]C[C@@H]2CCC[NH2+]2)ccc1N1CCCCC1 ZINC000841035259 730205046 /nfs/dbraw/zinc/20/50/46/730205046.db2.gz JLCFESFDESRXEY-HNNXBMFYSA-N 2 2 352.320 3.281 20 10 FGCDLP COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645480 732990225 /nfs/dbraw/zinc/99/02/25/732990225.db2.gz INOGEVDFLVHJCU-JQWIXIFHSA-N 2 2 352.784 3.013 20 10 FGCDLP COc1cc(Cl)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645480 732990227 /nfs/dbraw/zinc/99/02/27/732990227.db2.gz INOGEVDFLVHJCU-JQWIXIFHSA-N 2 2 352.784 3.013 20 10 FGCDLP C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1O)CN1CC[NH+](C)CC1 ZINC000185344534 495540155 /nfs/dbraw/zinc/54/01/55/495540155.db2.gz QQASHFSVYRCMAL-STQMWFEESA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(N(C)C)cc1 ZINC000163703398 496548117 /nfs/dbraw/zinc/54/81/17/496548117.db2.gz YXYXVYMHOKHQTO-SFHVURJKSA-N 2 2 353.510 3.436 20 10 FGCDLP Cn1cc([C@@H]2[C@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@@H+]2C)cn1 ZINC000363176195 498686782 /nfs/dbraw/zinc/68/67/82/498686782.db2.gz GMRVDHVEAZNQSI-JTSKRJEESA-N 2 2 364.493 3.452 20 10 FGCDLP Cn1cc([C@@H]2[C@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@H+]2C)cn1 ZINC000363176195 498686787 /nfs/dbraw/zinc/68/67/87/498686787.db2.gz GMRVDHVEAZNQSI-JTSKRJEESA-N 2 2 364.493 3.452 20 10 FGCDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)c1ccc(N3CCC(O)CC3)cc1)CCC2 ZINC000363756968 498976418 /nfs/dbraw/zinc/97/64/18/498976418.db2.gz JFBYJBNZFRGLQJ-IEBWSBKVSA-N 2 2 368.525 3.381 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)C2 ZINC000363862452 499028945 /nfs/dbraw/zinc/02/89/45/499028945.db2.gz YYZVBSHVMPKNGQ-WCQYABFASA-N 2 2 350.260 3.325 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@H]2CC[N@H+](Cc3cnc(C)s3)C[C@H]2C)c1 ZINC000373185433 499456127 /nfs/dbraw/zinc/45/61/27/499456127.db2.gz IMPUTFXOGRVVJD-ACJLOTCBSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@H]2C)c1 ZINC000373185433 499456128 /nfs/dbraw/zinc/45/61/28/499456128.db2.gz IMPUTFXOGRVVJD-ACJLOTCBSA-N 2 2 361.511 3.166 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000377803576 499736565 /nfs/dbraw/zinc/73/65/65/499736565.db2.gz YAUUTHMJZYMGMV-ZYHUDNBSSA-N 2 2 350.260 3.394 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CCc3[nH]c[nH+]c3C2)c1O ZINC000377803576 499736566 /nfs/dbraw/zinc/73/65/66/499736566.db2.gz YAUUTHMJZYMGMV-ZYHUDNBSSA-N 2 2 350.260 3.394 20 10 FGCDLP Oc1ccc(Br)cc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000093683326 700452891 /nfs/dbraw/zinc/45/28/91/700452891.db2.gz DHGNSJQCRNKTNK-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1ccc(Br)cc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000093683326 700452896 /nfs/dbraw/zinc/45/28/96/700452896.db2.gz DHGNSJQCRNKTNK-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc(Br)ccc1O ZINC000779065797 724386766 /nfs/dbraw/zinc/38/67/66/724386766.db2.gz PUBAEYRYEBZPKE-OCCSQVGLSA-N 2 2 350.260 3.407 20 10 FGCDLP C[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000779067300 724387270 /nfs/dbraw/zinc/38/72/70/724387270.db2.gz UOGZXPRKYKBNDB-CABCVRRESA-N 2 2 360.889 3.039 20 10 FGCDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601793 722967560 /nfs/dbraw/zinc/96/75/60/722967560.db2.gz BADPGFIOTVPZFW-YWZLYKJASA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601793 722967561 /nfs/dbraw/zinc/96/75/61/722967561.db2.gz BADPGFIOTVPZFW-YWZLYKJASA-N 2 2 360.885 3.333 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1O ZINC000806149892 725118288 /nfs/dbraw/zinc/11/82/88/725118288.db2.gz YOMHESPXCQLLET-RCCFBDPRSA-N 2 2 352.906 3.464 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000816642129 727184064 /nfs/dbraw/zinc/18/40/64/727184064.db2.gz QBBYRGVOSMOZPQ-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c1 ZINC000816642129 727184065 /nfs/dbraw/zinc/18/40/65/727184065.db2.gz QBBYRGVOSMOZPQ-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1 ZINC000816642129 727184068 /nfs/dbraw/zinc/18/40/68/727184068.db2.gz QBBYRGVOSMOZPQ-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1 ZINC000816642129 727184071 /nfs/dbraw/zinc/18/40/71/727184071.db2.gz QBBYRGVOSMOZPQ-QGZVFWFLSA-N 2 2 353.304 3.381 20 10 FGCDLP Oc1cc(Br)ccc1C[NH2+]C1CCN(c2cccc[nH+]2)CC1 ZINC000825113506 729371279 /nfs/dbraw/zinc/37/12/79/729371279.db2.gz FQLWHEZIUQIACM-UHFFFAOYSA-N 2 2 362.271 3.308 20 10 FGCDLP CC(C)OCC[NH+]1CCC([NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000825331964 729378998 /nfs/dbraw/zinc/37/89/98/729378998.db2.gz UELPDKNNCDFRRX-UHFFFAOYSA-N 2 2 371.319 3.134 20 10 FGCDLP NC1(C[NH2+]Cc2cccc(Cl)c2O)CC[NH+](Cc2ccccc2)CC1 ZINC000841102925 730211785 /nfs/dbraw/zinc/21/17/85/730211785.db2.gz CLVRVSUERPQRJN-UHFFFAOYSA-N 2 2 359.901 3.129 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000848551318 731180125 /nfs/dbraw/zinc/18/01/25/731180125.db2.gz JPKAYTQVFHVRCO-GXSJLCMTSA-N 2 2 366.259 3.095 20 10 FGCDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2c(O)cccc2Br)C1 ZINC000862251028 732799326 /nfs/dbraw/zinc/79/93/26/732799326.db2.gz YXEHGMKGJSIIBV-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2c(O)cccc2Br)C1 ZINC000862251028 732799328 /nfs/dbraw/zinc/79/93/28/732799328.db2.gz YXEHGMKGJSIIBV-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000862251028 732799333 /nfs/dbraw/zinc/79/93/33/732799333.db2.gz YXEHGMKGJSIIBV-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862251028 732799336 /nfs/dbraw/zinc/79/93/36/732799336.db2.gz YXEHGMKGJSIIBV-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Br)cc(F)c1O ZINC000925785620 759537184 /nfs/dbraw/zinc/53/71/84/759537184.db2.gz VCCAMOLJRWWJPK-DTWKUNHWSA-N 2 2 367.209 3.189 20 10 FGCDLP COc1ccc(N2CCC([NH2+]CCc3cn4ccccc4[nH+]3)CC2)cc1 ZINC000130614328 495419994 /nfs/dbraw/zinc/41/99/94/495419994.db2.gz PJTVKTLPMKIGEB-UHFFFAOYSA-N 2 2 350.466 3.144 20 10 FGCDLP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000187737284 496550919 /nfs/dbraw/zinc/55/09/19/496550919.db2.gz VSBXXQXKLKODFP-HNNXBMFYSA-N 2 2 367.484 3.271 20 10 FGCDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cccc(Cl)c3O)CC2)CC1 ZINC000271786994 497449046 /nfs/dbraw/zinc/44/90/46/497449046.db2.gz IKWGXVIUEIECGL-UHFFFAOYSA-N 2 2 351.922 3.036 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614356 499217768 /nfs/dbraw/zinc/21/77/68/499217768.db2.gz GTTQBTNHCDSIIY-WNYOCNMUSA-N 2 2 360.477 3.389 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cnn(C)c1)c1ccc(F)cc1O ZINC000367614356 499217770 /nfs/dbraw/zinc/21/77/70/499217770.db2.gz GTTQBTNHCDSIIY-WNYOCNMUSA-N 2 2 360.477 3.389 20 10 FGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000781628804 724580044 /nfs/dbraw/zinc/58/00/44/724580044.db2.gz AGMOSJGDXFKLOM-LBPRGKRZSA-N 2 2 352.276 3.394 20 10 FGCDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601786 722967522 /nfs/dbraw/zinc/96/75/22/722967522.db2.gz BADPGFIOTVPZFW-FOIQADDNSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601786 722967523 /nfs/dbraw/zinc/96/75/23/722967523.db2.gz BADPGFIOTVPZFW-FOIQADDNSA-N 2 2 360.885 3.333 20 10 FGCDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cc(Cl)cc(F)c3O)CC2)CC1 ZINC000775733614 724033768 /nfs/dbraw/zinc/03/37/68/724033768.db2.gz WEZYMSFJLFNIRA-UHFFFAOYSA-N 2 2 369.912 3.175 20 10 FGCDLP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808442513 725201413 /nfs/dbraw/zinc/20/14/13/725201413.db2.gz GGAOCAHAPORDFT-UHFFFAOYSA-N 2 2 367.852 3.200 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH2+]CCC[NH2+]Cc2cccnc2)c1 ZINC000841041452 730205320 /nfs/dbraw/zinc/20/53/20/730205320.db2.gz GJHIAQGIYRGWQD-UHFFFAOYSA-N 2 2 364.287 3.128 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1 ZINC000841087438 730209110 /nfs/dbraw/zinc/20/91/10/730209110.db2.gz NMTMPLFWHSLBOU-XJKSGUPXSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)c1 ZINC000841087438 730209113 /nfs/dbraw/zinc/20/91/13/730209113.db2.gz NMTMPLFWHSLBOU-XJKSGUPXSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000883017616 737512035 /nfs/dbraw/zinc/51/20/35/737512035.db2.gz SRTZSAQJGFQRKQ-UHFFFAOYSA-N 2 2 356.239 3.369 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Br)c(F)cc1O ZINC000925778159 759535391 /nfs/dbraw/zinc/53/53/91/759535391.db2.gz RRHHCCFFZQXPTK-DTWKUNHWSA-N 2 2 367.209 3.189 20 10 FGCDLP C[C@H]1C[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@@H+]1C1CC1 ZINC000157746122 496544649 /nfs/dbraw/zinc/54/46/49/496544649.db2.gz YXMWRPBZQBRSJV-HOCLYGCPSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@H]1C[C@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@H+]1C1CC1 ZINC000157746122 496544653 /nfs/dbraw/zinc/54/46/53/496544653.db2.gz YXMWRPBZQBRSJV-HOCLYGCPSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@@H+]1C1CC1 ZINC000157746270 496544920 /nfs/dbraw/zinc/54/49/20/496544920.db2.gz YXMWRPBZQBRSJV-GDBMZVCRSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@H+]1C1CC1 ZINC000157746270 496544923 /nfs/dbraw/zinc/54/49/23/496544923.db2.gz YXMWRPBZQBRSJV-GDBMZVCRSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(F)cc1O ZINC000185084783 496652933 /nfs/dbraw/zinc/65/29/33/496652933.db2.gz TXDYBZKDJICQEV-INIZCTEOSA-N 2 2 357.473 3.130 20 10 FGCDLP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCN(C)CC2)cc1)c1ccc(F)cc1O ZINC000185084783 496652943 /nfs/dbraw/zinc/65/29/43/496652943.db2.gz TXDYBZKDJICQEV-INIZCTEOSA-N 2 2 357.473 3.130 20 10 FGCDLP COc1cc(O)c(C[N@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cc1OC ZINC000282027156 498363314 /nfs/dbraw/zinc/36/33/14/498363314.db2.gz WIKIHQYTUHGQSD-OAHLLOKOSA-N 2 2 371.481 3.322 20 10 FGCDLP Cn1cc([C@@H]2[C@@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@@H+]2C)cn1 ZINC000372976231 499445541 /nfs/dbraw/zinc/44/55/41/499445541.db2.gz IZDWBVAWKJFYSX-XIKOKIGWSA-N 2 2 366.868 3.091 20 10 FGCDLP Cn1cc([C@@H]2[C@@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@H+]2C)cn1 ZINC000372976231 499445542 /nfs/dbraw/zinc/44/55/42/499445542.db2.gz IZDWBVAWKJFYSX-XIKOKIGWSA-N 2 2 366.868 3.091 20 10 FGCDLP COc1c(O)c(C[N@@H+]2CCC[C@@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000373207994 499457455 /nfs/dbraw/zinc/45/74/55/499457455.db2.gz FXKWPBMHNLUEBY-OAHLLOKOSA-N 2 2 374.441 3.466 20 10 FGCDLP COc1c(O)c(C[N@H+]2CCC[C@@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000373207994 499457456 /nfs/dbraw/zinc/45/74/56/499457456.db2.gz FXKWPBMHNLUEBY-OAHLLOKOSA-N 2 2 374.441 3.466 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c(O)c1 ZINC000377300557 499678011 /nfs/dbraw/zinc/67/80/11/499678011.db2.gz WGENLGRVPJOQIX-RXVVDRJESA-N 2 2 355.482 3.359 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c(O)c1 ZINC000377300557 499678013 /nfs/dbraw/zinc/67/80/13/499678013.db2.gz WGENLGRVPJOQIX-RXVVDRJESA-N 2 2 355.482 3.359 20 10 FGCDLP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3c(O)cccc3Cl)cc2)CC1 ZINC000113325229 700570970 /nfs/dbraw/zinc/57/09/70/700570970.db2.gz BSFHHSGJYHVXBA-UHFFFAOYSA-N 2 2 359.901 3.083 20 10 FGCDLP CN1CC[NH+](Cc2ccc(C[NH2+]Cc3c(O)cccc3Cl)cc2)CC1 ZINC000113325229 700570976 /nfs/dbraw/zinc/57/09/76/700570976.db2.gz BSFHHSGJYHVXBA-UHFFFAOYSA-N 2 2 359.901 3.083 20 10 FGCDLP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc(Br)ccc1O ZINC000762652750 723267784 /nfs/dbraw/zinc/26/77/84/723267784.db2.gz XZTSYJYANBMDRX-KGLIPLIRSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc(Br)ccc1O ZINC000762652750 723267788 /nfs/dbraw/zinc/26/77/88/723267788.db2.gz XZTSYJYANBMDRX-KGLIPLIRSA-N 2 2 371.319 3.306 20 10 FGCDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3cc(Cl)c(F)cc3O)CC2)CC1 ZINC000817413997 727248871 /nfs/dbraw/zinc/24/88/71/727248871.db2.gz PGNRTJFHZBKTPW-UHFFFAOYSA-N 2 2 369.912 3.177 20 10 FGCDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3cc(Cl)c(F)cc3O)CC2)CC1 ZINC000817413997 727248874 /nfs/dbraw/zinc/24/88/74/727248874.db2.gz PGNRTJFHZBKTPW-UHFFFAOYSA-N 2 2 369.912 3.177 20 10 FGCDLP [NH3+]C[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CC[C@H]1C(F)(F)F ZINC000863646851 732990035 /nfs/dbraw/zinc/99/00/35/732990035.db2.gz QDGQZFOCDVCYMI-CMPLNLGQSA-N 2 2 367.209 3.114 20 10 FGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2cc(Br)ccc2O)CC[C@H]1C(F)(F)F ZINC000863646851 732990037 /nfs/dbraw/zinc/99/00/37/732990037.db2.gz QDGQZFOCDVCYMI-CMPLNLGQSA-N 2 2 367.209 3.114 20 10 FGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C(F)(F)F ZINC000863646854 732990123 /nfs/dbraw/zinc/99/01/23/732990123.db2.gz QDGQZFOCDVCYMI-PWSUYJOCSA-N 2 2 367.209 3.114 20 10 FGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cc(Br)ccc2O)CC[C@@H]1C(F)(F)F ZINC000863646854 732990125 /nfs/dbraw/zinc/99/01/25/732990125.db2.gz QDGQZFOCDVCYMI-PWSUYJOCSA-N 2 2 367.209 3.114 20 10 FGCDLP COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645479 732990184 /nfs/dbraw/zinc/99/01/84/732990184.db2.gz INOGEVDFLVHJCU-CMPLNLGQSA-N 2 2 352.784 3.013 20 10 FGCDLP COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C2)c1O ZINC000863645479 732990191 /nfs/dbraw/zinc/99/01/91/732990191.db2.gz INOGEVDFLVHJCU-CMPLNLGQSA-N 2 2 352.784 3.013 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1O ZINC000187798565 496576139 /nfs/dbraw/zinc/57/61/39/496576139.db2.gz OOGWCWZAYQQBQT-ZLIFDBKOSA-N 2 2 354.441 3.089 20 10 FGCDLP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)ccc2O)CC1 ZINC000185314226 496727919 /nfs/dbraw/zinc/72/79/19/496727919.db2.gz WEYMZOPZEZFMJD-ZDUSSCGKSA-N 2 2 371.319 3.306 20 10 FGCDLP CC[NH+]1CCN(c2ccc(CNc3nc(C)[nH+]c(C)c3C)cc2F)CC1 ZINC000301697075 498228404 /nfs/dbraw/zinc/22/84/04/498228404.db2.gz QGBRWJVQAJWHGB-UHFFFAOYSA-N 2 2 357.477 3.295 20 10 FGCDLP COc1ccc(N2CC[NH+](CCCNc3[nH]c4ccccc4[nH+]3)CC2)cc1 ZINC000301870239 498304508 /nfs/dbraw/zinc/30/45/08/498304508.db2.gz IMRRVUUDHAQGAT-UHFFFAOYSA-N 2 2 365.481 3.196 20 10 FGCDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3cc(Cl)c(F)cc3O)CC2)CC1 ZINC000294290866 498646199 /nfs/dbraw/zinc/64/61/99/498646199.db2.gz PJUBITUSUNYBAO-UHFFFAOYSA-N 2 2 369.912 3.175 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1C ZINC000363860958 499028977 /nfs/dbraw/zinc/02/89/77/499028977.db2.gz VXMWMMSPONPHCQ-QKLQHJQFSA-N 2 2 356.514 3.476 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1C ZINC000363860958 499028981 /nfs/dbraw/zinc/02/89/81/499028981.db2.gz VXMWMMSPONPHCQ-QKLQHJQFSA-N 2 2 356.514 3.476 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377911984 499747644 /nfs/dbraw/zinc/74/76/44/499747644.db2.gz JNPZPMJFUJGZSX-INIZCTEOSA-N 2 2 355.482 3.453 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377911984 499747645 /nfs/dbraw/zinc/74/76/45/499747645.db2.gz JNPZPMJFUJGZSX-INIZCTEOSA-N 2 2 355.482 3.453 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@@H+]1C ZINC000765991642 723550284 /nfs/dbraw/zinc/55/02/84/723550284.db2.gz DNPUMXTURQIDRH-ZTFGCOKTSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@H+]1C ZINC000765991642 723550286 /nfs/dbraw/zinc/55/02/86/723550286.db2.gz DNPUMXTURQIDRH-ZTFGCOKTSA-N 2 2 351.922 3.082 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000843044407 730573241 /nfs/dbraw/zinc/57/32/41/730573241.db2.gz BFVTVOXLNOSZTB-BBRMVZONSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000843044407 730573242 /nfs/dbraw/zinc/57/32/42/730573242.db2.gz BFVTVOXLNOSZTB-BBRMVZONSA-N 2 2 353.304 3.427 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(F)cn3)cc2F)CC1 ZINC000092747361 494736025 /nfs/dbraw/zinc/73/60/25/494736025.db2.gz JWFLSXTWMALWMM-HNNXBMFYSA-N 2 2 360.452 3.353 20 10 FGCDLP Cc1cc(NC(=O)Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)cc[nH+]1 ZINC000580516041 505776147 /nfs/dbraw/zinc/77/61/47/505776147.db2.gz LUKIGRTXXXZQAR-UHFFFAOYSA-N 2 2 362.477 3.172 20 10 FGCDLP Cc1cc(NC(=O)Cn2c3ccccc3c3c2CC[N@H+](C(C)C)C3)cc[nH+]1 ZINC000580516041 505776151 /nfs/dbraw/zinc/77/61/51/505776151.db2.gz LUKIGRTXXXZQAR-UHFFFAOYSA-N 2 2 362.477 3.172 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Br)ccc1O ZINC000279017259 497304471 /nfs/dbraw/zinc/30/44/71/497304471.db2.gz UKKLQRNKLJAYBS-VXGBXAGGSA-N 2 2 350.260 3.264 20 10 FGCDLP COc1ccc(N2CC[NH+](CCCNc3nc(C)[nH+]c(C)c3C)CC2)cc1 ZINC000301708556 498233531 /nfs/dbraw/zinc/23/35/31/498233531.db2.gz WPLGDIGXPNXIAI-UHFFFAOYSA-N 2 2 369.513 3.035 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)cc1F ZINC000370406016 499217314 /nfs/dbraw/zinc/21/73/14/499217314.db2.gz MFQJRWNPUNKGED-RXVVDRJESA-N 2 2 356.489 3.412 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](C)[C@H]2c2cccnc2)cc1F ZINC000370406016 499217315 /nfs/dbraw/zinc/21/73/15/499217315.db2.gz MFQJRWNPUNKGED-RXVVDRJESA-N 2 2 356.489 3.412 20 10 FGCDLP CN(C)c1ccc(C[NH+](C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)cc1F ZINC000370406016 499217316 /nfs/dbraw/zinc/21/73/16/499217316.db2.gz MFQJRWNPUNKGED-RXVVDRJESA-N 2 2 356.489 3.412 20 10 FGCDLP CN(C)c1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)cc1F ZINC000370406016 499217317 /nfs/dbraw/zinc/21/73/17/499217317.db2.gz MFQJRWNPUNKGED-RXVVDRJESA-N 2 2 356.489 3.412 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@H](C)c1ccc(Br)cc1O)C2 ZINC000368314605 499284557 /nfs/dbraw/zinc/28/45/57/499284557.db2.gz FEPCLGYGOMNXST-DGCLKSJQSA-N 2 2 350.260 3.325 20 10 FGCDLP CCOc1ccc(O)c(C[N@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377919334 499748164 /nfs/dbraw/zinc/74/81/64/499748164.db2.gz MEERZCWFCPMOIY-UHFFFAOYSA-N 2 2 355.482 3.282 20 10 FGCDLP CCOc1ccc(O)c(C[N@@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377919334 499748165 /nfs/dbraw/zinc/74/81/65/499748165.db2.gz MEERZCWFCPMOIY-UHFFFAOYSA-N 2 2 355.482 3.282 20 10 FGCDLP CCC[NH+]1CCC([N@H+](C)Cc2cc(Br)cc(OC)c2O)CC1 ZINC000092165389 700432233 /nfs/dbraw/zinc/43/22/33/700432233.db2.gz PGADEJFKZYWDMJ-UHFFFAOYSA-N 2 2 371.319 3.470 20 10 FGCDLP CCC[NH+]1CCC([N@@H+](C)Cc2cc(Br)cc(OC)c2O)CC1 ZINC000092165389 700432239 /nfs/dbraw/zinc/43/22/39/700432239.db2.gz PGADEJFKZYWDMJ-UHFFFAOYSA-N 2 2 371.319 3.470 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]Cc3sccc3C)CC2)cc1 ZINC000237273499 713590129 /nfs/dbraw/zinc/59/01/29/713590129.db2.gz QNPADPQCEVSJAN-UHFFFAOYSA-N 2 2 359.539 3.367 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000816642128 727183977 /nfs/dbraw/zinc/18/39/77/727183977.db2.gz QBBYRGVOSMOZPQ-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c1 ZINC000816642128 727183978 /nfs/dbraw/zinc/18/39/78/727183978.db2.gz QBBYRGVOSMOZPQ-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1 ZINC000816642128 727183980 /nfs/dbraw/zinc/18/39/80/727183980.db2.gz QBBYRGVOSMOZPQ-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1 ZINC000816642128 727183981 /nfs/dbraw/zinc/18/39/81/727183981.db2.gz QBBYRGVOSMOZPQ-KRWDZBQOSA-N 2 2 353.304 3.381 20 10 FGCDLP CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)cc1F ZINC000827855829 729436097 /nfs/dbraw/zinc/43/60/97/729436097.db2.gz JEFPFFIVPBUVLJ-SFHVURJKSA-N 2 2 351.510 3.215 20 10 FGCDLP CCN(CC)c1ccc(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)cc1F ZINC000827855829 729436098 /nfs/dbraw/zinc/43/60/98/729436098.db2.gz JEFPFFIVPBUVLJ-SFHVURJKSA-N 2 2 351.510 3.215 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](CCc3ccccn3)CC2)cc1 ZINC000092645122 494693780 /nfs/dbraw/zinc/69/37/80/494693780.db2.gz OXBKMHAMLIRIAC-UHFFFAOYSA-N 2 2 352.526 3.287 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C2CC[NH+](CCc3ccccn3)CC2)cc1 ZINC000092645122 494693786 /nfs/dbraw/zinc/69/37/86/494693786.db2.gz OXBKMHAMLIRIAC-UHFFFAOYSA-N 2 2 352.526 3.287 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1O ZINC000187798526 496576354 /nfs/dbraw/zinc/57/63/54/496576354.db2.gz OOGWCWZAYQQBQT-VUCTXSBTSA-N 2 2 354.441 3.089 20 10 FGCDLP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc([N+](=O)[O-])ccc1O ZINC000273417084 496800159 /nfs/dbraw/zinc/80/01/59/496800159.db2.gz RAZOPGWXHFPUDE-AWEZNQCLSA-N 2 2 359.426 3.092 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2([NH2+]Cc3cccc(OC)c3O)CCCC2)no1 ZINC000266080416 497250737 /nfs/dbraw/zinc/25/07/37/497250737.db2.gz FOJPEYGYWBORRF-UHFFFAOYSA-N 2 2 374.485 3.185 20 10 FGCDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)c1ccc(N3CCOCC3)c(F)c1)CCC2 ZINC000366233560 498834885 /nfs/dbraw/zinc/83/48/85/498834885.db2.gz RMDFSTMMRGPAGF-FUHWJXTLSA-N 2 2 372.488 3.395 20 10 FGCDLP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc([N+](=O)[O-])ccc3O)cc2)CC1 ZINC000283945179 499018122 /nfs/dbraw/zinc/01/81/22/499018122.db2.gz JYGOTKPVGCLDQG-UHFFFAOYSA-N 2 2 371.437 3.063 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@H+](C[C@H]2CCCO2)C[C@H]1C)c1ccc(F)c(F)c1O ZINC000372617034 499154596 /nfs/dbraw/zinc/15/45/96/499154596.db2.gz HIEMQPFARZROAY-UMPJEAMMSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@H]2CCCO2)C[C@H]1C)c1ccc(F)c(F)c1O ZINC000372617034 499154597 /nfs/dbraw/zinc/15/45/97/499154597.db2.gz HIEMQPFARZROAY-UMPJEAMMSA-N 2 2 354.441 3.210 20 10 FGCDLP C[C@@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(N2CCOCC2)c(F)c1 ZINC000367438569 499199129 /nfs/dbraw/zinc/19/91/29/499199129.db2.gz NUILNLCHPNVIEL-OAHLLOKOSA-N 2 2 358.461 3.046 20 10 FGCDLP CC[N@@H+]1CCC[C@@H](C[NH+](C)Cc2cc(C)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370306566 499207683 /nfs/dbraw/zinc/20/76/83/499207683.db2.gz WFVZUKRGGHRDBV-LAUBAEHRSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[N@H+]1CCC[C@@H](C[NH+](C)Cc2cc(C)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370306566 499207685 /nfs/dbraw/zinc/20/76/85/499207685.db2.gz WFVZUKRGGHRDBV-LAUBAEHRSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@H+](C)Cc2cc(C)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370306566 499207686 /nfs/dbraw/zinc/20/76/86/499207686.db2.gz WFVZUKRGGHRDBV-LAUBAEHRSA-N 2 2 356.514 3.339 20 10 FGCDLP CC[NH+]1CCC[C@@H](C[N@@H+](C)Cc2cc(C)ccc2O)[C@@H]1c1cnn(C)c1 ZINC000370306566 499207688 /nfs/dbraw/zinc/20/76/88/499207688.db2.gz WFVZUKRGGHRDBV-LAUBAEHRSA-N 2 2 356.514 3.339 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469044 499331223 /nfs/dbraw/zinc/33/12/23/499331223.db2.gz CTZPHLVYDRRENI-BMFZPTHFSA-N 2 2 359.297 3.383 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469044 499331224 /nfs/dbraw/zinc/33/12/24/499331224.db2.gz CTZPHLVYDRRENI-BMFZPTHFSA-N 2 2 359.297 3.383 20 10 FGCDLP COc1cc(O)c(C[NH2+]Cc2cccc(-c3[nH+]ccn3C)c2)cc1OC ZINC000371515038 499336866 /nfs/dbraw/zinc/33/68/66/499336866.db2.gz RZPASJJOISVFRK-UHFFFAOYSA-N 2 2 353.422 3.100 20 10 FGCDLP C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024984 499655051 /nfs/dbraw/zinc/65/50/51/499655051.db2.gz NCZDAPLJQPCJON-WWGRRREGSA-N 2 2 356.869 3.164 20 10 FGCDLP C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024984 499655052 /nfs/dbraw/zinc/65/50/52/499655052.db2.gz NCZDAPLJQPCJON-WWGRRREGSA-N 2 2 356.869 3.164 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000119660338 700635279 /nfs/dbraw/zinc/63/52/79/700635279.db2.gz BJSNHDMMGGOQMF-HNNXBMFYSA-N 2 2 363.933 3.454 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1O ZINC000762649912 723266955 /nfs/dbraw/zinc/26/69/55/723266955.db2.gz OLLRLMWZHYPAKY-UONOGXRCSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1O ZINC000762649912 723266960 /nfs/dbraw/zinc/26/69/60/723266960.db2.gz OLLRLMWZHYPAKY-UONOGXRCSA-N 2 2 371.319 3.306 20 10 FGCDLP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](CC)CC1)c1cccc(Cl)c1O ZINC000806138324 725117583 /nfs/dbraw/zinc/11/75/83/725117583.db2.gz UBUNLHDKDXYZHC-YJBOKZPZSA-N 2 2 353.938 3.360 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c1O ZINC000827857147 729436109 /nfs/dbraw/zinc/43/61/09/729436109.db2.gz WYRMRCOLSPZALP-INIZCTEOSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c1O ZINC000827857147 729436110 /nfs/dbraw/zinc/43/61/10/729436110.db2.gz WYRMRCOLSPZALP-INIZCTEOSA-N 2 2 371.319 3.006 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c(Cl)c1 ZINC000840909115 730189963 /nfs/dbraw/zinc/18/99/63/730189963.db2.gz PQKIJQRWVRXGFR-QZTJIDSGSA-N 2 2 352.906 3.212 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000848551319 731180203 /nfs/dbraw/zinc/18/02/03/731180203.db2.gz JPKAYTQVFHVRCO-KOLCDFICSA-N 2 2 366.259 3.095 20 10 FGCDLP COc1ccc(N2CC[C@@H]([NH2+]Cc3cc(-n4cc[nH+]c4)cs3)C2)cc1 ZINC000850346054 731344914 /nfs/dbraw/zinc/34/49/14/731344914.db2.gz BPHYCCZDKMUJGU-OAHLLOKOSA-N 2 2 354.479 3.311 20 10 FGCDLP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000186566118 496049039 /nfs/dbraw/zinc/04/90/39/496049039.db2.gz VOFHZWWWJVSLMA-QWHCGFSZSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H](C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)CN1CC[NH+](C)CC1 ZINC000192822884 497222750 /nfs/dbraw/zinc/22/27/50/497222750.db2.gz XGBUOLQLIKOISF-CHWSQXEVSA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Br)cc1O ZINC000279007602 497300798 /nfs/dbraw/zinc/30/07/98/497300798.db2.gz SKNNDMZQQGQPQB-NWDGAFQWSA-N 2 2 350.260 3.264 20 10 FGCDLP C[NH+](C)C1CCN(c2ccc(N[C@@H]3CCc4cccc(O)c43)[nH+]c2)CC1 ZINC000297086107 498319223 /nfs/dbraw/zinc/31/92/23/498319223.db2.gz XAKZIESDLUBEOZ-GOSISDBHSA-N 2 2 352.482 3.417 20 10 FGCDLP Cc1ncc(C[N@@H+]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@H](C)C2)s1 ZINC000377777496 499731882 /nfs/dbraw/zinc/73/18/82/499731882.db2.gz BFXZAXQFUAEFNU-KUHUBIRLSA-N 2 2 357.523 3.387 20 10 FGCDLP Cc1ncc(C[N@H+]2CC[C@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@H](C)C2)s1 ZINC000377777496 499731883 /nfs/dbraw/zinc/73/18/83/499731883.db2.gz BFXZAXQFUAEFNU-KUHUBIRLSA-N 2 2 357.523 3.387 20 10 FGCDLP C[C@@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)cc(F)c1O ZINC000377796395 499735252 /nfs/dbraw/zinc/73/52/52/499735252.db2.gz NLGCMNVKGLPEQB-PSASIEDQSA-N 2 2 354.223 3.225 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000781911431 724611465 /nfs/dbraw/zinc/61/14/65/724611465.db2.gz MNYLAACEOYRVPR-CQSZACIVSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000781911431 724611467 /nfs/dbraw/zinc/61/14/67/724611467.db2.gz MNYLAACEOYRVPR-CQSZACIVSA-N 2 2 353.304 3.381 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000809767538 725266476 /nfs/dbraw/zinc/26/64/76/725266476.db2.gz NMAVSKLBASQPBT-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000809767538 725266478 /nfs/dbraw/zinc/26/64/78/725266478.db2.gz NMAVSKLBASQPBT-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c1 ZINC000809767538 725266481 /nfs/dbraw/zinc/26/64/81/725266481.db2.gz NMAVSKLBASQPBT-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)c1 ZINC000809767538 725266483 /nfs/dbraw/zinc/26/64/83/725266483.db2.gz NMAVSKLBASQPBT-BBRMVZONSA-N 2 2 353.304 3.379 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816549013 727174297 /nfs/dbraw/zinc/17/42/97/727174297.db2.gz AGMYOWGENFFYLI-CXAGYDPISA-N 2 2 358.885 3.411 20 10 FGCDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816549013 727174299 /nfs/dbraw/zinc/17/42/99/727174299.db2.gz AGMYOWGENFFYLI-CXAGYDPISA-N 2 2 358.885 3.411 20 10 FGCDLP C[C@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)CN1CC[NH+](C)CC1 ZINC000192822852 497223368 /nfs/dbraw/zinc/22/33/68/497223368.db2.gz XGBUOLQLIKOISF-OLZOCXBDSA-N 2 2 360.329 3.233 20 10 FGCDLP COc1cc(O)c(C[N@H+](Cc2ccco2)C2CC[NH+](C)CC2)cc1OC ZINC000290546881 498593081 /nfs/dbraw/zinc/59/30/81/498593081.db2.gz RNVNBANZWXHSOB-UHFFFAOYSA-N 2 2 360.454 3.099 20 10 FGCDLP COc1cc(O)c(C[N@@H+](Cc2ccco2)C2CC[NH+](C)CC2)cc1OC ZINC000290546881 498593088 /nfs/dbraw/zinc/59/30/88/498593088.db2.gz RNVNBANZWXHSOB-UHFFFAOYSA-N 2 2 360.454 3.099 20 10 FGCDLP CC[C@@H]([NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287656123 498827979 /nfs/dbraw/zinc/82/79/79/498827979.db2.gz LMHWKUNMOLFDOI-MSOLQXFVSA-N 2 2 353.938 3.358 20 10 FGCDLP Cn1cc([C@H]2[C@@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@@H+]2C)cn1 ZINC000372976219 499445600 /nfs/dbraw/zinc/44/56/00/499445600.db2.gz IZDWBVAWKJFYSX-KZULUSFZSA-N 2 2 366.868 3.091 20 10 FGCDLP Cn1cc([C@H]2[C@@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@H+]2C)cn1 ZINC000372976219 499445601 /nfs/dbraw/zinc/44/56/01/499445601.db2.gz IZDWBVAWKJFYSX-KZULUSFZSA-N 2 2 366.868 3.091 20 10 FGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000373232986 499458999 /nfs/dbraw/zinc/45/89/99/499458999.db2.gz RTJKMRARPGXDKM-LBPRGKRZSA-N 2 2 350.260 3.268 20 10 FGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000373232986 499459000 /nfs/dbraw/zinc/45/90/00/499459000.db2.gz RTJKMRARPGXDKM-LBPRGKRZSA-N 2 2 350.260 3.268 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@H+](C[C@@H]2CCCO2)C[C@H]1C)c1ccc(F)cc1O ZINC000375800913 499557217 /nfs/dbraw/zinc/55/72/17/499557217.db2.gz FTQRCWBEYZUVIF-TWKWOARYSA-N 2 2 350.478 3.461 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@@H]2CCCO2)C[C@H]1C)c1ccc(F)cc1O ZINC000375800913 499557218 /nfs/dbraw/zinc/55/72/18/499557218.db2.gz FTQRCWBEYZUVIF-TWKWOARYSA-N 2 2 350.478 3.461 20 10 FGCDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601791 722967531 /nfs/dbraw/zinc/96/75/31/722967531.db2.gz BADPGFIOTVPZFW-QRWLVFNGSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000756601791 722967532 /nfs/dbraw/zinc/96/75/32/722967532.db2.gz BADPGFIOTVPZFW-QRWLVFNGSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@@H+]1C ZINC000765991640 723550400 /nfs/dbraw/zinc/55/04/00/723550400.db2.gz DNPUMXTURQIDRH-JLSDUUJJSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@H+]1C ZINC000765991640 723550403 /nfs/dbraw/zinc/55/04/03/723550403.db2.gz DNPUMXTURQIDRH-JLSDUUJJSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Br)nc1 ZINC000817942084 727288835 /nfs/dbraw/zinc/28/88/35/727288835.db2.gz MDRRKEPELLCUSW-MLGOLLRUSA-N 2 2 363.303 3.261 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(Br)c(F)cc1O ZINC000817987844 727290697 /nfs/dbraw/zinc/29/06/97/727290697.db2.gz YUBSVTJOJBIEMO-FIQHERPVSA-N 2 2 357.267 3.333 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843044776 730573504 /nfs/dbraw/zinc/57/35/04/730573504.db2.gz IYFYHTARGZTXTJ-IUODEOHRSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1O ZINC000843044776 730573508 /nfs/dbraw/zinc/57/35/08/730573508.db2.gz IYFYHTARGZTXTJ-IUODEOHRSA-N 2 2 369.303 3.127 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@]3(C)CCCS3)CC2)cc1 ZINC000862263213 732801613 /nfs/dbraw/zinc/80/16/13/732801613.db2.gz RUGLWBAOHGHNAD-FQEVSTJZSA-N 2 2 363.571 3.083 20 10 FGCDLP Cc1cc(N2CCC([NH2+][C@@H](C)c3ccc(F)c(F)c3O)CC2)nc(C)[nH+]1 ZINC000187748318 496554700 /nfs/dbraw/zinc/55/47/00/496554700.db2.gz GGHCUQRLMPKIMK-LBPRGKRZSA-N 2 2 362.424 3.397 20 10 FGCDLP CC[C@@H]([NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287656125 498827915 /nfs/dbraw/zinc/82/79/15/498827915.db2.gz LMHWKUNMOLFDOI-QZTJIDSGSA-N 2 2 353.938 3.358 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@@H]([NH2+][C@H](C)c1cc(Br)ccc1O)C2 ZINC000363862447 499028842 /nfs/dbraw/zinc/02/88/42/499028842.db2.gz YYZVBSHVMPKNGQ-DGCLKSJQSA-N 2 2 350.260 3.325 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]CCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1F ZINC000740000440 722534661 /nfs/dbraw/zinc/53/46/61/722534661.db2.gz CMKVKIZLZNZHQW-CALCHBBNSA-N 2 2 351.510 3.261 20 10 FGCDLP CCN(CC)c1ccc(C[NH2+]CCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1F ZINC000740000440 722534662 /nfs/dbraw/zinc/53/46/62/722534662.db2.gz CMKVKIZLZNZHQW-CALCHBBNSA-N 2 2 351.510 3.261 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1O ZINC000762649913 723267131 /nfs/dbraw/zinc/26/71/31/723267131.db2.gz OLLRLMWZHYPAKY-ZIAGYGMSSA-N 2 2 371.319 3.306 20 10 FGCDLP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1O ZINC000762649913 723267134 /nfs/dbraw/zinc/26/71/34/723267134.db2.gz OLLRLMWZHYPAKY-ZIAGYGMSSA-N 2 2 371.319 3.306 20 10 FGCDLP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cccc(Br)c1O ZINC000775145683 723963733 /nfs/dbraw/zinc/96/37/33/723963733.db2.gz IPGWACLXGHIBQP-UHFFFAOYSA-N 2 2 373.254 3.334 20 10 FGCDLP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](CC)CC1)c1cccc(Cl)c1O ZINC000806138318 725117539 /nfs/dbraw/zinc/11/75/39/725117539.db2.gz UBUNLHDKDXYZHC-CRAIPNDOSA-N 2 2 353.938 3.360 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1O ZINC000806149889 725118160 /nfs/dbraw/zinc/11/81/60/725118160.db2.gz YOMHESPXCQLLET-BZSNNMDCSA-N 2 2 352.906 3.464 20 10 FGCDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756163 730270928 /nfs/dbraw/zinc/27/09/28/730270928.db2.gz UMBDVFPJLSISAY-QRWLVFNGSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756163 730270929 /nfs/dbraw/zinc/27/09/29/730270929.db2.gz UMBDVFPJLSISAY-QRWLVFNGSA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cc(Br)cc(F)c1O ZINC000925785616 759537751 /nfs/dbraw/zinc/53/77/51/759537751.db2.gz VCCAMOLJRWWJPK-BDAKNGLRSA-N 2 2 367.209 3.189 20 10 FGCDLP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000184983572 496610516 /nfs/dbraw/zinc/61/05/16/496610516.db2.gz VNMAWJHXQBUUKY-GFCCVEGCSA-N 2 2 360.329 3.376 20 10 FGCDLP COc1ccc(O)c([C@H](C)Nc2ccc(N3CC[C@@H]([NH+](C)C)C3)c[nH+]2)c1 ZINC000273545530 496836211 /nfs/dbraw/zinc/83/62/11/496836211.db2.gz ZIRNOIMDXWVEPO-GOEBONIOSA-N 2 2 356.470 3.109 20 10 FGCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c1 ZINC000273619808 496855254 /nfs/dbraw/zinc/85/52/54/496855254.db2.gz YQCZLOBYQKKNPR-ZDUSSCGKSA-N 2 2 360.429 3.230 20 10 FGCDLP Oc1c(Br)cccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000298119062 498669203 /nfs/dbraw/zinc/66/92/03/498669203.db2.gz OZLTXYQJBBSQJK-UHFFFAOYSA-N 2 2 362.271 3.308 20 10 FGCDLP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000371335995 499312701 /nfs/dbraw/zinc/31/27/01/499312701.db2.gz MYNKVAMMJCZOPK-INIZCTEOSA-N 2 2 372.340 3.299 20 10 FGCDLP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000371335995 499312703 /nfs/dbraw/zinc/31/27/03/499312703.db2.gz MYNKVAMMJCZOPK-INIZCTEOSA-N 2 2 372.340 3.299 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1CCCn2cc[nH+]c21)c1ccc(N2CCC(O)CC2)cc1 ZINC000375877110 499564094 /nfs/dbraw/zinc/56/40/94/499564094.db2.gz WXDMSDIYXNHBEI-WMZOPIPTSA-N 2 2 354.498 3.072 20 10 FGCDLP C[NH+]1CCN([C@H]2CCCC[N@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377698026 499721681 /nfs/dbraw/zinc/72/16/81/499721681.db2.gz PGFUDXHMCUCYDX-INIZCTEOSA-N 2 2 372.340 3.301 20 10 FGCDLP C[NH+]1CCN([C@H]2CCCC[N@@H+](Cc3cc(Cl)cc(Cl)c3O)C2)CC1 ZINC000377698026 499721682 /nfs/dbraw/zinc/72/16/82/499721682.db2.gz PGFUDXHMCUCYDX-INIZCTEOSA-N 2 2 372.340 3.301 20 10 FGCDLP C[C@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)cc(F)c1O ZINC000377796398 499735530 /nfs/dbraw/zinc/73/55/30/499735530.db2.gz NLGCMNVKGLPEQB-WPRPVWTQSA-N 2 2 354.223 3.225 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377865550 499743579 /nfs/dbraw/zinc/74/35/79/499743579.db2.gz SORRPHGUKXEINE-QGZVFWFLSA-N 2 2 369.509 3.496 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@@H+](C)C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000377865550 499743581 /nfs/dbraw/zinc/74/35/81/499743581.db2.gz SORRPHGUKXEINE-QGZVFWFLSA-N 2 2 369.509 3.496 20 10 FGCDLP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741989 700453956 /nfs/dbraw/zinc/45/39/56/700453956.db2.gz VDVJDEODVGDEOO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741989 700453959 /nfs/dbraw/zinc/45/39/59/700453959.db2.gz VDVJDEODVGDEOO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741989 700453961 /nfs/dbraw/zinc/45/39/61/700453961.db2.gz VDVJDEODVGDEOO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093741989 700453964 /nfs/dbraw/zinc/45/39/64/700453964.db2.gz VDVJDEODVGDEOO-ZDUSSCGKSA-N 2 2 371.319 3.327 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000192356532 712858195 /nfs/dbraw/zinc/85/81/95/712858195.db2.gz QBYQVKLKKHIHDA-IBGZPJMESA-N 2 2 360.885 3.426 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000192356532 712858197 /nfs/dbraw/zinc/85/81/97/712858197.db2.gz QBYQVKLKKHIHDA-IBGZPJMESA-N 2 2 360.885 3.426 20 10 FGCDLP CC[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc(Br)ccc1O ZINC000779065795 724386645 /nfs/dbraw/zinc/38/66/45/724386645.db2.gz PUBAEYRYEBZPKE-GXTWGEPZSA-N 2 2 350.260 3.407 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000781909804 724611403 /nfs/dbraw/zinc/61/14/03/724611403.db2.gz QUSXGYDDSZZBLL-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000781909804 724611404 /nfs/dbraw/zinc/61/14/04/724611404.db2.gz QUSXGYDDSZZBLL-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC000781909804 724611406 /nfs/dbraw/zinc/61/14/06/724611406.db2.gz QUSXGYDDSZZBLL-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c1 ZINC000781909804 724611408 /nfs/dbraw/zinc/61/14/08/724611408.db2.gz QUSXGYDDSZZBLL-CJNGLKHVSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000825303315 729377747 /nfs/dbraw/zinc/37/77/47/729377747.db2.gz HIKMFPOSDUYEQR-FQEVSTJZSA-N 2 2 360.885 3.081 20 10 FGCDLP Cc1cc(O)c(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000825303315 729377750 /nfs/dbraw/zinc/37/77/50/729377750.db2.gz HIKMFPOSDUYEQR-FQEVSTJZSA-N 2 2 360.885 3.081 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)cc1Cl ZINC000925781977 759537229 /nfs/dbraw/zinc/53/72/29/759537229.db2.gz JPWWPHXTOMYPPX-KGLIPLIRSA-N 2 2 373.875 3.072 20 10 FGCDLP Cc1cc(N2CCC([NH2+]Cc3c(O)ccc(Cl)c3F)CC2)nc(C)[nH+]1 ZINC000191292206 497770961 /nfs/dbraw/zinc/77/09/61/497770961.db2.gz CJFHNSNSLZDIFW-UHFFFAOYSA-N 2 2 364.852 3.350 20 10 FGCDLP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287798886 498866991 /nfs/dbraw/zinc/86/69/91/498866991.db2.gz TZSIMEDTXNRADO-MLGOLLRUSA-N 2 2 360.329 3.376 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C[C@@H]([NH3+])c3ccccc3)CC2)cc1 ZINC000370861335 499263592 /nfs/dbraw/zinc/26/35/92/499263592.db2.gz MIRVPCBVIHTQGO-OAQYLSRUSA-N 2 2 367.493 3.213 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@@H+]1C ZINC000765991639 723550353 /nfs/dbraw/zinc/55/03/53/723550353.db2.gz DNPUMXTURQIDRH-FHLIZLRMSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@H+]1C ZINC000765991639 723550354 /nfs/dbraw/zinc/55/03/54/723550354.db2.gz DNPUMXTURQIDRH-FHLIZLRMSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774122417 723861255 /nfs/dbraw/zinc/86/12/55/723861255.db2.gz LGMBNZPBFQYLMC-CYBMUJFWSA-N 2 2 360.329 3.377 20 10 FGCDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000809752533 725265249 /nfs/dbraw/zinc/26/52/49/725265249.db2.gz FOWDEAIZIJKJIS-UHFFFAOYSA-N 2 2 352.276 3.490 20 10 FGCDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000809752533 725265252 /nfs/dbraw/zinc/26/52/52/725265252.db2.gz FOWDEAIZIJKJIS-UHFFFAOYSA-N 2 2 352.276 3.490 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1 ZINC000841087431 730209179 /nfs/dbraw/zinc/20/91/79/730209179.db2.gz NMTMPLFWHSLBOU-BBRMVZONSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)c1 ZINC000841087431 730209181 /nfs/dbraw/zinc/20/91/81/730209181.db2.gz NMTMPLFWHSLBOU-BBRMVZONSA-N 2 2 353.304 3.427 20 10 FGCDLP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843051631 730574298 /nfs/dbraw/zinc/57/42/98/730574298.db2.gz APTBVQYAQFNJLS-INIZCTEOSA-N 2 2 366.347 3.481 20 10 FGCDLP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843051631 730574301 /nfs/dbraw/zinc/57/43/01/730574301.db2.gz APTBVQYAQFNJLS-INIZCTEOSA-N 2 2 366.347 3.481 20 10 FGCDLP C[N@@H+]1CC[C@@H](N[C@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137227 732184627 /nfs/dbraw/zinc/18/46/27/732184627.db2.gz KBHUYCIHMSQWDD-MSOLQXFVSA-N 2 2 365.949 3.472 20 10 FGCDLP C[N@H+]1CC[C@@H](N[C@H]2CCC[NH+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137227 732184628 /nfs/dbraw/zinc/18/46/28/732184628.db2.gz KBHUYCIHMSQWDD-MSOLQXFVSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@@H](N[C@H]2CCC[N@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137227 732184629 /nfs/dbraw/zinc/18/46/29/732184629.db2.gz KBHUYCIHMSQWDD-MSOLQXFVSA-N 2 2 365.949 3.472 20 10 FGCDLP C[NH+]1CC[C@@H](N[C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)CC1(C)C ZINC000858137227 732184630 /nfs/dbraw/zinc/18/46/30/732184630.db2.gz KBHUYCIHMSQWDD-MSOLQXFVSA-N 2 2 365.949 3.472 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)cc1Cl ZINC000925781980 759537274 /nfs/dbraw/zinc/53/72/74/759537274.db2.gz JPWWPHXTOMYPPX-UONOGXRCSA-N 2 2 373.875 3.072 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1O ZINC000093597103 494902726 /nfs/dbraw/zinc/90/27/26/494902726.db2.gz PQGGPOBHOMNOAR-CYBMUJFWSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1O ZINC000093597103 494902730 /nfs/dbraw/zinc/90/27/30/494902730.db2.gz PQGGPOBHOMNOAR-CYBMUJFWSA-N 2 2 369.303 3.081 20 10 FGCDLP COCC[NH+]1CCC([NH2+][C@H](C)c2cc(Br)cc(C)c2O)CC1 ZINC000187066424 496277503 /nfs/dbraw/zinc/27/75/03/496277503.db2.gz ASRAUQPFLQWSQP-CYBMUJFWSA-N 2 2 371.319 3.225 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@@H]2CC[N@H+](Cc3cnc(C)s3)C[C@H]2C)c1 ZINC000373185434 499456029 /nfs/dbraw/zinc/45/60/29/499456029.db2.gz IMPUTFXOGRVVJD-FZKQIMNGSA-N 2 2 361.511 3.166 20 10 FGCDLP COc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+](Cc3cnc(C)s3)C[C@H]2C)c1 ZINC000373185434 499456030 /nfs/dbraw/zinc/45/60/30/499456030.db2.gz IMPUTFXOGRVVJD-FZKQIMNGSA-N 2 2 361.511 3.166 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@@H+]1C ZINC000765991641 723550325 /nfs/dbraw/zinc/55/03/25/723550325.db2.gz DNPUMXTURQIDRH-OLMNPRSZSA-N 2 2 351.922 3.082 20 10 FGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC[N@H+]1C ZINC000765991641 723550327 /nfs/dbraw/zinc/55/03/27/723550327.db2.gz DNPUMXTURQIDRH-OLMNPRSZSA-N 2 2 351.922 3.082 20 10 FGCDLP C[NH+](C)Cc1cnc(C[NH2+]Cc2ccc(N3CCSCC3)cc2)s1 ZINC000796264862 723629071 /nfs/dbraw/zinc/62/90/71/723629071.db2.gz ABZBOSMYDQBNTC-UHFFFAOYSA-N 2 2 362.568 3.048 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](c4ccsc4)C3)cc2)CC1 ZINC000775726745 724031872 /nfs/dbraw/zinc/03/18/72/724031872.db2.gz YQNNTEQURVURAR-FQEVSTJZSA-N 2 2 357.523 3.073 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](c4ccsc4)C3)cc2)CC1 ZINC000775726745 724031878 /nfs/dbraw/zinc/03/18/78/724031878.db2.gz YQNNTEQURVURAR-FQEVSTJZSA-N 2 2 357.523 3.073 20 10 FGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Br)nc1 ZINC000817942080 727288979 /nfs/dbraw/zinc/28/89/79/727288979.db2.gz MDRRKEPELLCUSW-LRDDRELGSA-N 2 2 363.303 3.261 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2cccc(C[NH+]3CCOCC3)c2)cc1Cl ZINC000825126015 729372091 /nfs/dbraw/zinc/37/20/91/729372091.db2.gz NSORELNCNYZZNU-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccncc3Cl)cc2F)CC1 ZINC000858130865 732183575 /nfs/dbraw/zinc/18/35/75/732183575.db2.gz BOMLVMMYWRYQRL-UHFFFAOYSA-N 2 2 362.880 3.306 20 10 FGCDLP Oc1c(F)cc(Br)cc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000882935479 737505333 /nfs/dbraw/zinc/50/53/33/737505333.db2.gz RLTBTYFBVOTYRY-UHFFFAOYSA-N 2 2 357.267 3.400 20 10 FGCDLP CCC[NH+]1CCN(C2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)CC1 ZINC000365269340 498382067 /nfs/dbraw/zinc/38/20/67/498382067.db2.gz SDQBSBMVUQXAGZ-UHFFFAOYSA-N 2 2 369.912 3.177 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1 ZINC000363176236 498688435 /nfs/dbraw/zinc/68/84/35/498688435.db2.gz GZDJDGMXUMPKLH-UTKZUKDTSA-N 2 2 372.513 3.087 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1 ZINC000363176236 498688441 /nfs/dbraw/zinc/68/84/41/498688441.db2.gz GZDJDGMXUMPKLH-UTKZUKDTSA-N 2 2 372.513 3.087 20 10 FGCDLP C[C@H]1CC[C@H](C)[NH+]1CCN1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000092665217 700439403 /nfs/dbraw/zinc/43/94/03/700439403.db2.gz OLFPFJREXSLKLW-HOTGVXAUSA-N 2 2 351.922 3.036 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000192356527 712858146 /nfs/dbraw/zinc/85/81/46/712858146.db2.gz QBYQVKLKKHIHDA-LJQANCHMSA-N 2 2 360.885 3.426 20 10 FGCDLP Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000192356527 712858147 /nfs/dbraw/zinc/85/81/47/712858147.db2.gz QBYQVKLKKHIHDA-LJQANCHMSA-N 2 2 360.885 3.426 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(F)cc(F)c1O ZINC000756765051 722969811 /nfs/dbraw/zinc/96/98/11/722969811.db2.gz NDAGJCPZXXFPRK-RZAIGCCYSA-N 2 2 354.441 3.089 20 10 FGCDLP C[C@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)cc(Cl)c1O ZINC000774378582 723886596 /nfs/dbraw/zinc/88/65/96/723886596.db2.gz CQWODJGEJRPGBF-JTQLQIEISA-N 2 2 365.699 3.037 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000775725517 724031311 /nfs/dbraw/zinc/03/13/11/724031311.db2.gz PLUZSNXWGSCZBK-UHFFFAOYSA-N 2 2 356.869 3.262 20 10 FGCDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756162 730271056 /nfs/dbraw/zinc/27/10/56/730271056.db2.gz UMBDVFPJLSISAY-MGPUTAFESA-N 2 2 360.885 3.333 20 10 FGCDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cc1O ZINC000841756162 730271058 /nfs/dbraw/zinc/27/10/58/730271058.db2.gz UMBDVFPJLSISAY-MGPUTAFESA-N 2 2 360.885 3.333 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C2)c1 ZINC000873228086 735740271 /nfs/dbraw/zinc/74/02/71/735740271.db2.gz PFASZCUFTGJNOR-MNOVXSKESA-N 2 2 367.209 3.032 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@@H](C[NH3+])[C@@H](C(F)(F)F)C2)c1 ZINC000873228086 735740273 /nfs/dbraw/zinc/74/02/73/735740273.db2.gz PFASZCUFTGJNOR-MNOVXSKESA-N 2 2 367.209 3.032 20 10 FGCDLP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+]2CCOCC2)c1 ZINC000185197558 496700625 /nfs/dbraw/zinc/70/06/25/496700625.db2.gz TUHOQQPHBJVWRZ-GOSISDBHSA-N 2 2 370.493 3.262 20 10 FGCDLP C[C@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(N2CCOCC2)c(F)c1 ZINC000367438568 499199136 /nfs/dbraw/zinc/19/91/36/499199136.db2.gz NUILNLCHPNVIEL-HNNXBMFYSA-N 2 2 358.461 3.046 20 10 FGCDLP COc1cccc(C[NH2+]C2CC([NH+]3CCC(C(F)(F)F)CC3)C2)c1O ZINC000373489886 499472873 /nfs/dbraw/zinc/47/28/73/499472873.db2.gz NCDFWJYROXQRNC-UHFFFAOYSA-N 2 2 358.404 3.296 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CCC(c3c[nH+]c[nH]3)CC2)c1O ZINC000378335828 499502878 /nfs/dbraw/zinc/50/28/78/499502878.db2.gz UNMORHIFSZJMJM-UHFFFAOYSA-N 2 2 366.259 3.266 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CCC(c3c[nH]c[nH+]3)CC2)c1O ZINC000378335828 499502881 /nfs/dbraw/zinc/50/28/81/499502881.db2.gz UNMORHIFSZJMJM-UHFFFAOYSA-N 2 2 366.259 3.266 20 10 FGCDLP Cc1ncc(C[N@@H+]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@H](C)C2)s1 ZINC000377777494 499731984 /nfs/dbraw/zinc/73/19/84/499731984.db2.gz BFXZAXQFUAEFNU-AUUYWEPGSA-N 2 2 357.523 3.387 20 10 FGCDLP Cc1ncc(C[N@H+]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CCO4)[C@H](C)C2)s1 ZINC000377777494 499731985 /nfs/dbraw/zinc/73/19/85/499731985.db2.gz BFXZAXQFUAEFNU-AUUYWEPGSA-N 2 2 357.523 3.387 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377911987 499747518 /nfs/dbraw/zinc/74/75/18/499747518.db2.gz JNPZPMJFUJGZSX-MRXNPFEDSA-N 2 2 355.482 3.453 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[N@@H+](C)C2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000377911987 499747520 /nfs/dbraw/zinc/74/75/20/499747520.db2.gz JNPZPMJFUJGZSX-MRXNPFEDSA-N 2 2 355.482 3.453 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000809767540 725266695 /nfs/dbraw/zinc/26/66/95/725266695.db2.gz NMAVSKLBASQPBT-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000809767540 725266697 /nfs/dbraw/zinc/26/66/97/725266697.db2.gz NMAVSKLBASQPBT-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c1 ZINC000809767540 725266698 /nfs/dbraw/zinc/26/66/98/725266698.db2.gz NMAVSKLBASQPBT-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c1 ZINC000809767540 725266701 /nfs/dbraw/zinc/26/67/01/725266701.db2.gz NMAVSKLBASQPBT-CZUORRHYSA-N 2 2 353.304 3.379 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Br)nc1 ZINC000817942087 727288918 /nfs/dbraw/zinc/28/89/18/727288918.db2.gz MDRRKEPELLCUSW-WBMJQRKESA-N 2 2 363.303 3.261 20 10 FGCDLP Cc1cc(O)c(C[NH2+]Cc2cccc(C[NH+]3CCOCC3)c2)c(Cl)c1 ZINC000840879022 730187189 /nfs/dbraw/zinc/18/71/89/730187189.db2.gz BJLXMFCCDAWYDL-UHFFFAOYSA-N 2 2 360.885 3.476 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1cc(Br)ccc1O ZINC000850556876 731372681 /nfs/dbraw/zinc/37/26/81/731372681.db2.gz KJTKFCYQJSRJTR-WFASDCNBSA-N 2 2 369.303 3.059 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1ccc(Br)cc1O ZINC000850557062 731372819 /nfs/dbraw/zinc/37/28/19/731372819.db2.gz KPJQNZYIISRDQT-SWLSCSKDSA-N 2 2 369.303 3.059 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1ccc(Br)cc1O ZINC000850557058 731372835 /nfs/dbraw/zinc/37/28/35/731372835.db2.gz KPJQNZYIISRDQT-DOMZBBRYSA-N 2 2 369.303 3.059 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(N2CCOCC2)cc1Cl ZINC000925781975 759538314 /nfs/dbraw/zinc/53/83/14/759538314.db2.gz JPWWPHXTOMYPPX-KBPBESRZSA-N 2 2 373.875 3.072 20 10 FGCDLP COc1cc(Br)cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1O ZINC000092648427 494692553 /nfs/dbraw/zinc/69/25/53/494692553.db2.gz CKELOTSXDLJOGD-UHFFFAOYSA-N 2 2 366.259 3.197 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000185472917 495590827 /nfs/dbraw/zinc/59/08/27/495590827.db2.gz AUVPTIZINMCYNY-GUXCAODWSA-N 2 2 355.482 3.357 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccn3)C[C@H]2C)c1 ZINC000185472917 495590831 /nfs/dbraw/zinc/59/08/31/495590831.db2.gz AUVPTIZINMCYNY-GUXCAODWSA-N 2 2 355.482 3.357 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)[C@H](C)C1 ZINC000187722453 496546566 /nfs/dbraw/zinc/54/65/66/496546566.db2.gz ZPXICJMOWZXGQR-KEYYUXOJSA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)[C@H](C)C1 ZINC000187722453 496546571 /nfs/dbraw/zinc/54/65/71/496546571.db2.gz ZPXICJMOWZXGQR-KEYYUXOJSA-N 2 2 356.457 3.458 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1O ZINC000187798543 496576250 /nfs/dbraw/zinc/57/62/50/496576250.db2.gz OOGWCWZAYQQBQT-JLZZUVOBSA-N 2 2 354.441 3.089 20 10 FGCDLP Cn1cc([C@@H]2[C@@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@@H+]2C)cn1 ZINC000363176197 498686509 /nfs/dbraw/zinc/68/65/09/498686509.db2.gz GMRVDHVEAZNQSI-VGSWGCGISA-N 2 2 364.493 3.452 20 10 FGCDLP Cn1cc([C@@H]2[C@@H](C[NH2+]Cc3c(O)ccc4ccccc43)CCC[N@H+]2C)cn1 ZINC000363176197 498686512 /nfs/dbraw/zinc/68/65/12/498686512.db2.gz GMRVDHVEAZNQSI-VGSWGCGISA-N 2 2 364.493 3.452 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c(O)c1C ZINC000363860957 499029945 /nfs/dbraw/zinc/02/99/45/499029945.db2.gz VXMWMMSPONPHCQ-ABSDTBQOSA-N 2 2 356.514 3.476 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c(O)c1C ZINC000363860957 499029948 /nfs/dbraw/zinc/02/99/48/499029948.db2.gz VXMWMMSPONPHCQ-ABSDTBQOSA-N 2 2 356.514 3.476 20 10 FGCDLP CCCOc1ccc(C[N@@H+]2CCCN(Cc3[nH+]ccn3CC)CC2)c(O)c1 ZINC000371414708 499323067 /nfs/dbraw/zinc/32/30/67/499323067.db2.gz LAOCPXCUKDPMNW-UHFFFAOYSA-N 2 2 372.513 3.105 20 10 FGCDLP CCCOc1ccc(C[N@H+]2CCCN(Cc3[nH+]ccn3CC)CC2)c(O)c1 ZINC000371414708 499323069 /nfs/dbraw/zinc/32/30/69/499323069.db2.gz LAOCPXCUKDPMNW-UHFFFAOYSA-N 2 2 372.513 3.105 20 10 FGCDLP CN(C)c1ccc(C[N@H+](C)C2CC[NH+](CCc3ccncc3)CC2)cc1 ZINC000373248567 499459838 /nfs/dbraw/zinc/45/98/38/499459838.db2.gz YIZUXSWQFLJTAO-UHFFFAOYSA-N 2 2 352.526 3.287 20 10 FGCDLP CN(C)c1ccc(C[N@@H+](C)C2CC[NH+](CCc3ccncc3)CC2)cc1 ZINC000373248567 499459839 /nfs/dbraw/zinc/45/98/39/499459839.db2.gz YIZUXSWQFLJTAO-UHFFFAOYSA-N 2 2 352.526 3.287 20 10 FGCDLP Oc1cc2c(cc1C[NH2+]C1CC([NH+]3CCC(C(F)(F)F)CC3)C1)OCO2 ZINC000373486180 499472774 /nfs/dbraw/zinc/47/27/74/499472774.db2.gz RAWXSYHXKDAJTO-UHFFFAOYSA-N 2 2 372.387 3.016 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@H+](C[C@H]2CCCO2)C[C@@H]1C)c1ccc(F)cc1O ZINC000375800911 499557061 /nfs/dbraw/zinc/55/70/61/499557061.db2.gz FTQRCWBEYZUVIF-QNDJGXFYSA-N 2 2 350.478 3.461 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@H]2CCCO2)C[C@@H]1C)c1ccc(F)cc1O ZINC000375800911 499557062 /nfs/dbraw/zinc/55/70/62/499557062.db2.gz FTQRCWBEYZUVIF-QNDJGXFYSA-N 2 2 350.478 3.461 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c1 ZINC000762484181 723247511 /nfs/dbraw/zinc/24/75/11/723247511.db2.gz UVUHCGMKVGVFOF-CQSZACIVSA-N 2 2 371.319 3.054 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)c1 ZINC000762484181 723247514 /nfs/dbraw/zinc/24/75/14/723247514.db2.gz UVUHCGMKVGVFOF-CQSZACIVSA-N 2 2 371.319 3.054 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc(Cl)c1O ZINC000806139201 725117780 /nfs/dbraw/zinc/11/77/80/725117780.db2.gz LLOYOWHGYAXUNO-KRWDZBQOSA-N 2 2 367.921 3.029 20 10 FGCDLP CSC1(C[NH2+]Cc2cccc(Br)c2O)CC[NH+](C)CC1 ZINC000810170229 725294336 /nfs/dbraw/zinc/29/43/36/725294336.db2.gz IOYBIIUPMGFHIV-UHFFFAOYSA-N 2 2 359.333 3.072 20 10 FGCDLP C[C@@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 ZINC000817931309 727288338 /nfs/dbraw/zinc/28/83/38/727288338.db2.gz QLHHPAOOTQHRJJ-RYRKJORJSA-N 2 2 365.949 3.433 20 10 FGCDLP CC[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1cc(Cl)ccc1O ZINC000817983785 727290505 /nfs/dbraw/zinc/29/05/05/727290505.db2.gz QHZMUPKPYNUWND-LEOMRAHMSA-N 2 2 351.922 3.303 20 10 FGCDLP CC[C@@H]([NH2+]C1CCC(N2CC[NH2+]CC2)CC1)c1cc(Cl)ccc1O ZINC000817983785 727290506 /nfs/dbraw/zinc/29/05/06/727290506.db2.gz QHZMUPKPYNUWND-LEOMRAHMSA-N 2 2 351.922 3.303 20 10 FGCDLP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843048254 730573876 /nfs/dbraw/zinc/57/38/76/730573876.db2.gz GWVXQRGWDZMYQG-OAHLLOKOSA-N 2 2 352.320 3.220 20 10 FGCDLP [NH3+]C[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)c(Br)c2)C1 ZINC000843048254 730573881 /nfs/dbraw/zinc/57/38/81/730573881.db2.gz GWVXQRGWDZMYQG-OAHLLOKOSA-N 2 2 352.320 3.220 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H]3CC[C@H](C)SC3)CC2)cc1 ZINC000848516179 731173704 /nfs/dbraw/zinc/17/37/04/731173704.db2.gz AKWOIUGKNHJNGE-ZWKOTPCHSA-N 2 2 363.571 3.081 20 10 FGCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H]3CC[C@H](C)SC3)CC2)cc1 ZINC000848516178 731173847 /nfs/dbraw/zinc/17/38/47/731173847.db2.gz AKWOIUGKNHJNGE-ROUUACIJSA-N 2 2 363.571 3.081 20 10 FGCDLP COc1cc(Br)cc([C@@H](C)[NH2+][C@@H](C)Cn2cc[nH+]c2)c1O ZINC000848517938 731174332 /nfs/dbraw/zinc/17/43/32/731174332.db2.gz HSJTVKPCSWGYSM-WDEREUQCSA-N 2 2 354.248 3.099 20 10 FGCDLP COc1cc(Br)cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1O ZINC000093597104 494902392 /nfs/dbraw/zinc/90/23/92/494902392.db2.gz PQGGPOBHOMNOAR-ZDUSSCGKSA-N 2 2 369.303 3.081 20 10 FGCDLP COc1cc(Br)cc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1O ZINC000093597104 494902395 /nfs/dbraw/zinc/90/23/95/494902395.db2.gz PQGGPOBHOMNOAR-ZDUSSCGKSA-N 2 2 369.303 3.081 20 10 FGCDLP C[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N2CCC(O)CC2)cc1 ZINC000152736853 496240756 /nfs/dbraw/zinc/24/07/56/496240756.db2.gz NUVCLJZAYGRUBK-KRWDZBQOSA-N 2 2 368.525 3.074 20 10 FGCDLP C[C@H]1C[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@@H+]1C1CC1 ZINC000157746432 496544944 /nfs/dbraw/zinc/54/49/44/496544944.db2.gz YXMWRPBZQBRSJV-GOEBONIOSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@H]1C[C@@H]([NH2+]C2CCN(c3ccc(OC(F)F)cc3)CC2)C[N@H+]1C1CC1 ZINC000157746432 496544950 /nfs/dbraw/zinc/54/49/50/496544950.db2.gz YXMWRPBZQBRSJV-GOEBONIOSA-N 2 2 365.468 3.472 20 10 FGCDLP C[C@@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)c[nH+]1)c1cc([N+](=O)[O-])ccc1O ZINC000273527167 496830912 /nfs/dbraw/zinc/83/09/12/496830912.db2.gz VOOVBSFWECBXAG-CZUORRHYSA-N 2 2 371.441 3.009 20 10 FGCDLP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000278895004 497259018 /nfs/dbraw/zinc/25/90/18/497259018.db2.gz YVQPYOIXZZFCJX-QWHCGFSZSA-N 2 2 360.329 3.376 20 10 FGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cccc(C[NH+]2CCOCC2)c1 ZINC000294226071 498625819 /nfs/dbraw/zinc/62/58/19/498625819.db2.gz MBYCYGYQRAPLEJ-UHFFFAOYSA-N 2 2 364.848 3.307 20 10 FGCDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)c1ccc(N3CCC(O)CC3)cc1)CCC2 ZINC000363756970 498976240 /nfs/dbraw/zinc/97/62/40/498976240.db2.gz JFBYJBNZFRGLQJ-PKOBYXMFSA-N 2 2 368.525 3.381 20 10 FGCDLP CC[C@H](c1ccccc1O)[N@H+](C)C[C@@H]1C[C@H](F)CN1Cc1[nH+]ccn1C ZINC000367376460 499190992 /nfs/dbraw/zinc/19/09/92/499190992.db2.gz ATXLZXUNYYLGQS-XYJFISCASA-N 2 2 360.477 3.121 20 10 FGCDLP CC[C@H](c1ccccc1O)[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1[nH+]ccn1C ZINC000367376460 499190995 /nfs/dbraw/zinc/19/09/95/499190995.db2.gz ATXLZXUNYYLGQS-XYJFISCASA-N 2 2 360.477 3.121 20 10 FGCDLP Cc1cc(Br)cc(C[N@H+]2CC[C@H](c3[nH+]ccn3C)C2)c1O ZINC000377886715 499745542 /nfs/dbraw/zinc/74/55/42/499745542.db2.gz AGLCRHSQKUIPJJ-LBPRGKRZSA-N 2 2 350.260 3.186 20 10 FGCDLP Cc1cc(Br)cc(C[N@@H+]2CC[C@H](c3[nH+]ccn3C)C2)c1O ZINC000377886715 499745543 /nfs/dbraw/zinc/74/55/43/499745543.db2.gz AGLCRHSQKUIPJJ-LBPRGKRZSA-N 2 2 350.260 3.186 20 10 FGCDLP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093692911 700453409 /nfs/dbraw/zinc/45/34/09/700453409.db2.gz WJULMBMTWNOSQO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc(Br)cc(OC)c2O)C1 ZINC000093692911 700453411 /nfs/dbraw/zinc/45/34/11/700453411.db2.gz WJULMBMTWNOSQO-CYBMUJFWSA-N 2 2 371.319 3.327 20 10 FGCDLP C[C@@H]([NH2+]CCOCC[NH+](C)C)c1cc(Br)cc(Cl)c1O ZINC000774378583 723886520 /nfs/dbraw/zinc/88/65/20/723886520.db2.gz CQWODJGEJRPGBF-SNVBAGLBSA-N 2 2 365.699 3.037 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403285 722964084 /nfs/dbraw/zinc/96/40/84/722964084.db2.gz XNXLXQONHUKQFG-WDEREUQCSA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403285 722964085 /nfs/dbraw/zinc/96/40/85/722964085.db2.gz XNXLXQONHUKQFG-WDEREUQCSA-N 2 2 357.267 3.429 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c1 ZINC000762484180 723247263 /nfs/dbraw/zinc/24/72/63/723247263.db2.gz UVUHCGMKVGVFOF-AWEZNQCLSA-N 2 2 371.319 3.054 20 10 FGCDLP Cc1cc(Br)c(O)c(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)c1 ZINC000762484180 723247269 /nfs/dbraw/zinc/24/72/69/723247269.db2.gz UVUHCGMKVGVFOF-AWEZNQCLSA-N 2 2 371.319 3.054 20 10 FGCDLP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165402 723559108 /nfs/dbraw/zinc/55/91/08/723559108.db2.gz HQAPOVXFWNLTIJ-PMPSAXMXSA-N 2 2 351.922 3.310 20 10 FGCDLP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(N2CCOCC2)cc1Cl ZINC000766165402 723559109 /nfs/dbraw/zinc/55/91/09/723559109.db2.gz HQAPOVXFWNLTIJ-PMPSAXMXSA-N 2 2 351.922 3.310 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000775667062 724020001 /nfs/dbraw/zinc/02/00/01/724020001.db2.gz DSMPELCLVJIPLN-UHFFFAOYSA-N 2 2 356.869 3.119 20 10 FGCDLP CC[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810213096 725297144 /nfs/dbraw/zinc/29/71/44/725297144.db2.gz LPKANLQDBAYVIM-MRXNPFEDSA-N 2 2 360.420 3.299 20 10 FGCDLP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815558914 727083995 /nfs/dbraw/zinc/08/39/95/727083995.db2.gz RPBALQWXVJRLBH-AWEZNQCLSA-N 2 2 359.436 3.089 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816549015 727174016 /nfs/dbraw/zinc/17/40/16/727174016.db2.gz AGMYOWGENFFYLI-GUYCJALGSA-N 2 2 358.885 3.411 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816549015 727174020 /nfs/dbraw/zinc/17/40/20/727174020.db2.gz AGMYOWGENFFYLI-GUYCJALGSA-N 2 2 358.885 3.411 20 10 FGCDLP COc1cc(Br)cc([C@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000848548072 731179469 /nfs/dbraw/zinc/17/94/69/731179469.db2.gz ULLNFWSDQBXYFZ-JQWIXIFHSA-N 2 2 366.259 3.025 20 10 FGCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2F)CC1 ZINC000877011452 736175184 /nfs/dbraw/zinc/17/51/84/736175184.db2.gz CHXBWLQEQAFFHR-UHFFFAOYSA-N 2 2 368.909 3.367 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1O ZINC000187911366 496617139 /nfs/dbraw/zinc/61/71/39/496617139.db2.gz UHRYWNNNPMWAAL-CJNGLKHVSA-N 2 2 362.420 3.088 20 10 FGCDLP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(F)c(F)c1O ZINC000187911366 496617141 /nfs/dbraw/zinc/61/71/41/496617141.db2.gz UHRYWNNNPMWAAL-CJNGLKHVSA-N 2 2 362.420 3.088 20 10 FGCDLP Oc1ccc(Cl)c(F)c1C[NH2+]C1CC[NH+](CCc2ccncc2)CC1 ZINC000365076022 498286428 /nfs/dbraw/zinc/28/64/28/498286428.db2.gz DAURDTXXKPOPGI-UHFFFAOYSA-N 2 2 363.864 3.376 20 10 FGCDLP COc1c(O)c(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000365828036 498658492 /nfs/dbraw/zinc/65/84/92/498658492.db2.gz TZTNSNKGCOFWSM-MAUKXSAKSA-N 2 2 371.437 3.092 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)cc(F)c1O ZINC000377796397 499735494 /nfs/dbraw/zinc/73/54/94/499735494.db2.gz NLGCMNVKGLPEQB-WCBMZHEXSA-N 2 2 354.223 3.225 20 10 FGCDLP C[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000779067301 724387104 /nfs/dbraw/zinc/38/71/04/724387104.db2.gz UOGZXPRKYKBNDB-GJZGRUSLSA-N 2 2 360.889 3.039 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1ccc(N2CCOCC2)cc1Cl ZINC000779067304 724387151 /nfs/dbraw/zinc/38/71/51/724387151.db2.gz UOGZXPRKYKBNDB-LSDHHAIUSA-N 2 2 360.889 3.039 20 10 FGCDLP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1O ZINC000806149891 725118269 /nfs/dbraw/zinc/11/82/69/725118269.db2.gz YOMHESPXCQLLET-OKZBNKHCSA-N 2 2 352.906 3.464 20 10 FGCDLP CC[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1cc(Cl)ccc1O ZINC000817983784 727290337 /nfs/dbraw/zinc/29/03/37/727290337.db2.gz QHZMUPKPYNUWND-HTWSVDAQSA-N 2 2 351.922 3.303 20 10 FGCDLP CC[C@H]([NH2+]C1CCC(N2CC[NH2+]CC2)CC1)c1cc(Cl)ccc1O ZINC000817983784 727290343 /nfs/dbraw/zinc/29/03/43/727290343.db2.gz QHZMUPKPYNUWND-HTWSVDAQSA-N 2 2 351.922 3.303 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(N(C)C)cc1 ZINC000163703523 496548200 /nfs/dbraw/zinc/54/82/00/496548200.db2.gz YXYXVYMHOKHQTO-GOSISDBHSA-N 2 2 353.510 3.436 20 10 FGCDLP FC(F)(F)CC[NH+]1CCC([NH2+]Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000272565983 497665244 /nfs/dbraw/zinc/66/52/44/497665244.db2.gz OEFGASPBEVKVNN-UHFFFAOYSA-N 2 2 371.447 3.030 20 10 FGCDLP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1O ZINC000287612024 498813981 /nfs/dbraw/zinc/81/39/81/498813981.db2.gz JIMJXVQNGJTIIN-LRDDRELGSA-N 2 2 360.329 3.376 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccnc3)C2)c1 ZINC000363862384 499029833 /nfs/dbraw/zinc/02/98/33/499029833.db2.gz ITIAZRLUGWPIIF-FUHWJXTLSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccnc3)C2)c1 ZINC000363862384 499029836 /nfs/dbraw/zinc/02/98/36/499029836.db2.gz ITIAZRLUGWPIIF-FUHWJXTLSA-N 2 2 355.482 3.359 20 10 FGCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)CC2)cc1 ZINC000370766447 499252647 /nfs/dbraw/zinc/25/26/47/499252647.db2.gz LRZUXHMVGJUQBY-NDXORKPFSA-N 2 2 371.525 3.043 20 10 FGCDLP Oc1cc(F)c(Cl)cc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000816499508 727168575 /nfs/dbraw/zinc/16/85/75/727168575.db2.gz SIIFUGYWFUUMNJ-UHFFFAOYSA-N 2 2 356.869 3.119 20 10 FGCDLP CCN(CC)c1ccc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)cc1F ZINC000827855828 729436047 /nfs/dbraw/zinc/43/60/47/729436047.db2.gz JEFPFFIVPBUVLJ-GOSISDBHSA-N 2 2 351.510 3.215 20 10 FGCDLP CCN(CC)c1ccc(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)cc1F ZINC000827855828 729436048 /nfs/dbraw/zinc/43/60/48/729436048.db2.gz JEFPFFIVPBUVLJ-GOSISDBHSA-N 2 2 351.510 3.215 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)c1cc(Br)ccc1O ZINC000850556874 731372920 /nfs/dbraw/zinc/37/29/20/731372920.db2.gz KJTKFCYQJSRJTR-IUODEOHRSA-N 2 2 369.303 3.059 20 10 FGCDLP CC[C@@H]([NH2+]Cc1ccc(C(=O)N2CC[NH+](C)CC2)cc1)c1ccccc1O ZINC000274892483 497193267 /nfs/dbraw/zinc/19/32/67/497193267.db2.gz JQARYDYIKNXQIG-HXUWFJFHSA-N 2 2 367.493 3.021 20 10 FGCDLP C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)CN1CC[NH+](C)CC1 ZINC000192822837 497223222 /nfs/dbraw/zinc/22/32/22/497223222.db2.gz XGBUOLQLIKOISF-STQMWFEESA-N 2 2 360.329 3.233 20 10 FGCDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278895007 497258503 /nfs/dbraw/zinc/25/85/03/497258503.db2.gz YVQPYOIXZZFCJX-STQMWFEESA-N 2 2 360.329 3.376 20 10 FGCDLP Cc1cc[nH+]cc1CCC[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000289053599 497995658 /nfs/dbraw/zinc/99/56/58/497995658.db2.gz BMBBGFLONJOJCZ-UHFFFAOYSA-N 2 2 357.473 3.213 20 10 FGCDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)CC1 ZINC000364587573 498037398 /nfs/dbraw/zinc/03/73/98/498037398.db2.gz DLIDTDFKGHGTHN-UHFFFAOYSA-N 2 2 369.912 3.175 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@@H+]2CCCN(Cc3[nH+]ccn3C(C)C)CC2)c1 ZINC000372710237 499164914 /nfs/dbraw/zinc/16/49/14/499164914.db2.gz CEEPYWSDEGQNMX-KRWDZBQOSA-N 2 2 372.513 3.447 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@H+](C)C[C@@H]2CCC[NH+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699470 499722230 /nfs/dbraw/zinc/72/22/30/499722230.db2.gz MNJXWXKHESFXBH-CKJXQJPGSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@H](C)[N@@H+](C)C[C@@H]2CCC[NH+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699470 499722232 /nfs/dbraw/zinc/72/22/32/499722232.db2.gz MNJXWXKHESFXBH-CKJXQJPGSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH+](C)C[C@@H]2CCC[N@H+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699470 499722233 /nfs/dbraw/zinc/72/22/33/499722233.db2.gz MNJXWXKHESFXBH-CKJXQJPGSA-N 2 2 372.513 3.210 20 10 FGCDLP COc1ccc(O)c([C@H](C)[NH+](C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c1 ZINC000377699470 499722235 /nfs/dbraw/zinc/72/22/35/499722235.db2.gz MNJXWXKHESFXBH-CKJXQJPGSA-N 2 2 372.513 3.210 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000377803575 499736533 /nfs/dbraw/zinc/73/65/33/499736533.db2.gz YAUUTHMJZYMGMV-PWSUYJOCSA-N 2 2 350.260 3.394 20 10 FGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CCc3[nH]c[nH+]c3C2)c1O ZINC000377803575 499736534 /nfs/dbraw/zinc/73/65/34/499736534.db2.gz YAUUTHMJZYMGMV-PWSUYJOCSA-N 2 2 350.260 3.394 20 10 FGCDLP CC[NH+]1CCC([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 ZINC000765993190 723550585 /nfs/dbraw/zinc/55/05/85/723550585.db2.gz LQXDPFNEADIOHT-GOSISDBHSA-N 2 2 351.922 3.084 20 10 FGCDLP CC[C@@H]([NH2+]C1CC[NH+](CCC(=O)N(C)C)CC1)c1cc(Cl)ccc1O ZINC000775504065 723996665 /nfs/dbraw/zinc/99/66/65/723996665.db2.gz RPOWRFOQBOPNER-QGZVFWFLSA-N 2 2 367.921 3.029 20 10 FGCDLP Oc1cc(Br)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000824870224 729363096 /nfs/dbraw/zinc/36/30/96/729363096.db2.gz OFPMEPSOGSMDQE-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP Oc1cc(Br)ccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000824870224 729363098 /nfs/dbraw/zinc/36/30/98/729363098.db2.gz OFPMEPSOGSMDQE-CQSZACIVSA-N 2 2 353.304 3.463 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000843044413 730573220 /nfs/dbraw/zinc/57/32/20/730573220.db2.gz BFVTVOXLNOSZTB-XJKSGUPXSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000843044413 730573222 /nfs/dbraw/zinc/57/32/22/730573222.db2.gz BFVTVOXLNOSZTB-XJKSGUPXSA-N 2 2 353.304 3.427 20 10 FGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000882979507 737508604 /nfs/dbraw/zinc/50/86/04/737508604.db2.gz BVNQUZVPIQUHOY-SNVBAGLBSA-N 2 2 356.239 3.225 20 10 FGCDLP CC[NH+](CC)Cc1nc(C2([NH2+]Cc3cccc(C)c3O)CCCC2)no1 ZINC000271891749 497481503 /nfs/dbraw/zinc/48/15/03/497481503.db2.gz SCSYNKLLBPOPKE-UHFFFAOYSA-N 2 2 358.486 3.485 20 10 FGCDLP CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)c(F)c1 ZINC000297710107 498544268 /nfs/dbraw/zinc/54/42/68/498544268.db2.gz MSIJAWJGSUJVTC-INIZCTEOSA-N 2 2 359.493 3.035 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1 ZINC000363176237 498688176 /nfs/dbraw/zinc/68/81/76/498688176.db2.gz GZDJDGMXUMPKLH-UWJYYQICSA-N 2 2 372.513 3.087 20 10 FGCDLP CCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cnn(C)c2)c(O)c1 ZINC000363176237 498688184 /nfs/dbraw/zinc/68/81/84/498688184.db2.gz GZDJDGMXUMPKLH-UWJYYQICSA-N 2 2 372.513 3.087 20 10 FGCDLP CC[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(Cl)c1O ZINC000287565254 498799069 /nfs/dbraw/zinc/79/90/69/498799069.db2.gz GKHTXANMUOKMPV-GOSISDBHSA-N 2 2 374.916 3.433 20 10 FGCDLP COC1CCN(c2ccc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)cc2)CC1 ZINC000294908633 498846324 /nfs/dbraw/zinc/84/63/24/498846324.db2.gz HPXYDLFPOCOBKE-UHFFFAOYSA-N 2 2 354.498 3.405 20 10 FGCDLP Cc1cn2c([nH+]1)CC[C@H]([NH2+][C@@H](C)c1cc(Br)cc(F)c1O)C2 ZINC000368314725 499284460 /nfs/dbraw/zinc/28/44/60/499284460.db2.gz FHTPCORHIPXQBW-JQWIXIFHSA-N 2 2 368.250 3.464 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469045 499331044 /nfs/dbraw/zinc/33/10/44/499331044.db2.gz CTZPHLVYDRRENI-FVQBIDKESA-N 2 2 359.297 3.383 20 10 FGCDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1cc(Cl)cc(Cl)c1O ZINC000371469045 499331045 /nfs/dbraw/zinc/33/10/45/499331045.db2.gz CTZPHLVYDRRENI-FVQBIDKESA-N 2 2 359.297 3.383 20 10 FGCDLP COc1ccc(O)c([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000373251110 499459753 /nfs/dbraw/zinc/45/97/53/499459753.db2.gz CNLKMVALEQUINJ-MRXNPFEDSA-N 2 2 355.482 3.154 20 10 FGCDLP C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774114579 723860677 /nfs/dbraw/zinc/86/06/77/723860677.db2.gz GNMDYLVAGFCNIA-GFCCVEGCSA-N 2 2 360.329 3.376 20 10 FGCDLP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815558942 727084010 /nfs/dbraw/zinc/08/40/10/727084010.db2.gz SDSDTHJNVIKDST-CQSZACIVSA-N 2 2 359.436 3.089 20 10 FGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Br)nc1 ZINC000817942073 727288859 /nfs/dbraw/zinc/28/88/59/727288859.db2.gz MDRRKEPELLCUSW-BLLLJJGKSA-N 2 2 363.303 3.261 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2c(C3CC3)nc3sccn23)cc1 ZINC000841045461 730205704 /nfs/dbraw/zinc/20/57/04/730205704.db2.gz LFWKEJXTDDRBKE-INIZCTEOSA-N 2 2 355.511 3.129 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(Br)c(F)c2)cc1 ZINC000841045735 730205998 /nfs/dbraw/zinc/20/59/98/730205998.db2.gz PBQQAXJGHZUVQO-KRWDZBQOSA-N 2 2 366.278 3.444 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1 ZINC000841046151 730206107 /nfs/dbraw/zinc/20/61/07/730206107.db2.gz XCPUDNGXDRJAOW-MRXNPFEDSA-N 2 2 353.388 3.283 20 10 FGCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3occc3Br)cc2)CC1 ZINC000883283476 737546749 /nfs/dbraw/zinc/54/67/49/737546749.db2.gz HEDKQUHUXYSZBJ-UHFFFAOYSA-N 2 2 364.287 3.084 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(Cl)ccc1O ZINC000186126712 495866299 /nfs/dbraw/zinc/86/62/99/495866299.db2.gz UFHASMNEOJYTKJ-IRWQIABSSA-N 2 2 352.906 3.464 20 10 FGCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1O ZINC000186566103 496048828 /nfs/dbraw/zinc/04/88/28/496048828.db2.gz VOFHZWWWJVSLMA-OLZOCXBDSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@@H]([NH2+]Cc1cccc(OCC[NH+]2CCOCC2)c1)c1ccc(F)cc1O ZINC000185147051 496680940 /nfs/dbraw/zinc/68/09/40/496680940.db2.gz AMNNCGDNSXIJRT-MRXNPFEDSA-N 2 2 374.456 3.093 20 10 FGCDLP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc([N+](=O)[O-])ccc1O ZINC000273387929 496791774 /nfs/dbraw/zinc/79/17/74/496791774.db2.gz KAESHYUUTQUEKN-AWEZNQCLSA-N 2 2 359.426 3.092 20 10 FGCDLP CCn1cc[nH+]c1CN1CCC[N@@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC000371415890 499323660 /nfs/dbraw/zinc/32/36/60/499323660.db2.gz DKCUUJJSCHBATF-UHFFFAOYSA-N 2 2 364.493 3.470 20 10 FGCDLP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000092665221 700439509 /nfs/dbraw/zinc/43/95/09/700439509.db2.gz OLFPFJREXSLKLW-HZPDHXFCSA-N 2 2 351.922 3.036 20 10 FGCDLP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000119660521 700635359 /nfs/dbraw/zinc/63/53/59/700635359.db2.gz BJSNHDMMGGOQMF-OAHLLOKOSA-N 2 2 363.933 3.454 20 10 FGCDLP C[NH+]1CCN([C@H](C[NH2+]Cc2c(O)cccc2Cl)c2cccs2)CC1 ZINC000733322894 722495676 /nfs/dbraw/zinc/49/56/76/722495676.db2.gz VAOGDSBCTKABKZ-MRXNPFEDSA-N 2 2 365.930 3.185 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)[C@H](C)C1 ZINC000756582424 722967180 /nfs/dbraw/zinc/96/71/80/722967180.db2.gz INUUUXAFIIXHFW-LBTNJELSSA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)[C@H](C)C1 ZINC000756582424 722967181 /nfs/dbraw/zinc/96/71/81/722967181.db2.gz INUUUXAFIIXHFW-LBTNJELSSA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)[C@@H](C)C1 ZINC000756582414 722967190 /nfs/dbraw/zinc/96/71/90/722967190.db2.gz INUUUXAFIIXHFW-DEYYWGMASA-N 2 2 356.457 3.458 20 10 FGCDLP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)[C@@H](C)C1 ZINC000756582414 722967191 /nfs/dbraw/zinc/96/71/91/722967191.db2.gz INUUUXAFIIXHFW-DEYYWGMASA-N 2 2 356.457 3.458 20 10 FGCDLP C[C@@H]1CCCN(c2ccc(C[NH2+]C[C@@H](O)C[N@H+](C)C3CC3)cc2Cl)C1 ZINC000819289604 727364740 /nfs/dbraw/zinc/36/47/40/727364740.db2.gz FTLFKGZOGVJGCV-CRAIPNDOSA-N 2 2 365.949 3.121 20 10 FGCDLP C[C@@H]1CCCN(c2ccc(C[NH2+]C[C@@H](O)C[N@@H+](C)C3CC3)cc2Cl)C1 ZINC000819289604 727364742 /nfs/dbraw/zinc/36/47/42/727364742.db2.gz FTLFKGZOGVJGCV-CRAIPNDOSA-N 2 2 365.949 3.121 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000826943741 729419665 /nfs/dbraw/zinc/41/96/65/729419665.db2.gz ZQJDGEHUSBJIRX-KRWDZBQOSA-N 2 2 364.848 3.041 20 10 FGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000826943741 729419670 /nfs/dbraw/zinc/41/96/70/729419670.db2.gz ZQJDGEHUSBJIRX-KRWDZBQOSA-N 2 2 364.848 3.041 20 10 FGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2csc(Br)c2)cc1 ZINC000841043972 730205776 /nfs/dbraw/zinc/20/57/76/730205776.db2.gz RYTDKKGUEUEDCN-AWEZNQCLSA-N 2 2 354.317 3.366 20 10 FGCDLP COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645481 732990106 /nfs/dbraw/zinc/99/01/06/732990106.db2.gz INOGEVDFLVHJCU-PWSUYJOCSA-N 2 2 352.784 3.013 20 10 FGCDLP COc1cc(Cl)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645481 732990110 /nfs/dbraw/zinc/99/01/10/732990110.db2.gz INOGEVDFLVHJCU-PWSUYJOCSA-N 2 2 352.784 3.013 20 10 FGCDLP COc1cc(O)c(C[NH2+]CCCc2[nH+]c3ccccc3n2C)cc1OC ZINC000181346757 496362102 /nfs/dbraw/zinc/36/21/02/496362102.db2.gz PQAFGXKDRJJVEA-UHFFFAOYSA-N 2 2 355.438 3.019 20 10 FGCDLP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+]2CCOCC2)c(O)c1 ZINC000185197883 496700498 /nfs/dbraw/zinc/70/04/98/496700498.db2.gz GWDLIMGHSFIGJD-SFHVURJKSA-N 2 2 370.493 3.262 20 10 FGCDLP Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cnn(C)c2)c1O ZINC000368402225 499292400 /nfs/dbraw/zinc/29/24/00/499292400.db2.gz JODBLJQYFGAUJG-KDOFPFPSSA-N 2 2 362.905 3.260 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@H+](C[C@H]2CCCO2)C[C@H]1C)c1ccc(F)cc1O ZINC000375800912 499557112 /nfs/dbraw/zinc/55/71/12/499557112.db2.gz FTQRCWBEYZUVIF-SKWUIDRYSA-N 2 2 350.478 3.461 20 10 FGCDLP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C[C@H]2CCCO2)C[C@H]1C)c1ccc(F)cc1O ZINC000375800912 499557113 /nfs/dbraw/zinc/55/71/13/499557113.db2.gz FTQRCWBEYZUVIF-SKWUIDRYSA-N 2 2 350.478 3.461 20 10 FGCDLP CC[C@@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc(Br)ccc1O ZINC000377757153 499729306 /nfs/dbraw/zinc/72/93/06/499729306.db2.gz UHUOUBKDTVZDTL-DGCLKSJQSA-N 2 2 350.260 3.476 20 10 FGCDLP CC[C@@H]([NH2+][C@@H]1CCc2[nH]c[nH+]c2C1)c1cc(Br)ccc1O ZINC000377757153 499729307 /nfs/dbraw/zinc/72/93/07/499729307.db2.gz UHUOUBKDTVZDTL-DGCLKSJQSA-N 2 2 350.260 3.476 20 10 FGCDLP C[C@@H]1CC[C@@H](C)[NH+]1CCN1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000123044669 700699439 /nfs/dbraw/zinc/69/94/39/700699439.db2.gz WLSSZVHJOIBPHG-HZPDHXFCSA-N 2 2 351.922 3.036 20 10 FGCDLP Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000779060076 724385701 /nfs/dbraw/zinc/38/57/01/724385701.db2.gz CWHNGADHQAQQDV-AAEUAGOBSA-N 2 2 350.260 3.325 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H](c1cccs1)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000756341196 722963080 /nfs/dbraw/zinc/96/30/80/722963080.db2.gz ICEZVLLLOLKFTO-PBHICJAKSA-N 2 2 363.502 3.232 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217030 725297620 /nfs/dbraw/zinc/29/76/20/725297620.db2.gz VDZHJAMPVQCKSZ-YCPHGPKFSA-N 2 2 358.404 3.315 20 10 FGCDLP CC[C@H]([NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1O ZINC000810217030 725297622 /nfs/dbraw/zinc/29/76/22/725297622.db2.gz VDZHJAMPVQCKSZ-YCPHGPKFSA-N 2 2 358.404 3.315 20 10 FGCDLP C[C@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 ZINC000817931305 727288436 /nfs/dbraw/zinc/28/84/36/727288436.db2.gz QLHHPAOOTQHRJJ-NUJGCVRESA-N 2 2 365.949 3.433 20 10 FGCDLP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(Br)c(F)cc1O ZINC000817987846 727290725 /nfs/dbraw/zinc/29/07/25/727290725.db2.gz YUBSVTJOJBIEMO-NNYUYHANSA-N 2 2 357.267 3.333 20 10 FGCDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(Br)cc2O)C1 ZINC000824894808 729363998 /nfs/dbraw/zinc/36/39/98/729363998.db2.gz KFZVBBREKIXFEH-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(Br)cc2O)C1 ZINC000824894808 729364001 /nfs/dbraw/zinc/36/40/01/729364001.db2.gz KFZVBBREKIXFEH-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000824894808 729364002 /nfs/dbraw/zinc/36/40/02/729364002.db2.gz KFZVBBREKIXFEH-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000824894808 729364004 /nfs/dbraw/zinc/36/40/04/729364004.db2.gz KFZVBBREKIXFEH-CQSZACIVSA-N 2 2 353.304 3.318 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2csc(Br)c2)cc1 ZINC000841043973 730205590 /nfs/dbraw/zinc/20/55/90/730205590.db2.gz RYTDKKGUEUEDCN-CQSZACIVSA-N 2 2 354.317 3.366 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)c1ccc(Br)cc1O ZINC000850557065 731372701 /nfs/dbraw/zinc/37/27/01/731372701.db2.gz KPJQNZYIISRDQT-WFASDCNBSA-N 2 2 369.303 3.059 20 10 FGCDLP COc1c(O)c(C[N@@H+]2CCC[C@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000365826981 498656771 /nfs/dbraw/zinc/65/67/71/498656771.db2.gz RFBBHAPAGZBMDJ-HNNXBMFYSA-N 2 2 374.441 3.294 20 10 FGCDLP COc1c(O)c(C[N@H+]2CCC[C@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000365826981 498656776 /nfs/dbraw/zinc/65/67/76/498656776.db2.gz RFBBHAPAGZBMDJ-HNNXBMFYSA-N 2 2 374.441 3.294 20 10 FGCDLP C[C@H]([NH2+]CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)c1cc(F)ccc1O ZINC000368221040 499275458 /nfs/dbraw/zinc/27/54/58/499275458.db2.gz GVICIHFXYNDPSQ-INIZCTEOSA-N 3 2 363.521 3.378 20 10 FGCDLP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)cc(F)c1O ZINC000756765049 722969776 /nfs/dbraw/zinc/96/97/76/722969776.db2.gz NDAGJCPZXXFPRK-IGNZVWTISA-N 2 2 354.441 3.089 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403279 722964044 /nfs/dbraw/zinc/96/40/44/722964044.db2.gz XNXLXQONHUKQFG-MNOVXSKESA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Br)c(F)cc1O ZINC000756403279 722964045 /nfs/dbraw/zinc/96/40/45/722964045.db2.gz XNXLXQONHUKQFG-MNOVXSKESA-N 2 2 357.267 3.429 20 10 FGCDLP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc(F)cc(F)c1O ZINC000756433895 722964526 /nfs/dbraw/zinc/96/45/26/722964526.db2.gz ZWRYIXBIXSRTDQ-ZDUSSCGKSA-N 2 2 350.409 3.462 20 10 FGCDLP C[NH+](C)[C@H]1CCN(c2ccc(NCc3c(O)ccc(Cl)c3F)[nH+]c2)C1 ZINC000790240912 723116165 /nfs/dbraw/zinc/11/61/65/723116165.db2.gz NFMQKNOOOWQNRC-ZDUSSCGKSA-N 2 2 364.852 3.332 20 10 FGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cn(C)nc2-c2cccs2)cc1 ZINC000841045164 730205690 /nfs/dbraw/zinc/20/56/90/730205690.db2.gz JAAZGKONPYJUFN-QGZVFWFLSA-N 2 2 355.511 3.004 20 10 FGCDLP COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645482 732990011 /nfs/dbraw/zinc/99/00/11/732990011.db2.gz INOGEVDFLVHJCU-ZYHUDNBSSA-N 2 2 352.784 3.013 20 10 FGCDLP COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C2)c1O ZINC000863645482 732990014 /nfs/dbraw/zinc/99/00/14/732990014.db2.gz INOGEVDFLVHJCU-ZYHUDNBSSA-N 2 2 352.784 3.013 20 10 FGCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cc(Br)cc(F)c1O ZINC000925785627 759537528 /nfs/dbraw/zinc/53/75/28/759537528.db2.gz VCCAMOLJRWWJPK-RKDXNWHRSA-N 2 2 367.209 3.189 20 10 FGCDLP Oc1ccccc1C[N@@H+](Cc1ccc(-n2cc[nH+]c2)nc1)C[C@@H]1CCCO1 ZINC000177153360 495950954 /nfs/dbraw/zinc/95/09/54/495950954.db2.gz RSLWXQOLNQOHEU-IBGZPJMESA-N 2 2 364.449 3.154 20 10 FGCDLP Oc1ccccc1C[N@H+](Cc1ccc(-n2cc[nH+]c2)nc1)C[C@@H]1CCCO1 ZINC000177153360 495950958 /nfs/dbraw/zinc/95/09/58/495950958.db2.gz RSLWXQOLNQOHEU-IBGZPJMESA-N 2 2 364.449 3.154 20 10 FGCDLP C[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N2CCOCC2)c(F)c1 ZINC000152756147 496247791 /nfs/dbraw/zinc/24/77/91/496247791.db2.gz XFDCSFYFTFVQHP-INIZCTEOSA-N 2 2 372.488 3.088 20 10 FGCDLP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Cl)c(Cl)c1O ZINC000184983551 496610879 /nfs/dbraw/zinc/61/08/79/496610879.db2.gz VNMAWJHXQBUUKY-LBPRGKRZSA-N 2 2 360.329 3.376 20 10 FGCDLP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000185165704 496688550 /nfs/dbraw/zinc/68/85/50/496688550.db2.gz SYVRLCJWYYKPJE-AWEZNQCLSA-N 2 2 360.889 3.043 20 10 FGCDLP C[NH+](C)C1CCN(c2ccc(N[C@H]3CCc4cccc(O)c43)[nH+]c2)CC1 ZINC000297086111 498319034 /nfs/dbraw/zinc/31/90/34/498319034.db2.gz XAKZIESDLUBEOZ-SFHVURJKSA-N 2 2 352.482 3.417 20 10 FGCDLP COc1c(O)c(C[NH2+]C[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000365828040 498658525 /nfs/dbraw/zinc/65/85/25/498658525.db2.gz TZTNSNKGCOFWSM-QAPCUYQASA-N 2 2 371.437 3.092 20 10 FGCDLP Cn1cc([C@@H]2[C@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@@H+]2C)cn1 ZINC000372976222 499445515 /nfs/dbraw/zinc/44/55/15/499445515.db2.gz IZDWBVAWKJFYSX-SGTLLEGYSA-N 2 2 366.868 3.091 20 10 FGCDLP Cn1cc([C@@H]2[C@H](C[NH2+]Cc3c(O)ccc(Cl)c3F)CCC[N@H+]2C)cn1 ZINC000372976222 499445516 /nfs/dbraw/zinc/44/55/16/499445516.db2.gz IZDWBVAWKJFYSX-SGTLLEGYSA-N 2 2 366.868 3.091 20 10 FGCDLP C[C@H]([NH2+]C[C@H]1CCCn2cc[nH+]c21)c1ccc(N2CCC(O)CC2)cc1 ZINC000375877106 499564096 /nfs/dbraw/zinc/56/40/96/499564096.db2.gz WXDMSDIYXNHBEI-FUHWJXTLSA-N 2 2 354.498 3.072 20 10 FGCDLP C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024985 499655185 /nfs/dbraw/zinc/65/51/85/499655185.db2.gz NCZDAPLJQPCJON-XJKCOSOUSA-N 2 2 356.869 3.164 20 10 FGCDLP C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000377024985 499655186 /nfs/dbraw/zinc/65/51/86/499655186.db2.gz NCZDAPLJQPCJON-XJKCOSOUSA-N 2 2 356.869 3.164 20 10 FGCDLP