smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC(CC)[N@@H+](CCOC)Cc1c(O)cccc1Cl ZINC000133490012 1125462359 /nfs/dbraw/zinc/46/23/59/1125462359.db2.gz MSVZYVRDGQSHOX-UHFFFAOYSA-N 1 1 285.815 3.683 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)C1CCC1)c1ccc(F)cc1O ZINC000796845607 1119211522 /nfs/dbraw/zinc/21/15/22/1119211522.db2.gz BRYKVRFEHADYPX-YGRLFVJLSA-N 1 1 251.345 3.761 20 10 CHCDMO CC[C@]1(C)CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000758394913 1121721060 /nfs/dbraw/zinc/72/10/60/1121721060.db2.gz GVNBDGHOXMJQNY-QGZVFWFLSA-N 1 1 259.393 3.503 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccccc1O ZINC000109772632 1123326755 /nfs/dbraw/zinc/32/67/55/1123326755.db2.gz NLCDVRYXAOQRKX-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO CC[C@H]([NH2+]CCC(C)(C)COC)c1ccc(F)cc1O ZINC000872104606 1124683125 /nfs/dbraw/zinc/68/31/25/1124683125.db2.gz KZLRUZWZEBEAIL-AWEZNQCLSA-N 1 1 283.387 3.635 20 10 CHCDMO Cc1cc(C[N@H+]2Cc3cccc(O)c3C2)c(C)s1 ZINC000877703159 1125066363 /nfs/dbraw/zinc/06/63/63/1125066363.db2.gz UCKRQSLSLVUBEY-UHFFFAOYSA-N 1 1 259.374 3.586 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140465891 1131750257 /nfs/dbraw/zinc/75/02/57/1131750257.db2.gz UGJQDKGTZFFTBX-CYBMUJFWSA-N 1 1 253.773 3.810 20 10 CHCDMO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C1CCC1 ZINC000835024797 1131759411 /nfs/dbraw/zinc/75/94/11/1131759411.db2.gz BTGPFUJFZBGVEJ-SREVYHEPSA-N 1 1 258.409 3.640 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1Cl ZINC001231871111 1132385097 /nfs/dbraw/zinc/38/50/97/1132385097.db2.gz YKNOIQRRYBBWSE-JQWIXIFHSA-N 1 1 267.800 3.974 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000841754623 1132391984 /nfs/dbraw/zinc/39/19/84/1132391984.db2.gz UDKDOMDXEKEIRR-YPMHNXCESA-N 1 1 283.799 3.655 20 10 CHCDMO CS[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840117661 1132485763 /nfs/dbraw/zinc/48/57/63/1132485763.db2.gz WCEMGJJYTRDPJN-AWEZNQCLSA-N 1 1 279.449 3.761 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1ccc(C(F)(F)F)cc1O ZINC001233455110 1132624675 /nfs/dbraw/zinc/62/46/75/1132624675.db2.gz WWEWPGSANQFWSR-UHFFFAOYSA-N 1 1 273.298 3.643 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233755553 1132674647 /nfs/dbraw/zinc/67/46/47/1132674647.db2.gz VYQSBNBVVVZEPS-UHFFFAOYSA-N 1 1 289.297 3.523 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CC2(C)C)c1O ZINC001206809789 1133750646 /nfs/dbraw/zinc/75/06/46/1133750646.db2.gz MFAJTXYPYVOGEI-NSHDSACASA-N 1 1 283.799 3.532 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(Cl)ccc1O ZINC000136819776 1125647924 /nfs/dbraw/zinc/64/79/24/1125647924.db2.gz ANPCJPKVEYGTCG-GWCFXTLKSA-N 1 1 253.773 3.809 20 10 CHCDMO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2c(O)cccc2F)s1 ZINC000886589837 1125694167 /nfs/dbraw/zinc/69/41/67/1125694167.db2.gz HGYNBFCVIIPRSR-KOLCDFICSA-N 1 1 294.395 3.751 20 10 CHCDMO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1c(O)cccc1F ZINC000886619161 1125699867 /nfs/dbraw/zinc/69/98/67/1125699867.db2.gz VGXNAVZDGBQMTC-PELKAZGASA-N 1 1 292.181 3.766 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1c(O)cccc1F ZINC000886634536 1125700390 /nfs/dbraw/zinc/70/03/90/1125700390.db2.gz GRSMLNJPAWNUGN-CHWSQXEVSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCCO1)c1c(O)cccc1F ZINC000886632929 1125700898 /nfs/dbraw/zinc/70/08/98/1125700898.db2.gz JSCBKMUTQRQZAW-XNJJOIOASA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)s1 ZINC000886645390 1125701987 /nfs/dbraw/zinc/70/19/87/1125701987.db2.gz XYGNABXSFYEDBZ-IUCAKERBSA-N 1 1 280.368 3.708 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C(C1CC1)C1CC1 ZINC000092704033 1129405034 /nfs/dbraw/zinc/40/50/34/1129405034.db2.gz RMPWLFLRKVSRSE-UHFFFAOYSA-N 1 1 265.784 3.666 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)C(C1CC1)C1CC1 ZINC000092704033 1129405036 /nfs/dbraw/zinc/40/50/36/1129405036.db2.gz RMPWLFLRKVSRSE-UHFFFAOYSA-N 1 1 265.784 3.666 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC[C@H]2CC)c(O)c1 ZINC000768138525 1129835951 /nfs/dbraw/zinc/83/59/51/1129835951.db2.gz NRUPOFBQFSLZQR-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO CC(C)[N@@H+](Cc1cc2c(cc1O)CCCC2)C1CC1 ZINC000768440017 1129855957 /nfs/dbraw/zinc/85/59/57/1129855957.db2.gz CDHGDOSAGUXGML-UHFFFAOYSA-N 1 1 259.393 3.644 20 10 CHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccccc1O)CCC2 ZINC000179574680 1126830538 /nfs/dbraw/zinc/83/05/38/1126830538.db2.gz WRSRCOMWIWJMIS-CQSZACIVSA-N 1 1 288.416 3.667 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1cocn1)C1CCCCC1 ZINC000191919469 1126957071 /nfs/dbraw/zinc/95/70/71/1126957071.db2.gz BFLNKEUYKROGNT-UHFFFAOYSA-N 1 1 286.375 3.715 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCO1)c1cc(Cl)c(Cl)cc1O ZINC000192595940 1126962286 /nfs/dbraw/zinc/96/22/86/1126962286.db2.gz IBOZEQYSQTYRML-DTWKUNHWSA-N 1 1 290.190 3.529 20 10 CHCDMO C[C@H]([NH2+]C1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000192702003 1126963273 /nfs/dbraw/zinc/96/32/73/1126963273.db2.gz APGIYNPINRJDGS-QMMMGPOBSA-N 1 1 290.190 3.529 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCCC[C@H](F)C2)c(O)c1 ZINC001237045001 1131041838 /nfs/dbraw/zinc/04/18/38/1131041838.db2.gz GZIPMQKDAIMAPE-HNNXBMFYSA-N 1 1 265.372 3.840 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCC2(CC2)C1 ZINC001237078335 1131046326 /nfs/dbraw/zinc/04/63/26/1131046326.db2.gz PVIGJVRDJXLHNO-UHFFFAOYSA-N 1 1 272.175 3.685 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCC2(CC2)C1 ZINC001237078335 1131046331 /nfs/dbraw/zinc/04/63/31/1131046331.db2.gz PVIGJVRDJXLHNO-UHFFFAOYSA-N 1 1 272.175 3.685 20 10 CHCDMO C[N@H+](Cc1cccs1)Cc1cc(Cl)c(F)cc1O ZINC000816480919 1131098105 /nfs/dbraw/zinc/09/81/05/1131098105.db2.gz BKLOJYDRARLOEU-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1cc(Cl)c(F)cc1O ZINC000816480919 1131098111 /nfs/dbraw/zinc/09/81/11/1131098111.db2.gz BKLOJYDRARLOEU-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO COc1cc(C[N@@H+](C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC000164411484 1127164464 /nfs/dbraw/zinc/16/44/64/1127164464.db2.gz BVLQAPLQEALHQF-UHFFFAOYSA-N 1 1 277.408 3.683 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC000816647951 1131120416 /nfs/dbraw/zinc/12/04/16/1131120416.db2.gz BEFTYIXJOBLPFP-MNOVXSKESA-N 1 1 286.341 3.612 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(F)cc1O ZINC000285519489 1127234595 /nfs/dbraw/zinc/23/45/95/1127234595.db2.gz DXEHUFSRQBXGIT-XHDPSFHLSA-N 1 1 274.339 3.728 20 10 CHCDMO CC[C@@H]([NH2+]CC(C)(C)CCOC)c1ccc(F)cc1O ZINC000285944198 1127247822 /nfs/dbraw/zinc/24/78/22/1127247822.db2.gz DOQJJJNKUVULEL-CQSZACIVSA-N 1 1 283.387 3.635 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(F)cc1O ZINC000286109866 1127258401 /nfs/dbraw/zinc/25/84/01/1127258401.db2.gz NPKCQISKASSRGF-CYBMUJFWSA-N 1 1 294.757 3.821 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccccc2)cc1C ZINC000058583696 1127361233 /nfs/dbraw/zinc/36/12/33/1127361233.db2.gz VXFSVSDNYYBJHU-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC(C)(C)OC[C@@H]2C)c1 ZINC001308738702 1127452745 /nfs/dbraw/zinc/45/27/45/1127452745.db2.gz BOCLBXYTWGAJIG-ZDUSSCGKSA-N 1 1 277.408 3.515 20 10 CHCDMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(F)cc2O)o1 ZINC000293644592 1127510120 /nfs/dbraw/zinc/51/01/20/1127510120.db2.gz LAAVSHYBNSDEEL-JTQLQIEISA-N 1 1 292.354 3.631 20 10 CHCDMO C[C@@H](c1cccnc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293748644 1127517485 /nfs/dbraw/zinc/51/74/85/1127517485.db2.gz XWASRFMNVJXZFL-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293748644 1127517488 /nfs/dbraw/zinc/51/74/88/1127517488.db2.gz XWASRFMNVJXZFL-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO Cc1cc(C[N@@H+](Cc2cccnc2)C2CC2)ccc1N(C)C ZINC000293806894 1127522440 /nfs/dbraw/zinc/52/24/40/1127522440.db2.gz NVAQWJYMTUGVRS-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C)C[C@@H]2C)cc1Cl ZINC001231870792 1127544504 /nfs/dbraw/zinc/54/45/04/1127544504.db2.gz UFQOUVPCTDFWLR-JQWIXIFHSA-N 1 1 267.800 3.974 20 10 CHCDMO CCC(C)(C)[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228663100 1127580957 /nfs/dbraw/zinc/58/09/57/1127580957.db2.gz MIAOUFQOFLEYQS-UHFFFAOYSA-N 1 1 271.788 3.675 20 10 CHCDMO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1ccccc1O ZINC000295021436 1127614261 /nfs/dbraw/zinc/61/42/61/1127614261.db2.gz CHCXHIZSFFOLDW-LOWVWBTDSA-N 1 1 287.325 3.944 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)CC1CC(F)(F)C1 ZINC000295074128 1127618637 /nfs/dbraw/zinc/61/86/37/1127618637.db2.gz QOIWXJWKBADKFH-UHFFFAOYSA-N 1 1 269.335 3.650 20 10 CHCDMO Cc1cccnc1CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000296603993 1127677827 /nfs/dbraw/zinc/67/78/27/1127677827.db2.gz VVEICMVJQPVDSP-ZDUSSCGKSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(F)cc1O ZINC000297394019 1127695739 /nfs/dbraw/zinc/69/57/39/1127695739.db2.gz RZOKPPVYHAWOKN-LBPRGKRZSA-N 1 1 288.366 3.555 20 10 CHCDMO CC(C)C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000171922802 1127734573 /nfs/dbraw/zinc/73/45/73/1127734573.db2.gz IDJVYCFLIBQLBH-UHFFFAOYSA-N 1 1 259.349 3.643 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000366942935 1127748665 /nfs/dbraw/zinc/74/86/65/1127748665.db2.gz IYEIGXFVLKTZKP-IBGZPJMESA-N 1 1 297.398 3.548 20 10 CHCDMO Cc1cc(C[N@H+]2CCCO[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000172495072 1127766605 /nfs/dbraw/zinc/76/66/05/1127766605.db2.gz KZJXITJJMPPRTD-CQSZACIVSA-N 1 1 291.435 3.609 20 10 CHCDMO C[C@H]([NH2+]CCCc1ccccc1)c1ccc(F)cc1O ZINC000062744996 1127772276 /nfs/dbraw/zinc/77/22/76/1127772276.db2.gz QLMUCEYOAJXSQG-ZDUSSCGKSA-N 1 1 273.351 3.815 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062745071 1127772332 /nfs/dbraw/zinc/77/23/32/1127772332.db2.gz LMEBTNSMXXWCGZ-OLZOCXBDSA-N 1 1 273.351 3.986 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@@H]3C)c2c1 ZINC000173528259 1127837511 /nfs/dbraw/zinc/83/75/11/1127837511.db2.gz JVUBXBASRXJYBX-LBPRGKRZSA-N 1 1 271.360 3.538 20 10 CHCDMO Oc1cccc(Cl)c1CNc1[nH]c2ccc(F)cc2[nH+]1 ZINC000784326716 1128042866 /nfs/dbraw/zinc/04/28/66/1128042866.db2.gz UUGSDGAZXIHWSN-UHFFFAOYSA-N 1 1 291.713 3.673 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2ncccn2)cc1 ZINC000929185769 1128263249 /nfs/dbraw/zinc/26/32/49/1128263249.db2.gz ZAXRACVUYLZIKI-HNNXBMFYSA-N 1 1 298.434 3.516 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)c2ncccn2)cc1 ZINC000929185769 1128263252 /nfs/dbraw/zinc/26/32/52/1128263252.db2.gz ZAXRACVUYLZIKI-HNNXBMFYSA-N 1 1 298.434 3.516 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2cc(C)ccc2C)c1O ZINC000762068432 1128266009 /nfs/dbraw/zinc/26/60/09/1128266009.db2.gz OAFGZBIROLBSAG-UHFFFAOYSA-N 1 1 299.414 3.958 20 10 CHCDMO CC(C)[C@H](C)[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000915209852 1128292016 /nfs/dbraw/zinc/29/20/16/1128292016.db2.gz VFFLTJFPZRORLD-LBPRGKRZSA-N 1 1 279.424 3.872 20 10 CHCDMO CCC[N@@H+](Cc1ccc(Cl)cn1)Cc1ccccc1O ZINC000778220963 1128451107 /nfs/dbraw/zinc/45/11/07/1128451107.db2.gz OFGYVNRKDXYAMP-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO Cc1cc(O)c(C[N@H+](Cc2ccccn2)C(C)C)cc1C ZINC000917483617 1128501140 /nfs/dbraw/zinc/50/11/40/1128501140.db2.gz VSROMBRIHZHEEA-UHFFFAOYSA-N 1 1 284.403 3.815 20 10 CHCDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585507 1128568876 /nfs/dbraw/zinc/56/88/76/1128568876.db2.gz GOYDXGNFMNBJGY-AUUYWEPGSA-N 1 1 296.414 3.953 20 10 CHCDMO C[N@@H+](Cc1c2c(ccc1O)oc1c2CCCC1)CC1CC1 ZINC000919941937 1128652792 /nfs/dbraw/zinc/65/27/92/1128652792.db2.gz GRMMEDMRTBFHJU-UHFFFAOYSA-N 1 1 285.387 3.859 20 10 CHCDMO C[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)CC1CC1 ZINC000919941937 1128652794 /nfs/dbraw/zinc/65/27/94/1128652794.db2.gz GRMMEDMRTBFHJU-UHFFFAOYSA-N 1 1 285.387 3.859 20 10 CHCDMO CC[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccccc1O ZINC000158112863 1128664177 /nfs/dbraw/zinc/66/41/77/1128664177.db2.gz JFECLRKVTSLRNK-INIZCTEOSA-N 1 1 290.451 3.555 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000778994782 1128674713 /nfs/dbraw/zinc/67/47/13/1128674713.db2.gz LCTIYQQKNCGNQM-KRWDZBQOSA-N 1 1 285.362 3.738 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000778996984 1128675694 /nfs/dbraw/zinc/67/56/94/1128675694.db2.gz YGFULWCOZSSSEY-CQSZACIVSA-N 1 1 277.364 3.930 20 10 CHCDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1ccccc1O ZINC000779023637 1128685901 /nfs/dbraw/zinc/68/59/01/1128685901.db2.gz VBNDPCGKZVPGRG-RDJZCZTQSA-N 1 1 281.399 3.845 20 10 CHCDMO C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)c1ccc(F)cc1O ZINC000324775592 1128708883 /nfs/dbraw/zinc/70/88/83/1128708883.db2.gz FCAQGBLUMIHYER-MGPLVRAMSA-N 1 1 263.356 3.761 20 10 CHCDMO Cc1cccc([C@@H](C)[N@@H+](C)Cc2ccccc2O)c1 ZINC000072629619 1117782253 /nfs/dbraw/zinc/78/22/53/1117782253.db2.gz UMHSCKGLBIKFBV-CQSZACIVSA-N 1 1 255.361 3.894 20 10 CHCDMO Cc1ccc([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)c(O)c1 ZINC000185471993 1117828705 /nfs/dbraw/zinc/82/87/05/1117828705.db2.gz SVJLIERDAQNINP-YOEHRIQHSA-N 1 1 292.467 3.718 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCC1)CCC2 ZINC000728198738 1117870060 /nfs/dbraw/zinc/87/00/60/1117870060.db2.gz FHAHQDVLZRXTGS-QGZVFWFLSA-N 1 1 271.404 3.645 20 10 CHCDMO Oc1ccccc1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000179554512 1128747985 /nfs/dbraw/zinc/74/79/85/1128747985.db2.gz PLYBUXNUXIHSLY-UHFFFAOYSA-N 1 1 283.346 3.821 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(Cl)s1)CC2 ZINC001204443229 1118061965 /nfs/dbraw/zinc/06/19/65/1118061965.db2.gz VCISKEJAWUTVHK-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000179662996 1128754240 /nfs/dbraw/zinc/75/42/40/1128754240.db2.gz DMKVACPBZGFLRY-UHFFFAOYSA-N 1 1 283.371 3.565 20 10 CHCDMO CC[C@H](NCCC[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000764434039 1118091394 /nfs/dbraw/zinc/09/13/94/1118091394.db2.gz UGSOGNORDNTCIE-SFHVURJKSA-N 1 1 291.483 3.525 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NCCC[N@H+](C)C(C)C)cc1 ZINC000764806154 1118116645 /nfs/dbraw/zinc/11/66/45/1118116645.db2.gz KASAHCINFVLCOV-INIZCTEOSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NCCC[N@@H+](C)C(C)C)cc1 ZINC000764806154 1118116649 /nfs/dbraw/zinc/11/66/49/1118116649.db2.gz KASAHCINFVLCOV-INIZCTEOSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@@H](C)c1cccc(O)c1 ZINC000179770724 1128758333 /nfs/dbraw/zinc/75/83/33/1128758333.db2.gz SHEYTSOXCXPKRP-AWEZNQCLSA-N 1 1 285.387 3.989 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1c(C)noc1C ZINC000186186877 1118291422 /nfs/dbraw/zinc/29/14/22/1118291422.db2.gz UWBKAWCRPHGNTB-OTYXRUKQSA-N 1 1 292.354 3.938 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1c(C)noc1C ZINC000186186892 1118291869 /nfs/dbraw/zinc/29/18/69/1118291869.db2.gz UWBKAWCRPHGNTB-YMTOWFKASA-N 1 1 292.354 3.938 20 10 CHCDMO Cc1cc(C)cc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000693216991 1118421833 /nfs/dbraw/zinc/42/18/33/1118421833.db2.gz XGXZSHWRYUUSQV-CYBMUJFWSA-N 1 1 273.351 3.999 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2cccc(F)c2)c1O ZINC000160462794 1118428240 /nfs/dbraw/zinc/42/82/40/1118428240.db2.gz BGETWHPNGKRVAM-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)c1O ZINC000088706267 1118524605 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COc1cccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000131996848 1118787270 /nfs/dbraw/zinc/78/72/70/1118787270.db2.gz DLCXNBXZOKFSJD-MRXNPFEDSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1ccc(NCc2ccc(N3CCCCC3)cc2)[nH+]c1 ZINC000121604801 1118809855 /nfs/dbraw/zinc/80/98/55/1118809855.db2.gz MAKLHQIFHWDPDF-UHFFFAOYSA-N 1 1 281.403 3.992 20 10 CHCDMO CC(C)(C)C[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708424110 1119450559 /nfs/dbraw/zinc/45/05/59/1119450559.db2.gz WUASTDNOGNCRAC-LLVKDONJSA-N 1 1 283.362 3.929 20 10 CHCDMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708424110 1119450561 /nfs/dbraw/zinc/45/05/61/1119450561.db2.gz WUASTDNOGNCRAC-LLVKDONJSA-N 1 1 283.362 3.929 20 10 CHCDMO C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)cc(F)c2O)C[C@@H]1C ZINC000708498055 1119491197 /nfs/dbraw/zinc/49/11/97/1119491197.db2.gz WUNLZKMDWOFPKD-NRUUGDAUSA-N 1 1 269.335 3.585 20 10 CHCDMO CC[C@@H]([NH2+]CC(C)(C)[C@@H](O)C(C)C)c1ccc(F)cc1O ZINC000796850388 1119644439 /nfs/dbraw/zinc/64/44/39/1119644439.db2.gz ZEEDKAZGIUZYBD-ZBFHGGJFSA-N 1 1 297.414 3.615 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(C)cc2)c1O ZINC000179602121 1119752759 /nfs/dbraw/zinc/75/27/59/1119752759.db2.gz PEEAQGSWWQQTSK-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc(OCC)c1O ZINC000311996825 1120210710 /nfs/dbraw/zinc/21/07/10/1120210710.db2.gz QXDYEXSGASYBRF-CYBMUJFWSA-N 1 1 265.397 3.801 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC3(CC3)C2)c1O ZINC001143103503 1120347665 /nfs/dbraw/zinc/34/76/65/1120347665.db2.gz DUUHWSJFIQGADF-UHFFFAOYSA-N 1 1 259.393 3.676 20 10 CHCDMO C[C@H]([NH2+]CCO[C@@H]1CCCC[C@@H]1C)c1ccc(F)cc1O ZINC000756443667 1120350559 /nfs/dbraw/zinc/35/05/59/1120350559.db2.gz TZXQCIPKWJCUDK-GDZNZVCISA-N 1 1 295.398 3.777 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C#N)cc1C)Cc1ccccc1O ZINC000186246011 1120393954 /nfs/dbraw/zinc/39/39/54/1120393954.db2.gz SDZNQZRZFKCRHR-UHFFFAOYSA-N 1 1 294.398 3.985 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+]2C[C@H](C)[C@H](C)C2)c1 ZINC000781908467 1120511058 /nfs/dbraw/zinc/51/10/58/1120511058.db2.gz IYQLNNBFTQMWHQ-PHIMTYICSA-N 1 1 298.224 3.551 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H](C)[C@H](C)C2)c1 ZINC000781908467 1120511061 /nfs/dbraw/zinc/51/10/61/1120511061.db2.gz IYQLNNBFTQMWHQ-PHIMTYICSA-N 1 1 298.224 3.551 20 10 CHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccccc1O ZINC000191189318 1120517474 /nfs/dbraw/zinc/51/74/74/1120517474.db2.gz NMCOEMHLTVLQBV-UHFFFAOYSA-N 1 1 280.371 3.896 20 10 CHCDMO C[C@H](CCC1CC1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000398090078 1120566721 /nfs/dbraw/zinc/56/67/21/1120566721.db2.gz RNNUYMFNIGFUSL-GHMZBOCLSA-N 1 1 251.345 3.761 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(F)cc1O ZINC000195147322 1120615655 /nfs/dbraw/zinc/61/56/55/1120615655.db2.gz JHOJOBOBACFKTL-LBPRGKRZSA-N 1 1 296.345 3.930 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168739271 1120651933 /nfs/dbraw/zinc/65/19/33/1120651933.db2.gz NMQCZCJLPGDKHX-CQSZACIVSA-N 1 1 287.790 3.645 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](C)C1CC1)c1ccc(F)cc1O ZINC000796722052 1120674491 /nfs/dbraw/zinc/67/44/91/1120674491.db2.gz YQOVJYFESUCGMM-IINYFYTJSA-N 1 1 251.345 3.618 20 10 CHCDMO COc1cccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC000093383563 1120796836 /nfs/dbraw/zinc/79/68/36/1120796836.db2.gz GHZOTOPTAGAWBR-IPYPFGDCSA-N 1 1 275.392 3.554 20 10 CHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3ccccc3O)CCO2)cc1 ZINC000191665414 1128950252 /nfs/dbraw/zinc/95/02/52/1128950252.db2.gz YNYLWWBSHCNXRL-IBGZPJMESA-N 1 1 297.398 3.528 20 10 CHCDMO CCC[N@H+](CCOC)Cc1c(O)ccc(Cl)c1Cl ZINC001237077795 1128964479 /nfs/dbraw/zinc/96/44/79/1128964479.db2.gz KHXBKTYMJMLUBP-UHFFFAOYSA-N 1 1 292.206 3.557 20 10 CHCDMO CCC[N@@H+](CCOC)Cc1c(O)ccc(Cl)c1Cl ZINC001237077795 1128964482 /nfs/dbraw/zinc/96/44/82/1128964482.db2.gz KHXBKTYMJMLUBP-UHFFFAOYSA-N 1 1 292.206 3.557 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000708408979 1121464151 /nfs/dbraw/zinc/46/41/51/1121464151.db2.gz KDHQXAWNMQDEBY-CYBMUJFWSA-N 1 1 295.354 3.899 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](C(C)(C)C)C2)c1 ZINC000708454217 1121464891 /nfs/dbraw/zinc/46/48/91/1121464891.db2.gz NCRVNHQZFBMRLF-CQSZACIVSA-N 1 1 277.408 3.659 20 10 CHCDMO CCc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000709328238 1121470493 /nfs/dbraw/zinc/47/04/93/1121470493.db2.gz AFVPFRSLBVDULO-CYBMUJFWSA-N 1 1 287.325 3.729 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1OC=CC1=S ZINC001237180727 1128997064 /nfs/dbraw/zinc/99/70/64/1128997064.db2.gz BECJZKVWBJQVMB-UHFFFAOYSA-N 1 1 290.432 3.656 20 10 CHCDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1ccccc1O ZINC000727830935 1121749267 /nfs/dbraw/zinc/74/92/67/1121749267.db2.gz WNWPQUULMLHQMS-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO C[C@@H]1CC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001178624226 1121799798 /nfs/dbraw/zinc/79/97/98/1121799798.db2.gz KFDSAQFZNAHIBH-ZJUUUORDSA-N 1 1 271.763 3.711 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](CC)Cc2ccccn2)cc1 ZINC000773764735 1121809942 /nfs/dbraw/zinc/80/99/42/1121809942.db2.gz CQQWDMKTDJLDJZ-UHFFFAOYSA-N 1 1 283.419 3.560 20 10 CHCDMO C[C@]1([NH2+]Cc2c(O)ccc(Cl)c2F)CC=CCC1 ZINC001178930495 1121826964 /nfs/dbraw/zinc/82/69/64/1121826964.db2.gz DBDHVOLZNLRMSU-AWEZNQCLSA-N 1 1 269.747 3.773 20 10 CHCDMO CCCOC1C[NH+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204241332 1121868368 /nfs/dbraw/zinc/86/83/68/1121868368.db2.gz FIRJSHWPRDGOCU-UHFFFAOYSA-N 1 1 298.430 3.517 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H](C)O1 ZINC000732184544 1121909744 /nfs/dbraw/zinc/90/97/44/1121909744.db2.gz CLZUIKMRSMHBPQ-GDBMZVCRSA-N 1 1 291.435 3.823 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)Cc2cccs2)c1 ZINC001180057431 1121944567 /nfs/dbraw/zinc/94/45/67/1121944567.db2.gz DERLEDZESWQZJU-GFCCVEGCSA-N 1 1 291.416 3.525 20 10 CHCDMO CCCC[N@@H+](CC)Cc1c(O)cc(C)cc1Cl ZINC001180437458 1121987828 /nfs/dbraw/zinc/98/78/28/1121987828.db2.gz IBZPVJFMRKOFOC-UHFFFAOYSA-N 1 1 255.789 3.976 20 10 CHCDMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816485534 1122025180 /nfs/dbraw/zinc/02/51/80/1122025180.db2.gz QJUJZRMCKBXCRK-SECBINFHSA-N 1 1 259.752 3.661 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102714 1122033673 /nfs/dbraw/zinc/03/36/73/1122033673.db2.gz RYWXQRCVCSWNNA-SUMWQHHRSA-N 1 1 260.425 3.681 20 10 CHCDMO C[C@@H]1CCC[C@H](C[NH2+]Cc2cc(F)c(F)cc2O)[C@H]1C ZINC001181233354 1122045118 /nfs/dbraw/zinc/04/51/18/1122045118.db2.gz AMZCUEKTLDGMSZ-GRYCIOLGSA-N 1 1 283.362 3.832 20 10 CHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC001182184892 1122116912 /nfs/dbraw/zinc/11/69/12/1122116912.db2.gz USSRUMHXALVURL-YZTRRJNXSA-N 1 1 284.447 3.888 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC001182356874 1122147435 /nfs/dbraw/zinc/14/74/35/1122147435.db2.gz PTPACVKVJOFRSB-NSHDSACASA-N 1 1 283.774 3.807 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC001182356874 1122147438 /nfs/dbraw/zinc/14/74/38/1122147438.db2.gz PTPACVKVJOFRSB-NSHDSACASA-N 1 1 283.774 3.807 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c1 ZINC001182450838 1122160304 /nfs/dbraw/zinc/16/03/04/1122160304.db2.gz AFRZTEZZALITFH-BFHYXJOUSA-N 1 1 261.409 3.992 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC001182450935 1122160617 /nfs/dbraw/zinc/16/06/17/1122160617.db2.gz BSKJSIPXWFRSTQ-WCQYABFASA-N 1 1 281.346 3.729 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c(Cl)c1 ZINC001182453749 1122161511 /nfs/dbraw/zinc/16/15/11/1122161511.db2.gz VREIVDASYNLTSK-SRVKXCTJSA-N 1 1 267.800 3.830 20 10 CHCDMO C/C=C\C[C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC001183168708 1122211156 /nfs/dbraw/zinc/21/11/56/1122211156.db2.gz AHFYLVADGLGLBD-XQJDBVBESA-N 1 1 263.356 3.710 20 10 CHCDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC001183168708 1122211158 /nfs/dbraw/zinc/21/11/58/1122211158.db2.gz AHFYLVADGLGLBD-XQJDBVBESA-N 1 1 263.356 3.710 20 10 CHCDMO CC1=CCC[C@@H](C)[C@@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC001183454574 1122223311 /nfs/dbraw/zinc/22/33/11/1122223311.db2.gz MHLFGBRQEDGYBA-UKRRQHHQSA-N 1 1 257.377 3.700 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(F)cc1O ZINC000273462321 1122233658 /nfs/dbraw/zinc/23/36/58/1122233658.db2.gz CZPWHMVYGDVTQG-BONVTDFDSA-N 1 1 287.334 3.575 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](C)C[C@@H](C)C2)c1O ZINC001183874806 1122243425 /nfs/dbraw/zinc/24/34/25/1122243425.db2.gz BYWOKBIACYEDLU-TZMCWYRMSA-N 1 1 277.408 3.577 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]CCc1ccc(Cl)cc1 ZINC001183919200 1122248158 /nfs/dbraw/zinc/24/81/58/1122248158.db2.gz GUVRJAJQKRMMLY-UHFFFAOYSA-N 1 1 279.742 3.517 20 10 CHCDMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(OC)cc1O ZINC001203628493 1122363731 /nfs/dbraw/zinc/36/37/31/1122363731.db2.gz AXDAIRWWBYAUCN-KRWDZBQOSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc(C)cc(C)c2)c1 ZINC000775151974 1122446464 /nfs/dbraw/zinc/44/64/64/1122446464.db2.gz PEHZSMWXXQVUDC-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645511 1122655082 /nfs/dbraw/zinc/65/50/82/1122655082.db2.gz NRIOPXPZMKGLTH-ZBFHGGJFSA-N 1 1 260.425 3.824 20 10 CHCDMO COC1(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)CCCCC1 ZINC000775562685 1122675782 /nfs/dbraw/zinc/67/57/82/1122675782.db2.gz NPPUZZZZSQELEF-LLVKDONJSA-N 1 1 299.361 3.670 20 10 CHCDMO Cc1cc(C[N@H+]2CCC(C)=C(C)C2)ccc1N(C)C ZINC001193913031 1122728711 /nfs/dbraw/zinc/72/87/11/1122728711.db2.gz CAYQODHEGXEXMT-UHFFFAOYSA-N 1 1 258.409 3.603 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C2CC2)C2CCC(C)CC2)c1 ZINC000775648220 1122856761 /nfs/dbraw/zinc/85/67/61/1122856761.db2.gz ALIORIPPIKSTKM-UHFFFAOYSA-N 1 1 289.419 3.944 20 10 CHCDMO CCC(CC)[N@@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775649451 1122862605 /nfs/dbraw/zinc/86/26/05/1122862605.db2.gz RMXYVVMVBGSPAO-UHFFFAOYSA-N 1 1 263.381 3.554 20 10 CHCDMO COc1ccc(CCC[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775659102 1122872794 /nfs/dbraw/zinc/87/27/94/1122872794.db2.gz WVJTXCBPTSMRHF-UHFFFAOYSA-N 1 1 299.414 3.774 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccoc2)c1O ZINC000775662882 1122876591 /nfs/dbraw/zinc/87/65/91/1122876591.db2.gz HOLUBMTZIRSPFN-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO CC[N@H+](Cc1cc(Cl)cc(C)c1O)CC1CC1 ZINC000775700152 1122911695 /nfs/dbraw/zinc/91/16/95/1122911695.db2.gz CLDVPFSSNAUQNP-UHFFFAOYSA-N 1 1 253.773 3.586 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)c1 ZINC000775723017 1122924704 /nfs/dbraw/zinc/92/47/04/1122924704.db2.gz BNKFRYHACYFYLN-KDOFPFPSSA-N 1 1 297.398 3.779 20 10 CHCDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775724826 1122925925 /nfs/dbraw/zinc/92/59/25/1122925925.db2.gz RDAOTVLLRSWCQW-CYBMUJFWSA-N 1 1 285.840 3.681 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C3CC3)C2)c1O ZINC000775726361 1122926545 /nfs/dbraw/zinc/92/65/45/1122926545.db2.gz QVXBVPBCXDHBJT-LBPRGKRZSA-N 1 1 265.784 3.586 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000776013185 1123035497 /nfs/dbraw/zinc/03/54/97/1123035497.db2.gz 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FC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC000865822441 1124017959 /nfs/dbraw/zinc/01/79/59/1124017959.db2.gz HFENGDIRTSYFJU-MRXNPFEDSA-N 1 1 289.325 3.561 20 10 CHCDMO Cc1ccoc1C[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840950493 1124035846 /nfs/dbraw/zinc/03/58/46/1124035846.db2.gz OEVVZCRMPYKNQG-UHFFFAOYSA-N 1 1 272.392 3.594 20 10 CHCDMO COC(C)(C)CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000866505135 1124073727 /nfs/dbraw/zinc/07/37/27/1124073727.db2.gz HWHWOLXHADZQMR-JTQLQIEISA-N 1 1 271.788 3.511 20 10 CHCDMO C/C(Cl)=C/C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000528419749 1124658489 /nfs/dbraw/zinc/65/84/89/1124658489.db2.gz PGNBAEAHRIIZQO-JEMSNHSXSA-N 1 1 295.810 3.516 20 10 CHCDMO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879650064 1125223179 /nfs/dbraw/zinc/22/31/79/1125223179.db2.gz ZJBURHNUOVDKLC-NEPJUHHUSA-N 1 1 289.379 3.530 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c1O ZINC000228667678 1125250973 /nfs/dbraw/zinc/25/09/73/1125250973.db2.gz DBHQOHCKZFQTJF-QWRGUYRKSA-N 1 1 283.799 3.675 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1c(O)cccc1Cl ZINC000211658934 1125314970 /nfs/dbraw/zinc/31/49/70/1125314970.db2.gz QNONFJSMKQDRCY-CYBMUJFWSA-N 1 1 253.773 3.666 20 10 CHCDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1cccc(F)c1 ZINC000883016258 1125368409 /nfs/dbraw/zinc/36/84/09/1125368409.db2.gz SHEAARRNKBDCRA-UHFFFAOYSA-N 1 1 295.304 3.834 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(F)cc1O ZINC000883357718 1125401213 /nfs/dbraw/zinc/40/12/13/1125401213.db2.gz RMTPIHADGOXFRL-UKRRQHHQSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3ccsc3C2)cc1C ZINC000132599554 1125419982 /nfs/dbraw/zinc/41/99/82/1125419982.db2.gz BKPJUROUWROGHA-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c1O ZINC000132751807 1125421243 /nfs/dbraw/zinc/42/12/43/1125421243.db2.gz ZMLPMQOHLDRREK-ZFWWWQNUSA-N 1 1 277.408 3.801 20 10 CHCDMO CCC(CC)C[N@@H+](CC)Cc1cccc(OC)c1O ZINC000132930971 1125427411 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ZINC000091974744 1129376376 /nfs/dbraw/zinc/37/63/76/1129376376.db2.gz UEWZWEGIXBQMAE-UHFFFAOYSA-N 1 1 297.354 3.779 20 10 CHCDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000740860281 1129420933 /nfs/dbraw/zinc/42/09/33/1129420933.db2.gz CMXMZNZOJUXAMD-NEPJUHHUSA-N 1 1 277.408 3.626 20 10 CHCDMO CCSCC[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000741774826 1129451936 /nfs/dbraw/zinc/45/19/36/1129451936.db2.gz ILIJGBDBTKSDNZ-UHFFFAOYSA-N 1 1 280.481 3.718 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCOC3(CCCCC3)C2)cc1C ZINC000742165151 1129468399 /nfs/dbraw/zinc/46/83/99/1129468399.db2.gz FMOATSXCBGGLDV-UHFFFAOYSA-N 1 1 289.419 3.544 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C2=CC[N@@H+](C)CC2)cc1 ZINC001241319344 1129515081 /nfs/dbraw/zinc/51/50/81/1129515081.db2.gz IFDRUCPUJSHCFG-UHFFFAOYSA-N 1 1 266.388 3.813 20 10 CHCDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380214 1129522844 /nfs/dbraw/zinc/52/28/44/1129522844.db2.gz WJAVUZYXYLVFLB-GXTWGEPZSA-N 1 1 291.391 3.522 20 10 CHCDMO C[N@@H+](CCc1ccccc1Cl)Cc1ccccc1O ZINC000303400399 1129542246 /nfs/dbraw/zinc/54/22/46/1129542246.db2.gz RKDJKTDDVRMWNJ-UHFFFAOYSA-N 1 1 275.779 3.720 20 10 CHCDMO CCC[N@H+](CC)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000766402858 1129662994 /nfs/dbraw/zinc/66/29/94/1129662994.db2.gz YSXFBJMOHQMIRI-MRXNPFEDSA-N 1 1 291.483 3.525 20 10 CHCDMO CCC[N@@H+](CC)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000766402858 1129662997 /nfs/dbraw/zinc/66/29/97/1129662997.db2.gz YSXFBJMOHQMIRI-MRXNPFEDSA-N 1 1 291.483 3.525 20 10 CHCDMO CC/C=C/CC[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000767307146 1129784517 /nfs/dbraw/zinc/78/45/17/1129784517.db2.gz VYBJULBJPGIGJS-SNAWJCMRSA-N 1 1 288.435 3.564 20 10 CHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000767425679 1129793618 /nfs/dbraw/zinc/79/36/18/1129793618.db2.gz LWBVPEFAVNKZLM-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000380743042 1129832475 /nfs/dbraw/zinc/83/24/75/1129832475.db2.gz ULFUALDIZOPRGY-QWHCGFSZSA-N 1 1 255.361 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PIRBQSSWRMCTGF-HYXAFXHYSA-N 1 1 269.319 3.560 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C/C=C/c1ccc(F)c(F)c1)C2 ZINC001207242933 1133782395 /nfs/dbraw/zinc/78/23/95/1133782395.db2.gz GVBSPGWDZKEAAF-NSCUHMNNSA-N 1 1 287.309 3.699 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCc1cccc(F)c1)CC2 ZINC001207604656 1133827483 /nfs/dbraw/zinc/82/74/83/1133827483.db2.gz WACVHTVLFKNLKV-UHFFFAOYSA-N 1 1 285.362 3.522 20 10 CHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001207623889 1133831836 /nfs/dbraw/zinc/83/18/36/1133831836.db2.gz YPMRXRMSQOFLMQ-MGPQQGTHSA-N 1 1 277.383 3.980 20 10 CHCDMO C[C@H](C[N@H+]1CCc2cccc(O)c2C1)c1ccccc1 ZINC001207911532 1133860591 /nfs/dbraw/zinc/86/05/91/1133860591.db2.gz DJYXSHFLPSSOJY-CQSZACIVSA-N 1 1 267.372 3.554 20 10 CHCDMO CC1(C[N@H+]2CCCc3cc(O)c(O)cc3C2)CCCCC1 ZINC001208902094 1133959496 /nfs/dbraw/zinc/95/94/96/1133959496.db2.gz HQDBJKSYPVRDOM-UHFFFAOYSA-N 1 1 289.419 3.816 20 10 CHCDMO CC[N@@H+](CCOc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC001209300502 1134004410 /nfs/dbraw/zinc/00/44/10/1134004410.db2.gz WTWHJCUMVSGQNJ-UHFFFAOYSA-N 1 1 298.430 3.654 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCCO[C@H](C)C2)cc1 ZINC001209519629 1134035027 /nfs/dbraw/zinc/03/50/27/1134035027.db2.gz YZCKUHFEENUZBZ-QGZVFWFLSA-N 1 1 298.430 3.705 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000179950745 1134561299 /nfs/dbraw/zinc/56/12/99/1134561299.db2.gz OPRRYPRMOYAZJV-JTQLQIEISA-N 1 1 293.716 3.820 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3ccccc3[C@H](C)C2)c1O ZINC000404870088 1134950565 /nfs/dbraw/zinc/95/05/65/1134950565.db2.gz XNPXRMZIPKYSSR-CQSZACIVSA-N 1 1 297.398 3.563 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000317559121 1135173995 /nfs/dbraw/zinc/17/39/95/1135173995.db2.gz VAHAUPYHBUWJBJ-UHFFFAOYSA-N 1 1 299.389 3.986 20 10 CHCDMO CC[NH+](CC)c1ccc(Nc2ccc(N)cc2)cc1 ZINC000006869842 170251433 /nfs/dbraw/zinc/25/14/33/170251433.db2.gz DVESTULVTKYRRZ-UHFFFAOYSA-N 1 1 255.365 3.859 20 10 CHCDMO Cc1cc[nH+]c(N2CC=C(c3c[nH]c4ncccc34)CC2)c1 ZINC000347700178 226239424 /nfs/dbraw/zinc/23/94/24/226239424.db2.gz BFDSVTRYGWPEGC-UHFFFAOYSA-N 1 1 290.370 3.560 20 10 CHCDMO CCc1cnc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000130470986 260397108 /nfs/dbraw/zinc/39/71/08/260397108.db2.gz OMPOKYOLWVFVKU-GFCCVEGCSA-N 1 1 289.448 3.622 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccccc2)c1 ZINC000179596752 261801641 /nfs/dbraw/zinc/80/16/41/261801641.db2.gz NDFPWGQXLARNOA-CYBMUJFWSA-N 1 1 271.360 3.594 20 10 CHCDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)ccc1F ZINC000184911702 262033483 /nfs/dbraw/zinc/03/34/83/262033483.db2.gz OBMDVRLZZIWLQC-NSHDSACASA-N 1 1 277.314 3.830 20 10 CHCDMO CC[C@H]([NH2+]CCC1(OC)CCC1)c1ccc(F)cc1O ZINC000293860838 263151255 /nfs/dbraw/zinc/15/12/55/263151255.db2.gz YZVJKPSGJSLTNS-AWEZNQCLSA-N 1 1 281.371 3.531 20 10 CHCDMO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cscn1 ZINC000530413101 333546697 /nfs/dbraw/zinc/54/66/97/333546697.db2.gz FXTGJEWJOXCYCL-GFCCVEGCSA-N 1 1 285.416 3.794 20 10 CHCDMO CCc1cnc(C[N@H+](C)Cc2cc(C)c(C)cc2O)s1 ZINC000083115038 522020008 /nfs/dbraw/zinc/02/00/08/522020008.db2.gz XOALRSWBAQPBCT-UHFFFAOYSA-N 1 1 290.432 3.660 20 10 CHCDMO CCc1cnc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)s1 ZINC000083115038 522020018 /nfs/dbraw/zinc/02/00/18/522020018.db2.gz XOALRSWBAQPBCT-UHFFFAOYSA-N 1 1 290.432 3.660 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1F ZINC000127462401 522178246 /nfs/dbraw/zinc/17/82/46/522178246.db2.gz CFYYMEHSBAZCSH-KRWDZBQOSA-N 1 1 287.382 3.557 20 10 CHCDMO C[N@@H+](CCCCCO)Cc1cc(-c2ccccc2)ccc1O ZINC000279436155 522731181 /nfs/dbraw/zinc/73/11/81/522731181.db2.gz OPXJNWRSSASBDI-UHFFFAOYSA-N 1 1 299.414 3.654 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccnc1 ZINC000248049553 523262818 /nfs/dbraw/zinc/26/28/18/523262818.db2.gz NACVDSJJFJELGU-UHFFFAOYSA-N 1 1 295.430 3.704 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1C ZINC000127445804 525316669 /nfs/dbraw/zinc/31/66/69/525316669.db2.gz UXAGYJRFKCGBCP-INIZCTEOSA-N 1 1 270.376 3.674 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(F)cc1O ZINC000297394007 525416706 /nfs/dbraw/zinc/41/67/06/525416706.db2.gz RZOKPPVYHAWOKN-GFCCVEGCSA-N 1 1 288.366 3.555 20 10 CHCDMO C[C@@H]([NH2+]Cc1cccc(F)c1)c1ccc(F)cc1O ZINC000062745491 525534171 /nfs/dbraw/zinc/53/41/71/525534171.db2.gz VQBABVCXCWGDSZ-SNVBAGLBSA-N 1 1 263.287 3.521 20 10 CHCDMO Cc1ccc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1 ZINC000037786565 525917184 /nfs/dbraw/zinc/91/71/84/525917184.db2.gz LLBRBDSYRVNZLW-AWEZNQCLSA-N 1 1 290.451 3.614 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]1C ZINC001193603179 1122704632 /nfs/dbraw/zinc/70/46/32/1122704632.db2.gz AOLPRNGGXBKFML-ZBFHGGJFSA-N 1 1 260.425 3.681 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C2CC2)c1O ZINC000775677155 1122901032 /nfs/dbraw/zinc/90/10/32/1122901032.db2.gz HYIOATRCGSAIDK-CQSZACIVSA-N 1 1 265.784 3.728 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H]2C)c1O ZINC000775716551 1122921325 /nfs/dbraw/zinc/92/13/25/1122921325.db2.gz XQOWBYHXVDIISE-MWLCHTKSSA-N 1 1 253.773 3.584 20 10 CHCDMO COc1cccc([C@H](C)[NH2+]CC(F)(F)C(C)(C)C)c1O ZINC000850572695 1123294902 /nfs/dbraw/zinc/29/49/02/1123294902.db2.gz NYNWRZQDUFZKPX-JTQLQIEISA-N 1 1 287.350 3.733 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)s1 ZINC000866455389 1124067927 /nfs/dbraw/zinc/06/79/27/1124067927.db2.gz LDLCEKRXFWNIDB-IUCAKERBSA-N 1 1 280.368 3.708 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1Cl)C1CCCCC1 ZINC000131742926 1125409941 /nfs/dbraw/zinc/40/99/41/1125409941.db2.gz JYYCXGYYKHOTCD-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](CF)C2)cc1Cl ZINC001231870708 1132383098 /nfs/dbraw/zinc/38/30/98/1132383098.db2.gz PCYWTPXWYZEDCW-LLVKDONJSA-N 1 1 271.763 3.536 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841755643 1132392371 /nfs/dbraw/zinc/39/23/71/1132392371.db2.gz QNUSSZUZCVDYSK-KOLCDFICSA-N 1 1 271.813 3.592 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(Cl)cc1O ZINC000841761581 1132396500 /nfs/dbraw/zinc/39/65/00/1132396500.db2.gz YNZZWDBLYBOWNS-ONGXEEELSA-N 1 1 271.813 3.592 20 10 CHCDMO CC(C)(C)C1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233331706 1132603411 /nfs/dbraw/zinc/60/34/11/1132603411.db2.gz HRBSNGUSWRIXJD-UHFFFAOYSA-N 1 1 283.362 3.929 20 10 CHCDMO CCc1ccc(C[N@H+](CC)Cc2ccccc2O)o1 ZINC001204394710 1133442632 /nfs/dbraw/zinc/44/26/32/1133442632.db2.gz JKQRJEDVOSSMMP-UHFFFAOYSA-N 1 1 259.349 3.570 20 10 CHCDMO CSc1ccc(C[NH2+]Cc2cccc(F)c2O)cc1 ZINC001205450493 1133578108 /nfs/dbraw/zinc/57/81/08/1133578108.db2.gz KIULQIAJNJANDP-UHFFFAOYSA-N 1 1 277.364 3.543 20 10 CHCDMO CC1(C)CC[NH+](Cc2cccc(Br)c2O)CC1 ZINC000133932302 1125510645 /nfs/dbraw/zinc/51/06/45/1125510645.db2.gz RNMGLJOCZPUPMX-UHFFFAOYSA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957844 1125570466 /nfs/dbraw/zinc/57/04/66/1125570466.db2.gz UZIDCXPKQQTGEZ-CHWSQXEVSA-N 1 1 255.361 3.776 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(Cl)cc1O ZINC000841757141 1125596690 /nfs/dbraw/zinc/59/66/90/1125596690.db2.gz FBGDOQRBEMRFLQ-QWRGUYRKSA-N 1 1 283.799 3.511 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886489516 1125680369 /nfs/dbraw/zinc/68/03/69/1125680369.db2.gz KPLRVXBFPZDWMT-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO Cc1ccsc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886512668 1125683316 /nfs/dbraw/zinc/68/33/16/1125683316.db2.gz KTYQAKFMEINFDO-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO COc1ccc(C)cc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886543014 1125686499 /nfs/dbraw/zinc/68/64/99/1125686499.db2.gz JLNWCAJSJKWHKP-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1c(O)cccc1F ZINC000886551466 1125690433 /nfs/dbraw/zinc/69/04/33/1125690433.db2.gz IKGHQKDAMHRTTG-QWHCGFSZSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1c(O)cccc1F ZINC000886558705 1125690461 /nfs/dbraw/zinc/69/04/61/1125690461.db2.gz QFOTUYYSMUSEEW-YWPYICTPSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)c1c(O)cccc1F ZINC000886630996 1125701399 /nfs/dbraw/zinc/70/13/99/1125701399.db2.gz ABOBZWFZCRZGIM-HERUPUMHSA-N 1 1 289.753 3.887 20 10 CHCDMO Oc1ccc(Br)cc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000826539334 1125755829 /nfs/dbraw/zinc/75/58/29/1125755829.db2.gz RSHYQKCSXLTVCY-GWCFXTLKSA-N 1 1 296.208 3.529 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cc1C ZINC000793231274 1130532817 /nfs/dbraw/zinc/53/28/17/1130532817.db2.gz LXVWIFMHYQCPIC-YPMHNXCESA-N 1 1 287.325 3.782 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2cccs2)c1 ZINC000179713961 1126833278 /nfs/dbraw/zinc/83/32/78/1126833278.db2.gz WRMJEZSBVWIVBW-LLVKDONJSA-N 1 1 277.389 3.655 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2cccnc2)c1O ZINC000183729041 1126892057 /nfs/dbraw/zinc/89/20/57/1126892057.db2.gz PVZPJAIABSPAEI-GFCCVEGCSA-N 1 1 290.794 3.942 20 10 CHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2cccc(C)c2O)cs1 ZINC000189918607 1126935883 /nfs/dbraw/zinc/93/58/83/1126935883.db2.gz YVEATUNHHWHHQC-OAHLLOKOSA-N 1 1 288.416 3.803 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000193456313 1126969534 /nfs/dbraw/zinc/96/95/34/1126969534.db2.gz BRVKRTUQWICIRG-SFHVURJKSA-N 1 1 283.419 3.731 20 10 CHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Cl)C1(C)C ZINC001319706720 1126981980 /nfs/dbraw/zinc/98/19/80/1126981980.db2.gz ABOINNWJLQRVGU-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO C[C@H]([NH2+]C1CC(C)C1)c1cccc(C(F)(F)F)c1O ZINC000815595565 1131006079 /nfs/dbraw/zinc/00/60/79/1131006079.db2.gz VIFKLAVWTWCTMB-KYHHOPLUSA-N 1 1 273.298 3.860 20 10 CHCDMO C[N@H+](Cc1cccnc1)Cc1cc(Cl)c(Cl)cc1O ZINC001236792520 1131007920 /nfs/dbraw/zinc/00/79/20/1131007920.db2.gz DTCCFEGXFJEYJF-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO C[N@@H+](Cc1cccnc1)Cc1cc(Cl)c(Cl)cc1O ZINC001236792520 1131007924 /nfs/dbraw/zinc/00/79/24/1131007924.db2.gz DTCCFEGXFJEYJF-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237138797 1131055427 /nfs/dbraw/zinc/05/54/27/1131055427.db2.gz YVUJTAGUPGZUMR-CABZTGNLSA-N 1 1 291.288 3.591 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C2CC2)C2CCCC2)c1O ZINC000164001238 1127149084 /nfs/dbraw/zinc/14/90/84/1127149084.db2.gz ZXWAJQUVZRTEJM-UHFFFAOYSA-N 1 1 275.392 3.616 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000164226426 1127156855 /nfs/dbraw/zinc/15/68/55/1127156855.db2.gz LCCOBSTXBGEIGD-MRXNPFEDSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CF)C2)c1O ZINC001237687528 1131128012 /nfs/dbraw/zinc/12/80/12/1131128012.db2.gz KUHQTJPIAZYQIB-LLVKDONJSA-N 1 1 271.763 3.536 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])[C@@H](C)C1 ZINC001237798441 1131141606 /nfs/dbraw/zinc/14/16/06/1131141606.db2.gz FNHVHSHUHITTEJ-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cncc2F)cc1C ZINC000285520408 1127234844 /nfs/dbraw/zinc/23/48/44/1127234844.db2.gz OXSGPRZYVGMREO-NSHDSACASA-N 1 1 292.329 3.528 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cccc(F)c1)c1ccc(F)cc1O ZINC000285581171 1127238139 /nfs/dbraw/zinc/23/81/39/1127238139.db2.gz IPESEAPJEDTDJS-OAHLLOKOSA-N 1 1 277.314 3.911 20 10 CHCDMO CC[C@@H]([NH2+]CCc1csc(C)n1)c1ccc(F)cc1O ZINC000285587868 1127238288 /nfs/dbraw/zinc/23/82/88/1127238288.db2.gz JADCSDDKEBNCOT-CQSZACIVSA-N 1 1 294.395 3.580 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000286047309 1127256271 /nfs/dbraw/zinc/25/62/71/1127256271.db2.gz KBBKOTALXYYLCR-UKRRQHHQSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H]([NH2+]C1CC[NH+](CC)CC1)c1cccc(Cl)c1[O-] ZINC000286973358 1127278002 /nfs/dbraw/zinc/27/80/02/1127278002.db2.gz NXECZOIRXGPBIC-HNNXBMFYSA-N 1 1 296.842 3.571 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccncc1 ZINC000293630692 1127510074 /nfs/dbraw/zinc/51/00/74/1127510074.db2.gz NDSFJLABPAIYPJ-CQSZACIVSA-N 1 1 294.757 3.821 20 10 CHCDMO CC[N@@H+](CCC1CC1)Cc1ccc(N(C)C)c(F)c1 ZINC000761226267 1127552153 /nfs/dbraw/zinc/55/21/53/1127552153.db2.gz 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Cc1c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c2ccccc2n1C ZINC001138252862 1131482436 /nfs/dbraw/zinc/48/24/36/1131482436.db2.gz XBLCNRRCEGWOPG-GASCZTMLSA-N 1 1 268.404 3.719 20 10 CHCDMO Cc1c(C[N@@H+](C)Cc2cccc(O)c2)c2ccccc2n1C ZINC001138252572 1131482461 /nfs/dbraw/zinc/48/24/61/1131482461.db2.gz MFZNJUHRRDGNAV-UHFFFAOYSA-N 1 1 294.398 3.824 20 10 CHCDMO Cc1c(C[N@H+]2CCC(C)(C)C2)c2ccccc2n1C ZINC001138256976 1131482975 /nfs/dbraw/zinc/48/29/75/1131482975.db2.gz QYIQDDYLLLTOMW-UHFFFAOYSA-N 1 1 256.393 3.719 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c2ccccc2n1C ZINC001138256911 1131483255 /nfs/dbraw/zinc/48/32/55/1131483255.db2.gz PAWSCUCPMYIYLB-MRXNPFEDSA-N 1 1 290.357 3.718 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2O)CC1(C)C ZINC000824821300 1131485931 /nfs/dbraw/zinc/48/59/31/1131485931.db2.gz XWENKISOBFXSFX-CQSZACIVSA-N 1 1 297.826 3.601 20 10 CHCDMO CCOC1CC(C[N@H+](CC2CC2)c2ccc(OC)cc2)C1 ZINC000831587511 1131491594 /nfs/dbraw/zinc/49/15/94/1131491594.db2.gz 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ZINC001140341509 1131703782 /nfs/dbraw/zinc/70/37/82/1131703782.db2.gz SATIVZHQRPWNDB-SECBINFHSA-N 1 1 275.726 3.523 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H](C)O ZINC000834886181 1131718366 /nfs/dbraw/zinc/71/83/66/1131718366.db2.gz ADDPLXUWQVKCFB-SXMVTHIZSA-N 1 1 292.206 3.509 20 10 CHCDMO Cc1cc(C)c(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)cn1 ZINC000834902099 1131727110 /nfs/dbraw/zinc/72/71/10/1131727110.db2.gz DQTBYGZWMUUCET-NSHDSACASA-N 1 1 292.329 3.533 20 10 CHCDMO COCC1(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CCCC1 ZINC000834906998 1131729826 /nfs/dbraw/zinc/72/98/26/1131729826.db2.gz VPHVLYKLTGBJTF-NSHDSACASA-N 1 1 299.361 3.528 20 10 CHCDMO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000834912886 1131731907 /nfs/dbraw/zinc/73/19/07/1131731907.db2.gz MZOMMPIBSCDDON-IIAWOOMASA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461631 1131749228 /nfs/dbraw/zinc/74/92/28/1131749228.db2.gz OFVVENBTEZXYMC-LLVKDONJSA-N 1 1 253.773 3.668 20 10 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/nfs/dbraw/zinc/96/27/02/1131962702.db2.gz XOKMPIZUBHYESJ-UHFFFAOYSA-N 1 1 278.827 3.925 20 10 CHCDMO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)C[C@H]1F ZINC001140921432 1131963152 /nfs/dbraw/zinc/96/31/52/1131963152.db2.gz CTKMARGCBGTEPT-IAQYHMDHSA-N 1 1 284.806 3.586 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2Cl)C[C@H]1F ZINC001140921432 1131963157 /nfs/dbraw/zinc/96/31/57/1131963157.db2.gz CTKMARGCBGTEPT-IAQYHMDHSA-N 1 1 284.806 3.586 20 10 CHCDMO Cc1cc(NCc2cc3ccccc3cc2O)nc(C)[nH+]1 ZINC001171399530 1131966255 /nfs/dbraw/zinc/96/62/55/1131966255.db2.gz JOKMZNLQFQQNKX-UHFFFAOYSA-N 1 1 279.343 3.564 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001140949538 1131970415 /nfs/dbraw/zinc/97/04/15/1131970415.db2.gz CZNXNIUBLISWRE-GOSISDBHSA-N 1 1 297.398 3.744 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076466 1132005975 /nfs/dbraw/zinc/00/59/75/1132005975.db2.gz SLSVPWFKPZCTHN-GOSISDBHSA-N 1 1 284.447 3.760 20 10 CHCDMO Cc1cccc2c1CC[C@@H]([N@@H+](C)Cc1ccccc1O)C2 ZINC001171574871 1132061270 /nfs/dbraw/zinc/06/12/70/1132061270.db2.gz QMJIFDATIWHGSX-QGZVFWFLSA-N 1 1 281.399 3.690 20 10 CHCDMO CC[C@H](C)OCC[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349564 1132181896 /nfs/dbraw/zinc/18/18/96/1132181896.db2.gz VKCSJVVPXLNKQT-HOTGVXAUSA-N 1 1 292.467 3.778 20 10 CHCDMO CC[C@H](C)OCC[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349563 1132182094 /nfs/dbraw/zinc/18/20/94/1132182094.db2.gz VKCSJVVPXLNKQT-CVEARBPZSA-N 1 1 292.467 3.778 20 10 CHCDMO Cc1cc(O)c(C[NH2+]Cc2cc(C(C)C)no2)c(Cl)c1 ZINC000840897182 1132305994 /nfs/dbraw/zinc/30/59/94/1132305994.db2.gz KVADIBMJNSYFDI-UHFFFAOYSA-N 1 1 294.782 3.755 20 10 CHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2C)no1 ZINC000840910512 1132307540 /nfs/dbraw/zinc/30/75/40/1132307540.db2.gz ONERFAMQHXNKKQ-SFHVURJKSA-N 1 1 299.418 3.695 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000840918273 1132310398 /nfs/dbraw/zinc/31/03/98/1132310398.db2.gz YXSDEOGFMUGRCJ-UHFFFAOYSA-N 1 1 298.352 3.755 20 10 CHCDMO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1c(O)ccc2ccccc21 ZINC001231590155 1132318071 /nfs/dbraw/zinc/31/80/71/1132318071.db2.gz NHDWMXBTAITENA-GASCZTMLSA-N 1 1 295.382 3.631 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3ccccc3C2)c(O)c1 ZINC001231842053 1132375830 /nfs/dbraw/zinc/37/58/30/1132375830.db2.gz NRNIJUFIKMMFRB-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)Cc2ccccc2)c(O)c1 ZINC001231842661 1132376509 /nfs/dbraw/zinc/37/65/09/1132376509.db2.gz WWPPPXCOOGFULD-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC001231843361 1132376669 /nfs/dbraw/zinc/37/66/69/1132376669.db2.gz WWUJACIFRPRKMP-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO COc1ccccc1CC[N@@H+](C)Cc1c(C)cc(C)cc1O ZINC001231846741 1132378506 /nfs/dbraw/zinc/37/85/06/1132378506.db2.gz OFUTVBGRCAJBEW-UHFFFAOYSA-N 1 1 299.414 3.692 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC001231844149 1132378707 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3.716 20 10 CHCDMO [O-]c1c(F)cccc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000272284644 328199680 /nfs/dbraw/zinc/19/96/80/328199680.db2.gz NFTKZFACAXPORM-UHFFFAOYSA-N 1 1 277.364 3.757 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000272284644 328199682 /nfs/dbraw/zinc/19/96/82/328199682.db2.gz NFTKZFACAXPORM-UHFFFAOYSA-N 1 1 277.364 3.757 20 10 CHCDMO CCCCN1CCC([NH2+][C@H](CC)c2ccccc2O)CC1 ZINC000037150149 520576079 /nfs/dbraw/zinc/57/60/79/520576079.db2.gz DLWBCTWYZFUOQO-QGZVFWFLSA-N 1 1 290.451 3.697 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000289975691 521320921 /nfs/dbraw/zinc/32/09/21/521320921.db2.gz XHHXCZCJIWNQFV-QGZVFWFLSA-N 1 1 290.451 3.532 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccnc1Cl ZINC000068973558 521690212 /nfs/dbraw/zinc/69/02/12/521690212.db2.gz DQRLQYXGCXMEFJ-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062747711 524093042 /nfs/dbraw/zinc/09/30/42/524093042.db2.gz BPUPEQRGQUJLDO-NEPJUHHUSA-N 1 1 289.350 3.952 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1C ZINC000127445509 525314897 /nfs/dbraw/zinc/31/48/97/525314897.db2.gz UXAGYJRFKCGBCP-MRXNPFEDSA-N 1 1 270.376 3.674 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000062744688 525613610 /nfs/dbraw/zinc/61/36/10/525613610.db2.gz WUQYACQROYVIBZ-NWDGAFQWSA-N 1 1 259.324 3.943 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000278631680 525627430 /nfs/dbraw/zinc/62/74/30/525627430.db2.gz HAAVQWVGNYHIBF-YUMQZZPRSA-N 1 1 292.231 3.855 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000367721909 526347296 /nfs/dbraw/zinc/34/72/96/526347296.db2.gz ABODDPZPFPCXEE-HNNXBMFYSA-N 1 1 288.778 3.778 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127427864 526363553 /nfs/dbraw/zinc/36/35/53/526363553.db2.gz QKFHNVMMTFPMDZ-CQSZACIVSA-N 1 1 276.767 3.711 20 10 CHCDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000290340333 526521527 /nfs/dbraw/zinc/52/15/27/526521527.db2.gz FJCDBQSYCBLQDD-MRXNPFEDSA-N 1 1 299.418 3.849 20 10 CHCDMO CCC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000708466419 1121464335 /nfs/dbraw/zinc/46/43/35/1121464335.db2.gz HSDTULNTLZNRRT-LBPRGKRZSA-N 1 1 251.345 3.543 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC001182356873 1122147363 /nfs/dbraw/zinc/14/73/63/1122147363.db2.gz PTPACVKVJOFRSB-LLVKDONJSA-N 1 1 283.774 3.807 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC001182356873 1122147366 /nfs/dbraw/zinc/14/73/66/1122147366.db2.gz PTPACVKVJOFRSB-LLVKDONJSA-N 1 1 283.774 3.807 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645541 1122655088 /nfs/dbraw/zinc/65/50/88/1122655088.db2.gz OJSPZLDCYYXLOD-HOCLYGCPSA-N 1 1 260.425 3.906 20 10 CHCDMO CC[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC001173297190 1132445979 /nfs/dbraw/zinc/44/59/79/1132445979.db2.gz XJWFQEVVYIGLPU-PBHICJAKSA-N 1 1 260.425 3.763 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@H]2C)cc1Cl ZINC001232264946 1132447138 /nfs/dbraw/zinc/44/71/38/1132447138.db2.gz PDNGOFVVJKSUEY-GHMZBOCLSA-N 1 1 283.799 3.675 20 10 CHCDMO COCCC(C)(C)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841752498 1125584634 /nfs/dbraw/zinc/58/46/34/1125584634.db2.gz PBCCZSQRBWFRSE-LLVKDONJSA-N 1 1 285.815 3.759 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC000093480741 1125610726 /nfs/dbraw/zinc/61/07/26/1125610726.db2.gz WYOFZMLOLXOPHQ-CZUORRHYSA-N 1 1 275.392 3.555 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1c(O)cccc1F ZINC000886494938 1125680333 /nfs/dbraw/zinc/68/03/33/1125680333.db2.gz AGOKGFJJKTUSIG-XHDPSFHLSA-N 1 1 271.335 3.869 20 10 CHCDMO CCOc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886512868 1125682823 /nfs/dbraw/zinc/68/28/23/1125682823.db2.gz ORXXLIBUAJSGJP-GFCCVEGCSA-N 1 1 289.350 3.781 20 10 CHCDMO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2c(O)cccc2F)n1 ZINC000886587925 1125694420 /nfs/dbraw/zinc/69/44/20/1125694420.db2.gz IITCVSVEEOLSSR-ONGXEEELSA-N 1 1 294.395 3.751 20 10 CHCDMO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1c(O)cccc1F ZINC000886590097 1125695457 /nfs/dbraw/zinc/69/54/57/1125695457.db2.gz NTPONJUCHPPKBD-STQMWFEESA-N 1 1 281.371 3.531 20 10 CHCDMO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1c(O)cccc1F ZINC000886609674 1125696642 /nfs/dbraw/zinc/69/66/42/1125696642.db2.gz ZBTPNSZVDOALAA-QMMMGPOBSA-N 1 1 277.261 3.524 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1c(O)cccc1F ZINC000886605766 1125696683 /nfs/dbraw/zinc/69/66/83/1125696683.db2.gz YDPADUFDGCQDGM-UWVGGRQHSA-N 1 1 273.298 3.617 20 10 CHCDMO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886606670 1125696781 /nfs/dbraw/zinc/69/67/81/1125696781.db2.gz CZCMMJAZPLLRTQ-JTQLQIEISA-N 1 1 294.757 3.739 20 10 CHCDMO COc1ccc(F)c(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886639327 1125700368 /nfs/dbraw/zinc/70/03/68/1125700368.db2.gz ALJANUOIRYQGTP-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1ccc(F)cc1O ZINC000886731122 1125714885 /nfs/dbraw/zinc/71/48/85/1125714885.db2.gz VSJFDMYTVHZVPX-GXTWGEPZSA-N 1 1 293.382 3.531 20 10 CHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000093593586 1125771386 /nfs/dbraw/zinc/77/13/86/1125771386.db2.gz FCPSDBRQDRZNHQ-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1CCC2(CC2)CC1 ZINC000766212186 1129337860 /nfs/dbraw/zinc/33/78/60/1129337860.db2.gz BMWBDZKULHPFEU-UHFFFAOYSA-N 1 1 283.774 3.997 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c(O)cc1C ZINC000768442739 1129857688 /nfs/dbraw/zinc/85/76/88/1129857688.db2.gz ZWMBVVIRFDQFOD-LBPRGKRZSA-N 1 1 265.397 3.576 20 10 CHCDMO C[N@@H+](CCc1cccs1)Cc1cc(Cl)ccc1O ZINC000769497817 1129914148 /nfs/dbraw/zinc/91/41/48/1129914148.db2.gz BXPHKYRSFIHFCL-UHFFFAOYSA-N 1 1 281.808 3.782 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1ccc(Cl)nc1Cl ZINC000788020293 1130172046 /nfs/dbraw/zinc/17/20/46/1130172046.db2.gz PJAMSHXOFAGBIW-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(Cl)nc1Cl ZINC000788020293 1130172049 /nfs/dbraw/zinc/17/20/49/1130172049.db2.gz PJAMSHXOFAGBIW-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@@H](C)OC ZINC000812302822 1130684397 /nfs/dbraw/zinc/68/43/97/1130684397.db2.gz ZSPNYKHGTKILBJ-CQSZACIVSA-N 1 1 279.424 3.681 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000183292285 1126884749 /nfs/dbraw/zinc/88/47/49/1126884749.db2.gz OZHJUSXATHSIIS-QGZVFWFLSA-N 1 1 282.387 3.905 20 10 CHCDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000187596989 1126912249 /nfs/dbraw/zinc/91/22/49/1126912249.db2.gz FYNRXXCPMYYWGJ-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CN(c1ccc(C[NH2+]Cc2cocn2)cc1)C1CCCCC1 ZINC000192299657 1126960295 /nfs/dbraw/zinc/96/02/95/1126960295.db2.gz ISICMOZUOCHQRJ-UHFFFAOYSA-N 1 1 299.418 3.733 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000156006538 1127092966 /nfs/dbraw/zinc/09/29/66/1127092966.db2.gz JFSRRRJONGAJNE-INIZCTEOSA-N 1 1 297.398 3.780 20 10 CHCDMO CCc1nc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000156419529 1127155405 /nfs/dbraw/zinc/15/54/05/1127155405.db2.gz ISEYBTWTQQYZGH-GFCCVEGCSA-N 1 1 289.448 3.622 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000816609251 1131114204 /nfs/dbraw/zinc/11/42/04/1131114204.db2.gz WAKLCLRMZPSGRP-UHFFFAOYSA-N 1 1 297.679 3.617 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1cccnc1)c1ccc(F)cc1O ZINC000285519470 1127235046 /nfs/dbraw/zinc/23/50/46/1127235046.db2.gz DXEHUFSRQBXGIT-ABAIWWIYSA-N 1 1 274.339 3.728 20 10 CHCDMO C[C@H]1C[C@H](C)C[NH+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237948633 1131155441 /nfs/dbraw/zinc/15/54/41/1131155441.db2.gz FSBHUIWINRWOST-UWVGGRQHSA-N 1 1 271.763 3.663 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccccc1)c1ccc(F)cc1O ZINC000285860711 1127245555 /nfs/dbraw/zinc/24/55/55/1127245555.db2.gz YJKNNTSXHREFKV-OAHLLOKOSA-N 1 1 259.324 3.772 20 10 CHCDMO CC[C@H]([NH2+]CCCC(F)(F)F)c1ccc(F)cc1O ZINC000286003662 1127252605 /nfs/dbraw/zinc/25/26/05/1127252605.db2.gz IVALOATVRGELEH-NSHDSACASA-N 1 1 279.277 3.915 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)CC1 ZINC000226565490 1127411840 /nfs/dbraw/zinc/41/18/40/1127411840.db2.gz MICXBYINGAQXOB-GFCCVEGCSA-N 1 1 251.345 3.543 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)cc1 ZINC001168405347 1127426854 /nfs/dbraw/zinc/42/68/54/1127426854.db2.gz XJTRPQLFRSDJBL-INIZCTEOSA-N 1 1 272.436 3.931 20 10 CHCDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1O ZINC000295094373 1127619827 /nfs/dbraw/zinc/61/98/27/1127619827.db2.gz UFQDSKBQSVPTJX-PWSUYJOCSA-N 1 1 273.298 3.555 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1 ZINC000295210667 1127627822 /nfs/dbraw/zinc/62/78/22/1127627822.db2.gz LMLPEQCBPQHOIZ-WMLDXEAASA-N 1 1 298.434 3.525 20 10 CHCDMO CSc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000171926600 1127734824 /nfs/dbraw/zinc/73/48/24/1127734824.db2.gz MYRLGHDIABVAKY-UHFFFAOYSA-N 1 1 273.401 3.746 20 10 CHCDMO CO[C@]1(C)CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000230300065 1127751191 /nfs/dbraw/zinc/75/11/91/1127751191.db2.gz DSFLHUOTDLQUBX-GOSISDBHSA-N 1 1 285.387 3.546 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1ccc(F)cc1O ZINC000230407935 1127752232 /nfs/dbraw/zinc/75/22/32/1127752232.db2.gz IXDZFOJUWGSKKR-GRYCIOLGSA-N 1 1 251.345 3.618 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1ccc(F)cc1O ZINC000062746782 1127774174 /nfs/dbraw/zinc/77/41/74/1127774174.db2.gz FLSSAROSITXHSS-WDEREUQCSA-N 1 1 279.380 3.875 20 10 CHCDMO Cc1cc(O)c(C[N@H+]([C@H](C)C2CC2)C2CC2)cc1C ZINC000914850614 1128253968 /nfs/dbraw/zinc/25/39/68/1128253968.db2.gz MUGIUFXBHBPHTG-CYBMUJFWSA-N 1 1 259.393 3.772 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000927101897 1128217376 /nfs/dbraw/zinc/21/73/76/1128217376.db2.gz PTAPCRWQLQAHDI-VXGBXAGGSA-N 1 1 295.398 3.776 20 10 CHCDMO CCC[C@@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001257308419 1128218211 /nfs/dbraw/zinc/21/82/11/1128218211.db2.gz RWVIQTIJWPRBFB-SNVBAGLBSA-N 1 1 278.783 3.872 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCC2)O1)c1c(O)cccc1F ZINC000927124003 1128219749 /nfs/dbraw/zinc/21/97/49/1128219749.db2.gz GOBNLSQAUMPQKU-OLZOCXBDSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](COc3ccccc3)C2)c1 ZINC000780788918 1128358931 /nfs/dbraw/zinc/35/89/31/1128358931.db2.gz DCDAKUWDDLSIKE-MRXNPFEDSA-N 1 1 297.398 3.602 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000763333720 1128392421 /nfs/dbraw/zinc/39/24/21/1128392421.db2.gz SCOVHAGUFADMAG-OAHLLOKOSA-N 1 1 267.372 3.777 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000763333716 1128392461 /nfs/dbraw/zinc/39/24/61/1128392461.db2.gz SCOVHAGUFADMAG-HNNXBMFYSA-N 1 1 267.372 3.777 20 10 CHCDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(F)ccc1O ZINC000780792574 1128420994 /nfs/dbraw/zinc/42/09/94/1128420994.db2.gz HPAIRVOVCTYCRM-GXSJLCMTSA-N 1 1 291.288 3.694 20 10 CHCDMO CC(C)(C)[C@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC001202779140 1128560891 /nfs/dbraw/zinc/56/08/91/1128560891.db2.gz RSGYIFIUFQMXNI-JSGCOSHPSA-N 1 1 283.362 3.975 20 10 CHCDMO Cc1ccc(C2=CC[N@@H+](Cc3ccccc3O)CC2)cc1 ZINC000778994048 1128674771 /nfs/dbraw/zinc/67/47/71/1128674771.db2.gz GKYBHQZXYPXBKF-UHFFFAOYSA-N 1 1 279.383 3.990 20 10 CHCDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000779000418 1128675506 /nfs/dbraw/zinc/67/55/06/1128675506.db2.gz VJTRIJDFFQEVOJ-QGZVFWFLSA-N 1 1 297.398 3.608 20 10 CHCDMO CC[C@]1(C)CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000779019864 1128683554 /nfs/dbraw/zinc/68/35/54/1128683554.db2.gz IYQUAMUGJPOUQG-OAHLLOKOSA-N 1 1 251.345 3.543 20 10 CHCDMO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccc(F)cc1O ZINC000185440042 1117824359 /nfs/dbraw/zinc/82/43/59/1117824359.db2.gz VGOUTUNTUFIFJH-LJLILKBBSA-N 1 1 271.335 3.895 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H](C)CC(F)F)c1ccc(F)cc1O ZINC000842892327 1118158349 /nfs/dbraw/zinc/15/83/49/1118158349.db2.gz AYRJCWUZAQCUCA-CABZTGNLSA-N 1 1 275.314 3.863 20 10 CHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)C1CCC1 ZINC000179829576 1128761295 /nfs/dbraw/zinc/76/12/95/1128761295.db2.gz ZDZOYCWZLAHWJP-UHFFFAOYSA-N 1 1 284.197 3.529 20 10 CHCDMO CCOc1ccccc1C[N@@H+](CC)Cc1ccccc1O ZINC001203543878 1118189378 /nfs/dbraw/zinc/18/93/78/1118189378.db2.gz JFEDLDCJQYYRFT-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cccc(Cl)c1[O-] ZINC001652674274 1118273350 /nfs/dbraw/zinc/27/33/50/1118273350.db2.gz BGYILUKQMKVIAA-SNVBAGLBSA-N 1 1 253.773 3.666 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)c1O ZINC000253061181 1118288500 /nfs/dbraw/zinc/28/85/00/1118288500.db2.gz DUKTWBBIIUXNLI-GHMZBOCLSA-N 1 1 295.810 3.726 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)c1O ZINC000253061181 1118288506 /nfs/dbraw/zinc/28/85/06/1118288506.db2.gz DUKTWBBIIUXNLI-GHMZBOCLSA-N 1 1 295.810 3.726 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000211671287 1118332108 /nfs/dbraw/zinc/33/21/08/1118332108.db2.gz LEFWWMRNNJAJIH-CYBMUJFWSA-N 1 1 298.224 3.775 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](CC(C)C)C2)c1O ZINC000307782520 1118452251 /nfs/dbraw/zinc/45/22/51/1118452251.db2.gz 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ZINC000109772042 1123326491 /nfs/dbraw/zinc/32/64/91/1123326491.db2.gz AKSIFAJNSJYBNY-UHFFFAOYSA-N 1 1 285.387 3.811 20 10 CHCDMO CC[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC001204769371 1123424966 /nfs/dbraw/zinc/42/49/66/1123424966.db2.gz SZRHVJWAALEWMG-KEGWNNHHSA-N 1 1 290.476 3.593 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCCc2ccccc21 ZINC000111235619 1123432390 /nfs/dbraw/zinc/43/23/90/1123432390.db2.gz PAPFUWNUIVRQLZ-KRWDZBQOSA-N 1 1 267.372 3.902 20 10 CHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000112961946 1123506017 /nfs/dbraw/zinc/50/60/17/1123506017.db2.gz FTIAOWRGOVHDOP-OAHLLOKOSA-N 1 1 291.435 3.682 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCO[C@@H](CC)C1 ZINC000780758818 1123544440 /nfs/dbraw/zinc/54/44/40/1123544440.db2.gz WTEZANFHGIOTLU-WBVHZDCISA-N 1 1 291.435 3.809 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccnc(C)c2)cc1 ZINC000856720108 1123566278 /nfs/dbraw/zinc/56/62/78/1123566278.db2.gz XLNWEZCKLCFPFN-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO C[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CCCC1 ZINC000194570473 1129135481 /nfs/dbraw/zinc/13/54/81/1129135481.db2.gz BBWUGFRMDCDJQB-UHFFFAOYSA-N 1 1 277.408 3.770 20 10 CHCDMO C[C@@H]([NH2+]Cc1ncccc1Cl)c1ccc(N(C)C)cc1 ZINC000859258586 1123692955 /nfs/dbraw/zinc/69/29/55/1123692955.db2.gz QHXFEIUWGHVWRD-GFCCVEGCSA-N 1 1 289.810 3.652 20 10 CHCDMO C[C@H]([NH2+]Cc1ncccc1Cl)c1ccc(N(C)C)cc1 ZINC000859258587 1123693175 /nfs/dbraw/zinc/69/31/75/1123693175.db2.gz QHXFEIUWGHVWRD-LBPRGKRZSA-N 1 1 289.810 3.652 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCCC(F)(F)CC2)cc1 ZINC000859537924 1123701164 /nfs/dbraw/zinc/70/11/64/1123701164.db2.gz SGQZESLCUHRJMX-UHFFFAOYSA-N 1 1 282.378 3.764 20 10 CHCDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000763645023 1129148678 /nfs/dbraw/zinc/14/86/78/1129148678.db2.gz DDXOEBBDALWQIF-CQSZACIVSA-N 1 1 258.409 3.517 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@](C)(O)CC2)cc1C(C)C ZINC000794664286 1123923499 /nfs/dbraw/zinc/92/34/99/1123923499.db2.gz CJGPPGQYZRSFJR-GOSISDBHSA-N 1 1 291.435 3.561 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c1O ZINC000794684945 1123927498 /nfs/dbraw/zinc/92/74/98/1123927498.db2.gz KKWHZTJELVSDSQ-AWEZNQCLSA-N 1 1 277.408 3.720 20 10 CHCDMO Cc1cc(N(C)C)ccc1CNc1[nH]c2ccccc2[nH+]1 ZINC000301861388 1123939232 /nfs/dbraw/zinc/93/92/32/1123939232.db2.gz FWMLVHIASKOCGD-UHFFFAOYSA-N 1 1 280.375 3.549 20 10 CHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)c2csnn2)c1O ZINC000840886143 1123997516 /nfs/dbraw/zinc/99/75/16/1123997516.db2.gz PLTHLMVMKTZCTN-RKDXNWHRSA-N 1 1 297.811 3.617 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2cc(F)cc(F)c2O)s1 ZINC000866455492 1124068095 /nfs/dbraw/zinc/06/80/95/1124068095.db2.gz MEGZFQVWVJUKTN-YUMQZZPRSA-N 1 1 298.358 3.847 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)s1 ZINC000866455263 1124068290 /nfs/dbraw/zinc/06/82/90/1124068290.db2.gz LDLCEKRXFWNIDB-BDAKNGLRSA-N 1 1 280.368 3.708 20 10 CHCDMO C[C@@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866622559 1124091476 /nfs/dbraw/zinc/09/14/76/1124091476.db2.gz GVRUKCPRKPCPCP-WBMJQRKESA-N 1 1 293.382 3.674 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC4(CCC4)C3)c2c1 ZINC000121863788 1124104048 /nfs/dbraw/zinc/10/40/48/1124104048.db2.gz GFGAHSLHVACPGF-UHFFFAOYSA-N 1 1 297.398 3.930 20 10 CHCDMO CC(C)[N@@H+](CCOC1CCC1)Cc1ccc(N(C)C)cc1 ZINC000805732258 1131260018 /nfs/dbraw/zinc/26/00/18/1131260018.db2.gz FLHOBXQNZCROGF-UHFFFAOYSA-N 1 1 290.451 3.532 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(N)cc2)s1 ZINC001120263178 1131273617 /nfs/dbraw/zinc/27/36/17/1131273617.db2.gz LMCVIQYCFDRSCH-LLVKDONJSA-N 1 1 275.421 3.535 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872259635 1124699560 /nfs/dbraw/zinc/69/95/60/1124699560.db2.gz ZLCPRBVJJWNQQC-INIZCTEOSA-N 1 1 289.419 3.624 20 10 CHCDMO CCCC[N@@H+](CCOC1CCC1)Cc1ccccc1O ZINC000805756215 1131309461 /nfs/dbraw/zinc/30/94/61/1131309461.db2.gz VKXDPNCBMXDYEN-UHFFFAOYSA-N 1 1 277.408 3.563 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CC2CCOCC2)cc1C(C)C ZINC000124649319 1124804093 /nfs/dbraw/zinc/80/40/93/1124804093.db2.gz RXENWNYPBQVVKY-UHFFFAOYSA-N 1 1 291.435 3.682 20 10 CHCDMO Cc1cccc(O)c1C[N@H+](Cc1ccccn1)C(C)C ZINC000876624414 1124967014 /nfs/dbraw/zinc/96/70/14/1124967014.db2.gz LWQKSANCHUIIDP-UHFFFAOYSA-N 1 1 270.376 3.506 20 10 CHCDMO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1O ZINC000879649280 1125222648 /nfs/dbraw/zinc/22/26/48/1125222648.db2.gz OZNURMAOXFPTBR-LLVKDONJSA-N 1 1 274.364 3.529 20 10 CHCDMO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879652373 1125224537 /nfs/dbraw/zinc/22/45/37/1125224537.db2.gz ZJBURHNUOVDKLC-RYUDHWBXSA-N 1 1 289.379 3.530 20 10 CHCDMO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882879787 1125359994 /nfs/dbraw/zinc/35/99/94/1125359994.db2.gz MRSSXGXCIUIXPS-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000882935646 1125362515 /nfs/dbraw/zinc/36/25/15/1125362515.db2.gz YHSDVOWEYLXSFN-OAHLLOKOSA-N 1 1 293.288 3.587 20 10 CHCDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1cccs1 ZINC000883007873 1125367376 /nfs/dbraw/zinc/36/73/76/1125367376.db2.gz JRHNXIMWEKHKFA-UHFFFAOYSA-N 1 1 283.343 3.757 20 10 CHCDMO COc1ccc(O)c(CNc2cccc3cc[nH+]cc32)c1 ZINC000131459315 1125392683 /nfs/dbraw/zinc/39/26/83/1125392683.db2.gz GQLTUTREOSDJHE-UHFFFAOYSA-N 1 1 280.327 3.561 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)[C@H]1CCCOC1 ZINC000883353286 1125400297 /nfs/dbraw/zinc/40/02/97/1125400297.db2.gz ROCJJEFFUDVLAS-HUBLWGQQSA-N 1 1 297.826 3.901 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCC[C@]12CCCO2)c1ccc(F)cc1O ZINC000883368809 1125403101 /nfs/dbraw/zinc/40/31/01/1125403101.db2.gz BVGCNCACEGNHKC-OIISXLGYSA-N 1 1 293.382 3.674 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)C2CCCCC2)c1O ZINC000131745937 1125409710 /nfs/dbraw/zinc/40/97/10/1125409710.db2.gz JYCREZMNDVZKEP-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1cc(C[N@H+]2CCC(F)(F)C(C)(C)C2)ccc1N(C)C ZINC001139669611 1131353343 /nfs/dbraw/zinc/35/33/43/1131353343.db2.gz DHTVSOZAHZZLEN-UHFFFAOYSA-N 1 1 296.405 3.928 20 10 CHCDMO Cc1cc(C[N@@H+]2CCCC[C@@H](C)C2)ccc1N(C)C ZINC001139670016 1131357901 /nfs/dbraw/zinc/35/79/01/1131357901.db2.gz VJMMVYGTRPCZQI-CQSZACIVSA-N 1 1 260.425 3.683 20 10 CHCDMO CCCCC[N@@H+](Cc1cc(OC)ccc1O)C(C)C ZINC000133252951 1125440441 /nfs/dbraw/zinc/44/04/41/1125440441.db2.gz DOIDLIIUTKYTSF-UHFFFAOYSA-N 1 1 265.397 3.801 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001237938058 1129221846 /nfs/dbraw/zinc/22/18/46/1129221846.db2.gz XGRBGPAXZAJYIQ-QMMMGPOBSA-N 1 1 293.716 3.662 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001237938058 1129221848 /nfs/dbraw/zinc/22/18/48/1129221848.db2.gz XGRBGPAXZAJYIQ-QMMMGPOBSA-N 1 1 293.716 3.662 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1cc(Cl)ccc1O ZINC000092438600 1129394118 /nfs/dbraw/zinc/39/41/18/1129394118.db2.gz KVGICGLQBMPRNZ-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO COc1cc(C[N@H+]2CCC=C(c3ccco3)C2)c(O)cc1C ZINC000795652311 1129407336 /nfs/dbraw/zinc/40/73/36/1129407336.db2.gz XHNFWQQSOJZSJY-UHFFFAOYSA-N 1 1 299.370 3.592 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(C)s2)c1O ZINC000093049329 1129415911 /nfs/dbraw/zinc/41/59/11/1129415911.db2.gz JWHICDQJFVRYGC-UHFFFAOYSA-N 1 1 291.416 3.793 20 10 CHCDMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000740860283 1129420724 /nfs/dbraw/zinc/42/07/24/1129420724.db2.gz CMXMZNZOJUXAMD-RYUDHWBXSA-N 1 1 277.408 3.626 20 10 CHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC2(CCC2)C1 ZINC000093455757 1129423530 /nfs/dbraw/zinc/42/35/30/1129423530.db2.gz IOCMZJWVHKFREG-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccccc2)cc1 ZINC000741752891 1129451219 /nfs/dbraw/zinc/45/12/19/1129451219.db2.gz HJOBVLXTEVTKRO-UHFFFAOYSA-N 1 1 268.404 3.775 20 10 CHCDMO CCC[N@@H+](CC[C@@H](O)c1ccccc1)Cc1ccccc1O ZINC000795927850 1129457111 /nfs/dbraw/zinc/45/71/11/1129457111.db2.gz ZSOOJUPQFJKNNK-LJQANCHMSA-N 1 1 299.414 3.728 20 10 CHCDMO C[N@@H+](CCc1cccs1)Cc1cc2c(cc1O)CCC2 ZINC000743382258 1129521934 /nfs/dbraw/zinc/52/19/34/1129521934.db2.gz NDASBPUSLFLTSK-UHFFFAOYSA-N 1 1 287.428 3.617 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCOC[C@H]2c2ccccc2)cc1C ZINC000743407386 1129523285 /nfs/dbraw/zinc/52/32/85/1129523285.db2.gz WWCASOZYBRCWQM-SFHVURJKSA-N 1 1 297.398 3.583 20 10 CHCDMO CCCC[N@@H+](CCC[C@@H]1CCOC1)Cc1ccccc1O ZINC000828470294 1131386787 /nfs/dbraw/zinc/38/67/87/1131386787.db2.gz ZMKMDRVRMOXFOS-MRXNPFEDSA-N 1 1 291.435 3.811 20 10 CHCDMO C[C@H]([NH2+]Cc1ccon1)c1ccc(N2CCCCC2)cc1 ZINC000766419906 1129664485 /nfs/dbraw/zinc/66/44/85/1129664485.db2.gz GEHOBEKPECWNBH-AWEZNQCLSA-N 1 1 285.391 3.516 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)CC12CC(C)(C1)OC2 ZINC001169753666 1129752546 /nfs/dbraw/zinc/75/25/46/1129752546.db2.gz ASSSVBUXOSDRTF-UHFFFAOYSA-N 1 1 289.419 3.563 20 10 CHCDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768137146 1129835015 /nfs/dbraw/zinc/83/50/15/1129835015.db2.gz GQUWFNUBPORBRV-CQSZACIVSA-N 1 1 260.425 3.762 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)cc1 ZINC000768129994 1129835233 /nfs/dbraw/zinc/83/52/33/1129835233.db2.gz MEIUWCMWCHJPSO-HNNXBMFYSA-N 1 1 258.409 3.541 20 10 CHCDMO CC(C)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000768141267 1129835865 /nfs/dbraw/zinc/83/58/65/1129835865.db2.gz UPADBVRUTPAGSS-UHFFFAOYSA-N 1 1 255.361 3.899 20 10 CHCDMO CCOc1ccc(C[N@@H+](CC)Cc2ccccc2)c(O)c1 ZINC000768140802 1129836506 /nfs/dbraw/zinc/83/65/06/1129836506.db2.gz KYZDHKREBKRSSR-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2F)c(O)c1 ZINC000768171256 1129839403 /nfs/dbraw/zinc/83/94/03/1129839403.db2.gz AIYOYTAWJRHBIW-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccn(C)c2)cc1 ZINC000768207403 1129840047 /nfs/dbraw/zinc/84/00/47/1129840047.db2.gz HUHKZYYOBLQKIH-UHFFFAOYSA-N 1 1 285.435 3.503 20 10 CHCDMO COc1cccc(O)c1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000768197844 1129843852 /nfs/dbraw/zinc/84/38/52/1129843852.db2.gz XYNFUCKHVDLRPG-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](Cc1cccs1)C1CC1 ZINC000768253021 1129847616 /nfs/dbraw/zinc/84/76/16/1129847616.db2.gz VJFLHUQDGKUGLG-UHFFFAOYSA-N 1 1 289.400 3.627 20 10 CHCDMO CCCC[N@@H+](Cc1c(O)cccc1Cl)C1CC1 ZINC000768291948 1129850050 /nfs/dbraw/zinc/85/00/50/1129850050.db2.gz SEHYONBKZIOMCW-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000768338012 1129852115 /nfs/dbraw/zinc/85/21/15/1129852115.db2.gz KTTRGPBLWQSLLM-OAHLLOKOSA-N 1 1 260.425 3.907 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000768360214 1129853813 /nfs/dbraw/zinc/85/38/13/1129853813.db2.gz LEYMMPBUIZNXCM-KRWDZBQOSA-N 1 1 298.386 3.523 20 10 CHCDMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000768420761 1129858101 /nfs/dbraw/zinc/85/81/01/1129858101.db2.gz HYVGCLGUGYXRSW-HNNXBMFYSA-N 1 1 272.436 3.907 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1cc(OC)c(C)cc1O ZINC000768463781 1129858771 /nfs/dbraw/zinc/85/87/71/1129858771.db2.gz MEVIZCVRIMRJFH-GFCCVEGCSA-N 1 1 265.397 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GYJLSXKQXNQORD-ZBFHGGJFSA-N 1 1 259.393 3.855 20 10 CHCDMO Cc1cc2c(cn1)C[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001233287011 1132595256 /nfs/dbraw/zinc/59/52/56/1132595256.db2.gz SAAPVBKZBUQUNL-UHFFFAOYSA-N 1 1 296.414 3.909 20 10 CHCDMO Cc1cc2c(cn1)C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001233287011 1132595260 /nfs/dbraw/zinc/59/52/60/1132595260.db2.gz SAAPVBKZBUQUNL-UHFFFAOYSA-N 1 1 296.414 3.909 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233287327 1132596821 /nfs/dbraw/zinc/59/68/21/1132596821.db2.gz JWNXQIKYOJFMIL-CYBMUJFWSA-N 1 1 261.409 3.922 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001233287314 1132597622 /nfs/dbraw/zinc/59/76/22/1132597622.db2.gz IMQRKLMTPSFJAT-CQSZACIVSA-N 1 1 265.372 3.624 20 10 CHCDMO CC[N@@H+](Cc1ccc(Cl)o1)Cc1ccccc1O ZINC001233316909 1132599523 /nfs/dbraw/zinc/59/95/23/1132599523.db2.gz KUZCDMIAKJIZBV-UHFFFAOYSA-N 1 1 265.740 3.661 20 10 CHCDMO CCC[N@H+](Cc1c(O)ccc(F)c1F)[C@H](C)CC ZINC001233331601 1132604172 /nfs/dbraw/zinc/60/41/72/1132604172.db2.gz CSUMGBJUPPLCDC-SNVBAGLBSA-N 1 1 257.324 3.681 20 10 CHCDMO CCC[N@@H+](Cc1c(O)ccc(F)c1F)[C@H](C)CC ZINC001233331601 1132604175 /nfs/dbraw/zinc/60/41/75/1132604175.db2.gz CSUMGBJUPPLCDC-SNVBAGLBSA-N 1 1 257.324 3.681 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C2(CC2)C1 ZINC001233455191 1132624501 /nfs/dbraw/zinc/62/45/01/1132624501.db2.gz ACUHRMLCZPTYKU-SNVBAGLBSA-N 1 1 285.309 3.785 20 10 CHCDMO Nc1ccc(N(c2cc[nH+]cc2)c2ccc(N)cc2)cc1 ZINC001173884900 1132624993 /nfs/dbraw/zinc/62/49/93/1132624993.db2.gz XHKFFVWAASZWDV-UHFFFAOYSA-N 1 1 276.343 3.716 20 10 CHCDMO CCN(Cc1ccccc1O)c1ccc2c([nH+]1)CCCC2 ZINC001154889705 1132631466 /nfs/dbraw/zinc/63/14/66/1132631466.db2.gz FOJGYDHYPLDYDV-UHFFFAOYSA-N 1 1 282.387 3.693 20 10 CHCDMO CC1CC([N@@H+](C)Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233728708 1132671709 /nfs/dbraw/zinc/67/17/09/1132671709.db2.gz YZSALMRSMRODGS-UHFFFAOYSA-N 1 1 289.297 3.521 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C(C)C)C2)c(Cl)c1 ZINC001204390149 1133217806 /nfs/dbraw/zinc/21/78/06/1133217806.db2.gz RDXCFJXRJUMRCA-LBPRGKRZSA-N 1 1 267.800 3.832 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C(C)C)C2)c(Cl)c1 ZINC001204390147 1133218556 /nfs/dbraw/zinc/21/85/56/1133218556.db2.gz RDXCFJXRJUMRCA-GFCCVEGCSA-N 1 1 267.800 3.832 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000252762319 1133230662 /nfs/dbraw/zinc/23/06/62/1133230662.db2.gz DMFUWUXQINBIRE-OLZOCXBDSA-N 1 1 263.356 3.543 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000252762319 1133230669 /nfs/dbraw/zinc/23/06/69/1133230669.db2.gz DMFUWUXQINBIRE-OLZOCXBDSA-N 1 1 263.356 3.543 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001203312461 1133313727 /nfs/dbraw/zinc/31/37/27/1133313727.db2.gz FPIXCESLMOAYLN-UHFFFAOYSA-N 1 1 280.415 3.919 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1cccc(OC)c1O ZINC001203596632 1133343733 /nfs/dbraw/zinc/34/37/33/1133343733.db2.gz MOSHUPXMTMPWSU-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)CCc2ccc(C)cc2)c1O ZINC001203609413 1133344275 /nfs/dbraw/zinc/34/42/75/1133344275.db2.gz RTCLFJZYVILRJX-UHFFFAOYSA-N 1 1 299.414 3.774 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001203657423 1133349054 /nfs/dbraw/zinc/34/90/54/1133349054.db2.gz KWPGIFOOWDZPCE-SECBINFHSA-N 1 1 275.726 3.523 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)C/C=C/c2ccccc2)c1 ZINC001203680306 1133353077 /nfs/dbraw/zinc/35/30/77/1133353077.db2.gz NXUXPVCBOFQGBW-RMKNXTFCSA-N 1 1 283.371 3.546 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1O ZINC001203875557 1133378017 /nfs/dbraw/zinc/37/80/17/1133378017.db2.gz PVTUVOSCZUGPRM-HNNXBMFYSA-N 1 1 287.334 3.574 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203933697 1133386028 /nfs/dbraw/zinc/38/60/28/1133386028.db2.gz GIYGQLGFHGMLOQ-KRWDZBQOSA-N 1 1 260.425 3.907 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC001203934099 1133386207 /nfs/dbraw/zinc/38/62/07/1133386207.db2.gz MFDOHRLWFZSINE-IBGZPJMESA-N 1 1 294.442 3.817 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](CF)C2)cc1 ZINC001203939842 1133386265 /nfs/dbraw/zinc/38/62/65/1133386265.db2.gz WSJUEKWYRJGLLP-INIZCTEOSA-N 1 1 278.415 3.714 20 10 CHCDMO CCCO[C@@H]1CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC001203939011 1133386400 /nfs/dbraw/zinc/38/64/00/1133386400.db2.gz IRTIUJMRSLYUTP-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO CCc1ccc(C[N@H+](CC)Cc2ccccc2O)cc1 ZINC001204178423 1133416132 /nfs/dbraw/zinc/41/61/32/1133416132.db2.gz QDPYUZNAQJNDKD-UHFFFAOYSA-N 1 1 269.388 3.977 20 10 CHCDMO CCC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001204228932 1133423041 /nfs/dbraw/zinc/42/30/41/1133423041.db2.gz CKNLSJUGORDVAA-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001204275058 1133426657 /nfs/dbraw/zinc/42/66/57/1133426657.db2.gz MYZWFCWWSXJTCX-INIZCTEOSA-N 1 1 297.398 3.553 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2C2CCCCC2)c(O)c1 ZINC001204281501 1133428762 /nfs/dbraw/zinc/42/87/62/1133428762.db2.gz SEGTYJJOWQWMLB-MRXNPFEDSA-N 1 1 275.392 3.643 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324951 1133438423 /nfs/dbraw/zinc/43/84/23/1133438423.db2.gz PQNVKNAJYDXEAZ-INIZCTEOSA-N 1 1 272.436 3.909 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001204887940 1133496405 /nfs/dbraw/zinc/49/64/05/1133496405.db2.gz CRDDQXWSOWFBGJ-YJBOKZPZSA-N 1 1 272.436 3.826 20 10 CHCDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001204961964 1133508450 /nfs/dbraw/zinc/50/84/50/1133508450.db2.gz YFSOGHVOCKUOSA-IMJJTQAJSA-N 1 1 259.393 3.711 20 10 CHCDMO COc1cc(C)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c(O)c1 ZINC001205185051 1133543259 /nfs/dbraw/zinc/54/32/59/1133543259.db2.gz JFNHCXQBSPKPQD-SFHVURJKSA-N 1 1 297.398 3.829 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001205489427 1133583072 /nfs/dbraw/zinc/58/30/72/1133583072.db2.gz QGWQXIDOALEZCZ-ZNUVNQELSA-N 1 1 272.436 3.886 20 10 CHCDMO Cc1ccoc1C[N@H+](C)Cc1ccc(Cl)cc1O ZINC001205997650 1133640213 /nfs/dbraw/zinc/64/02/13/1133640213.db2.gz CDVPQMAREPTQNP-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO CCC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C(C)C ZINC001206464713 1133705450 /nfs/dbraw/zinc/70/54/50/1133705450.db2.gz VGNBGRYHCVEBOV-BQYQJAHWSA-N 1 1 260.425 3.886 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccc(C)cc1OC ZINC001206783197 1133747895 /nfs/dbraw/zinc/74/78/95/1133747895.db2.gz VVZJMSZVOTVAFY-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC[N@@H+](CCc1c(F)cccc1F)Cc1ccccc1O ZINC001208116948 1133878814 /nfs/dbraw/zinc/87/88/14/1133878814.db2.gz MZCSAKJRPBWXFZ-UHFFFAOYSA-N 1 1 291.341 3.735 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000166371181 1133917661 /nfs/dbraw/zinc/91/76/61/1133917661.db2.gz NKBZERYUKXVGLD-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000166371181 1133917662 /nfs/dbraw/zinc/91/76/62/1133917662.db2.gz NKBZERYUKXVGLD-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+](C)[C@@H]2CCCOC2)cc1 ZINC001209520284 1134033965 /nfs/dbraw/zinc/03/39/65/1134033965.db2.gz UIVREQOCACGFHY-LJQANCHMSA-N 1 1 298.430 3.705 20 10 CHCDMO COC[C@H]1CCC[N@H+]1Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209517791 1134034256 /nfs/dbraw/zinc/03/42/56/1134034256.db2.gz GSWFOQRMFIGOAW-LJQANCHMSA-N 1 1 298.430 3.705 20 10 CHCDMO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000186157586 262082817 /nfs/dbraw/zinc/08/28/17/262082817.db2.gz YJLOKVHBYATIMS-VHSXEESVSA-N 1 1 292.354 3.590 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc(C)on2)cc1 ZINC000282689653 328243177 /nfs/dbraw/zinc/24/31/77/328243177.db2.gz NZHOBXRMYYYCJI-AWEZNQCLSA-N 1 1 287.407 3.680 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1O ZINC000291532409 328264664 /nfs/dbraw/zinc/26/46/64/328264664.db2.gz KJJKKWYCYXRZPQ-QGZVFWFLSA-N 1 1 287.403 3.555 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCSC(C)(C)CC2)c1O ZINC000279513230 521341696 /nfs/dbraw/zinc/34/16/96/521341696.db2.gz XKTIQVOAJKDVEH-UHFFFAOYSA-N 1 1 295.448 3.508 20 10 CHCDMO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062747656 521370761 /nfs/dbraw/zinc/37/07/61/521370761.db2.gz WBDZKXJLZNOFNZ-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[N@H+](Cc1nc(C)cs1)Cc1ccc(N(C)C)cc1 ZINC000129325166 521449122 /nfs/dbraw/zinc/44/91/22/521449122.db2.gz VPYVXNUGIAUIDE-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CC[N@@H+](Cc1nc(C)cs1)Cc1ccc(N(C)C)cc1 ZINC000129325166 521449127 /nfs/dbraw/zinc/44/91/27/521449127.db2.gz VPYVXNUGIAUIDE-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](c3ccncc3)C2)cc1 ZINC000296047782 522176455 /nfs/dbraw/zinc/17/64/55/522176455.db2.gz TWGRUOZOUYLELO-SFHVURJKSA-N 1 1 295.430 3.527 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000062744931 524605515 /nfs/dbraw/zinc/60/55/15/524605515.db2.gz PMSUUIQUVCCWPE-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000278631678 525688299 /nfs/dbraw/zinc/68/82/99/525688299.db2.gz HAAVQWVGNYHIBF-SFYZADRCSA-N 1 1 292.231 3.855 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC(C)C)C(C)C)c1O ZINC000133522364 1125467701 /nfs/dbraw/zinc/46/77/01/1125467701.db2.gz PXWHOFFMVVWSFP-UHFFFAOYSA-N 1 1 265.397 3.657 20 10 CHCDMO CCCCc1nc(C[N@H+](C)Cc2ccccc2O)cs1 ZINC000109771147 1125469062 /nfs/dbraw/zinc/46/90/62/1125469062.db2.gz ZCIINKBRROJVAA-UHFFFAOYSA-N 1 1 290.432 3.823 20 10 CHCDMO CCCCc1nc(C[N@@H+](C)Cc2ccccc2O)cs1 ZINC000109771147 1125469068 /nfs/dbraw/zinc/46/90/68/1125469068.db2.gz ZCIINKBRROJVAA-UHFFFAOYSA-N 1 1 290.432 3.823 20 10 CHCDMO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1ccccc1O ZINC000109772069 1125469267 /nfs/dbraw/zinc/46/92/67/1125469267.db2.gz VOUDGHJIVLBXBC-LBPRGKRZSA-N 1 1 259.324 3.724 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](C)C(C)C ZINC001167241050 1118115486 /nfs/dbraw/zinc/11/54/86/1118115486.db2.gz OQZMSTRJLBEVPT-HNNXBMFYSA-N 1 1 262.441 3.927 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1[O-])[C@@H](C)C(C)C ZINC000706462936 1121429431 /nfs/dbraw/zinc/42/94/31/1121429431.db2.gz ZRFMYNKJUYBLDT-NSHDSACASA-N 1 1 281.371 3.600 20 10 CHCDMO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@@H](C)C(C)C ZINC000706462936 1121429435 /nfs/dbraw/zinc/42/94/35/1121429435.db2.gz ZRFMYNKJUYBLDT-NSHDSACASA-N 1 1 281.371 3.600 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@@H](C)C(C)C ZINC000706462936 1121429437 /nfs/dbraw/zinc/42/94/37/1121429437.db2.gz ZRFMYNKJUYBLDT-NSHDSACASA-N 1 1 281.371 3.600 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138386514 1131497404 /nfs/dbraw/zinc/49/74/04/1131497404.db2.gz PGXPDUWBWSKLGH-AWEZNQCLSA-N 1 1 278.440 3.772 20 10 CHCDMO CCC[N@@H+](Cc1ccc(Cl)cc1O)CC1CC1 ZINC001140461707 1131748340 /nfs/dbraw/zinc/74/83/40/1131748340.db2.gz RKFFHTHMXXYCPD-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO CCC[N@H+](Cc1ccc(Cl)cc1O)CC1CC1 ZINC001140461707 1131748344 /nfs/dbraw/zinc/74/83/44/1131748344.db2.gz RKFFHTHMXXYCPD-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140921961 1131964118 /nfs/dbraw/zinc/96/41/18/1131964118.db2.gz YGYYFJSRKHBJLI-GFCCVEGCSA-N 1 1 266.816 3.638 20 10 CHCDMO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841748612 1132389736 /nfs/dbraw/zinc/38/97/36/1132389736.db2.gz AWSHHWHUJGMGIX-MNOVXSKESA-N 1 1 285.815 3.900 20 10 CHCDMO C[C@H](C[C@H]1CCOC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841760715 1132394144 /nfs/dbraw/zinc/39/41/44/1132394144.db2.gz UJVPJNKERJKOPP-GRYCIOLGSA-N 1 1 283.799 3.511 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2O)[C@H]1C ZINC001205470637 1133580602 /nfs/dbraw/zinc/58/06/02/1133580602.db2.gz BEHYKYJAGMWUDP-WDEREUQCSA-N 1 1 298.224 3.775 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1OC ZINC000215914330 1125581923 /nfs/dbraw/zinc/58/19/23/1125581923.db2.gz WEDHLWQYSPEESN-UHFFFAOYSA-N 1 1 298.430 3.783 20 10 CHCDMO CCOC1CC(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)C1 ZINC000841752230 1125585005 /nfs/dbraw/zinc/58/50/05/1125585005.db2.gz NJOMQCHVMUDPNJ-DCBWTQNWSA-N 1 1 297.826 3.901 20 10 CHCDMO C[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccc(Cl)cc1O ZINC000841756640 1125593540 /nfs/dbraw/zinc/59/35/40/1125593540.db2.gz ZIPQPPXILXGHDY-KNXALSJPSA-N 1 1 297.826 3.637 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841758081 1125597830 /nfs/dbraw/zinc/59/78/30/1125597830.db2.gz RYVCPIDMEFWMAN-WDEREUQCSA-N 1 1 285.840 3.839 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000246942446 1125651354 /nfs/dbraw/zinc/65/13/54/1125651354.db2.gz LORYEGKHNWUYEZ-KXBFYZLASA-N 1 1 297.398 3.546 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1F ZINC000886495221 1125680639 /nfs/dbraw/zinc/68/06/39/1125680639.db2.gz NQNBLSUKXDTDBO-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccncc1 ZINC000886532784 1125685513 /nfs/dbraw/zinc/68/55/13/1125685513.db2.gz OUJLUUIKPDOWKL-BXUZGUMPSA-N 1 1 274.339 3.728 20 10 CHCDMO COCCC1(C[NH2+][C@H](C)c2c(O)cccc2F)CCCC1 ZINC000886540971 1125687627 /nfs/dbraw/zinc/68/76/27/1125687627.db2.gz 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271.763 3.663 20 10 CHCDMO CC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000286047302 1127256318 /nfs/dbraw/zinc/25/63/18/1127256318.db2.gz KBBKOTALXYYLCR-DZGCQCFKSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000286202298 1127262472 /nfs/dbraw/zinc/26/24/72/1127262472.db2.gz RKKXCYLQEOIEMH-HZUKXOBISA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000286202304 1127262508 /nfs/dbraw/zinc/26/25/08/1127262508.db2.gz RKKXCYLQEOIEMH-WPGHFRTFSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@H]([NH2+]Cc1cnc(C)s1)c1ccc(F)cc1O ZINC000286232658 1127263580 /nfs/dbraw/zinc/26/35/80/1127263580.db2.gz SWJAUKVQADSSMA-ZDUSSCGKSA-N 1 1 280.368 3.537 20 10 CHCDMO Cc1cccc(CCC[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000287654274 1127311985 /nfs/dbraw/zinc/31/19/85/1127311985.db2.gz VCMSJVHDEDOTTO-ZDUSSCGKSA-N 1 1 288.366 3.518 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001237934139 1129219682 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ZINC000072629620 1117782524 /nfs/dbraw/zinc/78/25/24/1117782524.db2.gz UMHSCKGLBIKFBV-AWEZNQCLSA-N 1 1 255.361 3.894 20 10 CHCDMO CC(C)C1(C[NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000186099823 1117992593 /nfs/dbraw/zinc/99/25/93/1117992593.db2.gz DGWWIQUWOUVQQB-LLVKDONJSA-N 1 1 251.345 3.618 20 10 CHCDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1O ZINC000179576738 1128749804 /nfs/dbraw/zinc/74/98/04/1128749804.db2.gz YLCRFNSYHOGBER-YOEHRIQHSA-N 1 1 267.372 3.770 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000179677390 1128753255 /nfs/dbraw/zinc/75/32/55/1128753255.db2.gz AZXBLSXJRPORSC-LBPRGKRZSA-N 1 1 289.350 3.733 20 10 CHCDMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC001650660159 1118081955 /nfs/dbraw/zinc/08/19/55/1118081955.db2.gz YUYWNXUADZXHLY-LLVKDONJSA-N 1 1 293.411 3.507 20 10 CHCDMO CC[C@H](NCCC[N@H+](C)C(C)C)c1ccc(N(C)C)cc1 ZINC000764806230 1118116963 /nfs/dbraw/zinc/11/69/63/1118116963.db2.gz LRAIIWWTSJXPMW-SFHVURJKSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H](NCCC[N@@H+](C)C(C)C)c1ccc(N(C)C)cc1 ZINC000764806230 1118116964 /nfs/dbraw/zinc/11/69/64/1118116964.db2.gz LRAIIWWTSJXPMW-SFHVURJKSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(C)nc2)cc1 ZINC000765567445 1118171405 /nfs/dbraw/zinc/17/14/05/1118171405.db2.gz UGOILNBZDZSMGX-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NCC[N@H+](CC)C(C)C)cc1 ZINC000765626841 1118184558 /nfs/dbraw/zinc/18/45/58/1118184558.db2.gz DGNGROLLNDLBNP-MRXNPFEDSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NCC[N@@H+](CC)C(C)C)cc1 ZINC000765626841 1118184560 /nfs/dbraw/zinc/18/45/60/1118184560.db2.gz DGNGROLLNDLBNP-MRXNPFEDSA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC3(CCCC3)C2)c1O ZINC001140182537 1118250893 /nfs/dbraw/zinc/25/08/93/1118250893.db2.gz UQPSQNJDGCKSHN-UHFFFAOYSA-N 1 1 259.393 3.775 20 10 CHCDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cc(F)ccc1O ZINC000179923913 1128768056 /nfs/dbraw/zinc/76/80/56/1128768056.db2.gz PMDIKLARWABSRG-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179955136 1128769040 /nfs/dbraw/zinc/76/90/40/1128769040.db2.gz FFHPLQQEPSKFCA-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2O)s1 ZINC000180068041 1128774042 /nfs/dbraw/zinc/77/40/42/1128774042.db2.gz LUGDDYZISKKPNF-UHFFFAOYSA-N 1 1 265.353 3.533 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(OC)cc1O ZINC000213659444 1118817685 /nfs/dbraw/zinc/81/76/85/1118817685.db2.gz ISHDOSVEVVBIOQ-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccccc1O ZINC000181171262 1128841146 /nfs/dbraw/zinc/84/11/46/1128841146.db2.gz ZPEUKKCVZVFEMP-GFCCVEGCSA-N 1 1 282.343 3.726 20 10 CHCDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000179557081 1119751821 /nfs/dbraw/zinc/75/18/21/1119751821.db2.gz BUSWAMKOELKSDA-AWEZNQCLSA-N 1 1 255.361 3.894 20 10 CHCDMO CCSCC[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168807595 1120096864 /nfs/dbraw/zinc/09/68/64/1120096864.db2.gz ISRPPBGPGPUQNW-WDEREUQCSA-N 1 1 271.401 3.714 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccc(F)cc1O ZINC000311847010 1120113200 /nfs/dbraw/zinc/11/32/00/1120113200.db2.gz ILKOZAQZFKUGPM-ZIULKBFBSA-N 1 1 263.356 3.761 20 10 CHCDMO Cc1ccc(N[C@@H](C)c2cc(F)cc(F)c2[O-])c(C)n1 ZINC001116588466 1120165336 /nfs/dbraw/zinc/16/53/36/1120165336.db2.gz GOILCAUVCHTKBR-VIFPVBQESA-N 1 1 278.302 3.855 20 10 CHCDMO CCCC[C@H](C)[N@@H+](C)Cc1cccc(OCC)c1O ZINC000311996827 1120210410 /nfs/dbraw/zinc/21/04/10/1120210410.db2.gz QXDYEXSGASYBRF-ZDUSSCGKSA-N 1 1 265.397 3.801 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1O ZINC000180488833 1120276018 /nfs/dbraw/zinc/27/60/18/1120276018.db2.gz ARAMZQRRWCLZAR-SFHVURJKSA-N 1 1 296.414 3.777 20 10 CHCDMO CC[N@H+](Cc1c(O)ccc2ccccc21)CC1CC1 ZINC000069797430 1128908736 /nfs/dbraw/zinc/90/87/36/1128908736.db2.gz NUVRONPMBWVVAL-UHFFFAOYSA-N 1 1 255.361 3.777 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccccc1O ZINC000397992201 1120543434 /nfs/dbraw/zinc/54/34/34/1120543434.db2.gz AVVMLQRTJCJWMC-AAEUAGOBSA-N 1 1 255.308 3.621 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000922843069 1120609763 /nfs/dbraw/zinc/60/97/63/1120609763.db2.gz OXYDOVWFFMHXDX-GFCCVEGCSA-N 1 1 299.386 3.578 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000228003364 1120663055 /nfs/dbraw/zinc/66/30/55/1120663055.db2.gz RVJDREZTZXEXRJ-SWLSCSKDSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000228003364 1120663057 /nfs/dbraw/zinc/66/30/57/1120663057.db2.gz RVJDREZTZXEXRJ-SWLSCSKDSA-N 1 1 263.356 3.686 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](C)C1CC1)c1ccc(F)cc1O ZINC000796722053 1120674545 /nfs/dbraw/zinc/67/45/45/1120674545.db2.gz YQOVJYFESUCGMM-QMTHXVAHSA-N 1 1 251.345 3.618 20 10 CHCDMO Cc1ccccc1CC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000094183084 1120980121 /nfs/dbraw/zinc/98/01/21/1120980121.db2.gz ZEHSJEIVRAUNAU-CYBMUJFWSA-N 1 1 273.351 3.733 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CC(C)(C)O1 ZINC000065224535 1121203453 /nfs/dbraw/zinc/20/34/53/1121203453.db2.gz FPWFSFMGJVHHCU-CYBMUJFWSA-N 1 1 285.387 3.545 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCC(F)(F)CC1 ZINC000702771530 1121212278 /nfs/dbraw/zinc/21/22/78/1121212278.db2.gz SSTCZNJNCZZHPF-UHFFFAOYSA-N 1 1 275.726 3.667 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000124513722 1121302438 /nfs/dbraw/zinc/30/24/38/1121302438.db2.gz KNWOWXNPUULPSH-JTQLQIEISA-N 1 1 293.716 3.820 20 10 CHCDMO CCC[N@@H+](Cc1nc2ccccc2o1)Cc1ccccc1O ZINC000727831072 1121751121 /nfs/dbraw/zinc/75/11/21/1121751121.db2.gz HAJGFFQHFYWCSE-UHFFFAOYSA-N 1 1 296.370 3.946 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccoc2C)cc1 ZINC000773746292 1121788191 /nfs/dbraw/zinc/78/81/91/1121788191.db2.gz JGYRCPQYHXNRNA-UHFFFAOYSA-N 1 1 272.392 3.676 20 10 CHCDMO CC1(C)C[C@@]1(C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001179468895 1121880748 /nfs/dbraw/zinc/88/07/48/1121880748.db2.gz SHDWWEOFNFLSKN-AWEZNQCLSA-N 1 1 271.763 3.711 20 10 CHCDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001179974145 1121931490 /nfs/dbraw/zinc/93/14/90/1121931490.db2.gz KIFNRMAJLXERPS-NSHDSACASA-N 1 1 253.773 3.524 20 10 CHCDMO CC[C@@H]1C[C@H](C)C[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001180203299 1121962467 /nfs/dbraw/zinc/96/24/67/1121962467.db2.gz OFHJXFDUKUCKMF-WWJLMDQWSA-N 1 1 272.436 3.886 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](OC)[C@H](C)CC ZINC001180194734 1121965685 /nfs/dbraw/zinc/96/56/85/1121965685.db2.gz MAEQHOWKZHSHKO-PBHICJAKSA-N 1 1 279.424 3.665 20 10 CHCDMO CC[N@@H+](CCC1CC1)Cc1cc(Cl)c(C)cc1O ZINC001180614214 1122000233 /nfs/dbraw/zinc/00/02/33/1122000233.db2.gz ZJIMLRFHWYOMBU-UHFFFAOYSA-N 1 1 267.800 3.976 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC001181696867 1122073164 /nfs/dbraw/zinc/07/31/64/1122073164.db2.gz CGZGADSWAFHUOH-QGZVFWFLSA-N 1 1 299.418 3.966 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c(O)c1 ZINC000779605575 1129032187 /nfs/dbraw/zinc/03/21/87/1129032187.db2.gz UUFJBDBYCLJZAK-CQSZACIVSA-N 1 1 289.419 3.803 20 10 CHCDMO C[C@H](C[C@H](C)O)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774355515 1122160428 /nfs/dbraw/zinc/16/04/28/1122160428.db2.gz TYZWQLPWYBDPQQ-HRDYMLBCSA-N 1 1 292.206 3.509 20 10 CHCDMO CCc1cccc(C[N@H+]2CCSC[C@@H]2C2CCC2)c1O ZINC001182463709 1122166921 /nfs/dbraw/zinc/16/69/21/1122166921.db2.gz WLFXXMMBRJFECK-MRXNPFEDSA-N 1 1 291.460 3.672 20 10 CHCDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccc(F)c1[O-] ZINC001205254345 1122206233 /nfs/dbraw/zinc/20/62/33/1122206233.db2.gz ZGJORNOSLBMNMM-MRXNPFEDSA-N 1 1 285.362 3.868 20 10 CHCDMO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(F)c1O ZINC001205254345 1122206239 /nfs/dbraw/zinc/20/62/39/1122206239.db2.gz ZGJORNOSLBMNMM-MRXNPFEDSA-N 1 1 285.362 3.868 20 10 CHCDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccc(F)c1O ZINC001205254345 1122206245 /nfs/dbraw/zinc/20/62/45/1122206245.db2.gz ZGJORNOSLBMNMM-MRXNPFEDSA-N 1 1 285.362 3.868 20 10 CHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623150 1122221377 /nfs/dbraw/zinc/22/13/77/1122221377.db2.gz ZFRNCQVXRZNZAU-LRDDRELGSA-N 1 1 270.376 3.561 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C/C=C\c1ccc(F)cc1)C2 ZINC001183454768 1122223896 /nfs/dbraw/zinc/22/38/96/1122223896.db2.gz NNLMGLKHRJQLJF-IHWYPQMZSA-N 1 1 269.319 3.560 20 10 CHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2)c1 ZINC000273422113 1122233030 /nfs/dbraw/zinc/23/30/30/1122233030.db2.gz SLMNPGIQBHLQER-CHWSQXEVSA-N 1 1 299.370 3.591 20 10 CHCDMO CC[C@H](C)C[C@H](CC)[NH2+]Cc1c(O)cccc1F ZINC001183920008 1122248011 /nfs/dbraw/zinc/24/80/11/1122248011.db2.gz SKOPYHSGBAIYLS-RYUDHWBXSA-N 1 1 253.361 3.836 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001203602260 1122302770 /nfs/dbraw/zinc/30/27/70/1122302770.db2.gz LSTGZLFKRPTXRI-UONOGXRCSA-N 1 1 277.408 3.659 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCC=CO2)cc1 ZINC000774820873 1122318105 /nfs/dbraw/zinc/31/81/05/1122318105.db2.gz IMCQTRRUZUPQCG-SFHVURJKSA-N 1 1 288.435 3.657 20 10 CHCDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000775206302 1122481376 /nfs/dbraw/zinc/48/13/76/1122481376.db2.gz MIDOSQAOPOCTQN-LBPRGKRZSA-N 1 1 291.391 3.522 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645539 1122654760 /nfs/dbraw/zinc/65/47/60/1122654760.db2.gz OJSPZLDCYYXLOD-GDBMZVCRSA-N 1 1 260.425 3.906 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3sccc3[C@@H]2C)c1 ZINC000775647673 1122861194 /nfs/dbraw/zinc/86/11/94/1122861194.db2.gz XWTQYEGNPKIIPW-NSHDSACASA-N 1 1 289.400 3.582 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1cccc(Cl)c1[O-] ZINC000775675300 1122894995 /nfs/dbraw/zinc/89/49/95/1122894995.db2.gz WPFVSZHZNYENTL-UHFFFAOYSA-N 1 1 265.740 3.661 20 10 CHCDMO Cc1cccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1O ZINC000775679294 1122901280 /nfs/dbraw/zinc/90/12/80/1122901280.db2.gz VTBMSPGXHUFOOA-GOSISDBHSA-N 1 1 297.398 3.664 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1O ZINC000775690580 1122911203 /nfs/dbraw/zinc/91/12/03/1122911203.db2.gz PQIAOWKWFNUTCJ-OAHLLOKOSA-N 1 1 285.362 3.829 20 10 CHCDMO Cc1cccc(C[N@H+]2CCO[C@H](c3ccccc3C)C2)c1O ZINC000775703139 1122915193 /nfs/dbraw/zinc/91/51/93/1122915193.db2.gz KVQXCMMLCZLGMV-SFHVURJKSA-N 1 1 297.398 3.583 20 10 CHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3C)C2)c1O ZINC000775703138 1122915727 /nfs/dbraw/zinc/91/57/27/1122915727.db2.gz KVQXCMMLCZLGMV-GOSISDBHSA-N 1 1 297.398 3.583 20 10 CHCDMO CO[C@@H](C)C[N@@H+](Cc1cc(Cl)cc(C)c1O)C(C)C ZINC000775715231 1122922385 /nfs/dbraw/zinc/92/23/85/1122922385.db2.gz USTMPIKYXLLAHV-LBPRGKRZSA-N 1 1 285.815 3.599 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@](C)(c3ccccc3)C2)c1 ZINC000775724864 1122925776 /nfs/dbraw/zinc/92/57/76/1122925776.db2.gz JARSKIKVQPFBPT-IBGZPJMESA-N 1 1 297.398 3.564 20 10 CHCDMO CC(C)C[N@@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203875187 1122952990 /nfs/dbraw/zinc/95/29/90/1122952990.db2.gz JTHZXTLBMDAPPZ-UHFFFAOYSA-N 1 1 285.387 3.756 20 10 CHCDMO Oc1ccc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)cc1O ZINC001203879177 1122958161 /nfs/dbraw/zinc/95/81/61/1122958161.db2.gz GTCSFDBWGKIOPM-OAHLLOKOSA-N 1 1 275.392 3.500 20 10 CHCDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(O)c(O)c1 ZINC001203880610 1122959043 /nfs/dbraw/zinc/95/90/43/1122959043.db2.gz VYINTVWEJHQADY-UHFFFAOYSA-N 1 1 291.778 3.773 20 10 CHCDMO C[C@H]1Cc2cc(CNc3ccc4c(c3)[nH+]cn4C)ccc2O1 ZINC001201115121 1123073805 /nfs/dbraw/zinc/07/38/05/1123073805.db2.gz XUUBHVCRXLCURT-LBPRGKRZSA-N 1 1 293.370 3.509 20 10 CHCDMO Cn1c[nH+]c2cc(NCc3ccc4cc[nH]c4c3)ccc21 ZINC001201114956 1123073838 /nfs/dbraw/zinc/07/38/38/1123073838.db2.gz TUZFBUGFFXEEIS-UHFFFAOYSA-N 1 1 276.343 3.667 20 10 CHCDMO CCSC1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC000850394453 1123261960 /nfs/dbraw/zinc/26/19/60/1123261960.db2.gz ROLWBOGNMXGQJZ-UHFFFAOYSA-N 1 1 289.803 3.560 20 10 CHCDMO CC[C@H]([NH2+]CCc1cnccc1C)c1ccc(F)cc1O ZINC000850505254 1123275916 /nfs/dbraw/zinc/27/59/16/1123275916.db2.gz QDBTXQDYIDDSEO-INIZCTEOSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@@H]([NH2+]CC(F)(F)C(C)(C)C)c1cc(F)ccc1O ZINC000850571850 1123294964 /nfs/dbraw/zinc/29/49/64/1123294964.db2.gz CVIXHAKGRQHJOT-SECBINFHSA-N 1 1 275.314 3.863 20 10 CHCDMO CC(C)(C)C(F)(F)C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000850572260 1123295656 /nfs/dbraw/zinc/29/56/56/1123295656.db2.gz IYLRHFOKPSLYRE-NSHDSACASA-N 1 1 269.335 3.651 20 10 CHCDMO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccccc1O ZINC000109772107 1123326114 /nfs/dbraw/zinc/32/61/14/1123326114.db2.gz CLNACDFSSWGOHW-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccccc1O ZINC000109772107 1123326115 /nfs/dbraw/zinc/32/61/15/1123326115.db2.gz CLNACDFSSWGOHW-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000109770427 1123326477 /nfs/dbraw/zinc/32/64/77/1123326477.db2.gz CBBUJYCIIPVJLA-MRXNPFEDSA-N 1 1 255.361 3.975 20 10 CHCDMO CC[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC001204769370 1123425172 /nfs/dbraw/zinc/42/51/72/1123425172.db2.gz SZRHVJWAALEWMG-FUTAKVPZSA-N 1 1 290.476 3.593 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)O1 ZINC000111168328 1123428055 /nfs/dbraw/zinc/42/80/55/1123428055.db2.gz ACNKTYNDCMHGMV-DZGCQCFKSA-N 1 1 285.387 3.545 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccccn1)C1CCCC1 ZINC000113506128 1123529856 /nfs/dbraw/zinc/52/98/56/1123529856.db2.gz PCKOCVVTBVDAPH-UHFFFAOYSA-N 1 1 282.387 3.732 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)C[C@@H]2C)c1O ZINC000228631324 1123634666 /nfs/dbraw/zinc/63/46/66/1123634666.db2.gz KPFGFBCITUUHPG-MNOVXSKESA-N 1 1 283.799 3.675 20 10 CHCDMO Cc1cc(C[N@H+]2CCCC(F)(F)CC2)ccc1N(C)C ZINC000859540976 1123700996 /nfs/dbraw/zinc/70/09/96/1123700996.db2.gz NXGMHWKUVYXVIH-UHFFFAOYSA-N 1 1 282.378 3.682 20 10 CHCDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1O ZINC000276200533 1129142875 /nfs/dbraw/zinc/14/28/75/1129142875.db2.gz NPVDXHXLWNNOLV-GFCCVEGCSA-N 1 1 273.298 3.555 20 10 CHCDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1O ZINC000276200536 1129143150 /nfs/dbraw/zinc/14/31/50/1129143150.db2.gz NPVDXHXLWNNOLV-LBPRGKRZSA-N 1 1 273.298 3.555 20 10 CHCDMO C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000896953248 1123792778 /nfs/dbraw/zinc/79/27/78/1123792778.db2.gz WPVAJXQCFYQCHA-PSASIEDQSA-N 1 1 289.803 3.558 20 10 CHCDMO COCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000195527393 1129146263 /nfs/dbraw/zinc/14/62/63/1129146263.db2.gz JDQLPKDMRZWDSN-HNNXBMFYSA-N 1 1 285.387 3.602 20 10 CHCDMO COCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000195527394 1129146357 /nfs/dbraw/zinc/14/63/57/1129146357.db2.gz JDQLPKDMRZWDSN-OAHLLOKOSA-N 1 1 285.387 3.602 20 10 CHCDMO Cc1cc(C[N@@H+](C)CC2CC2)c(O)c(C(C)(C)C)c1 ZINC000195640095 1129147860 /nfs/dbraw/zinc/14/78/60/1129147860.db2.gz MCOSDWGJJNLGAT-UHFFFAOYSA-N 1 1 261.409 3.840 20 10 CHCDMO Cc1cc(N(C)C)ccc1CNc1cc[nH+]cc1Cl ZINC000301535790 1123908860 /nfs/dbraw/zinc/90/88/60/1123908860.db2.gz TWOYLWADYBAGFN-UHFFFAOYSA-N 1 1 275.783 3.722 20 10 CHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670532 1123924632 /nfs/dbraw/zinc/92/46/32/1123924632.db2.gz XRVJLMONKNLURK-QMTHXVAHSA-N 1 1 299.336 3.654 20 10 CHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000794653798 1123925489 /nfs/dbraw/zinc/92/54/89/1123925489.db2.gz FSIISGPUAJZOLR-GOSISDBHSA-N 1 1 291.435 3.825 20 10 CHCDMO CC[C@H](NCC[NH+](C(C)C)C(C)C)c1ccccc1O ZINC000084523727 1129153581 /nfs/dbraw/zinc/15/35/81/1129153581.db2.gz VJUKENBSOHYZPQ-INIZCTEOSA-N 1 1 278.440 3.552 20 10 CHCDMO COCC(C)(C)CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000872104836 1124684179 /nfs/dbraw/zinc/68/41/79/1124684179.db2.gz RDHFZIGOYZIEJM-NSHDSACASA-N 1 1 285.815 3.759 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000876636254 1124965500 /nfs/dbraw/zinc/96/55/00/1124965500.db2.gz DAEBJCJHBUGGNC-KRWDZBQOSA-N 1 1 283.371 3.743 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000876683445 1124971219 /nfs/dbraw/zinc/97/12/19/1124971219.db2.gz 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1 292.382 3.963 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CCc2cccc(F)c2)c1O ZINC001140184592 1131674340 /nfs/dbraw/zinc/67/43/40/1131674340.db2.gz AUZLZRQCBFLWLM-UHFFFAOYSA-N 1 1 287.378 3.823 20 10 CHCDMO CCc1nc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)co1 ZINC000834898702 1131722925 /nfs/dbraw/zinc/72/29/25/1131722925.db2.gz BRGHPBRCEMGRMM-CYBMUJFWSA-N 1 1 287.407 3.544 20 10 CHCDMO C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Cl)ccc1[O-] ZINC000834908361 1131730282 /nfs/dbraw/zinc/73/02/82/1131730282.db2.gz JAUCBGXXCDQQBN-GFCCVEGCSA-N 1 1 296.842 3.571 20 10 CHCDMO C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(Cl)ccc1[O-] ZINC000834908361 1131730286 /nfs/dbraw/zinc/73/02/86/1131730286.db2.gz JAUCBGXXCDQQBN-GFCCVEGCSA-N 1 1 296.842 3.571 20 10 CHCDMO C[N@@H+](CCc1ccccc1)Cc1ccc(Cl)cc1O ZINC001140461739 1131749670 /nfs/dbraw/zinc/74/96/70/1131749670.db2.gz SPSSVYLRBDXBPC-UHFFFAOYSA-N 1 1 275.779 3.720 20 10 CHCDMO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C1CCC1 ZINC000835024798 1131759928 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C[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1Cl ZINC001140921363 1131964345 /nfs/dbraw/zinc/96/43/45/1131964345.db2.gz CFZNJPOUGOLYIJ-GFCCVEGCSA-N 1 1 266.816 3.780 20 10 CHCDMO CC1CC([N@@H+](C)Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140922698 1131964853 /nfs/dbraw/zinc/96/48/53/1131964853.db2.gz ZRTLSDPATNQULQ-UHFFFAOYSA-N 1 1 266.816 3.636 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCCC2)c(Cl)c1 ZINC001140924897 1131966298 /nfs/dbraw/zinc/96/62/98/1131966298.db2.gz VWDQHSDELLPDRO-UHFFFAOYSA-N 1 1 266.816 3.780 20 10 CHCDMO C[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)CC1CCC1 ZINC001141076210 1132005288 /nfs/dbraw/zinc/00/52/88/1132005288.db2.gz MRXSCZAOMIIGIS-UHFFFAOYSA-N 1 1 284.447 3.617 20 10 CHCDMO CC1CC([N@@H+](C)Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141074196 1132005965 /nfs/dbraw/zinc/00/59/65/1132005965.db2.gz APCMOUXSPFUXAA-UHFFFAOYSA-N 1 1 284.447 3.616 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2c(F)cccc2C1 ZINC001171436871 1132015124 /nfs/dbraw/zinc/01/51/24/1132015124.db2.gz GZGZXQQHJUVWJJ-HNNXBMFYSA-N 1 1 285.362 3.521 20 10 CHCDMO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001649160835 1132023982 /nfs/dbraw/zinc/02/39/82/1132023982.db2.gz FPBWPAQOTVRXIQ-FZMZJTMJSA-N 1 1 283.362 3.975 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141143419 1132028173 /nfs/dbraw/zinc/02/81/73/1132028173.db2.gz YJMFQVHNKKRTNL-INIZCTEOSA-N 1 1 288.435 3.670 20 10 CHCDMO CCC(CC)[N@@H+](CC)Cc1ccc2c(c1)OCCN2C ZINC001141144272 1132028381 /nfs/dbraw/zinc/02/83/81/1132028381.db2.gz YBNYAZRSDYKQGF-UHFFFAOYSA-N 1 1 276.424 3.526 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC001141156308 1132030358 /nfs/dbraw/zinc/03/03/58/1132030358.db2.gz JENCVKRRTPAYLB-QGZVFWFLSA-N 1 1 283.371 3.825 20 10 CHCDMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc(O)ccc1O ZINC001141161174 1132030687 /nfs/dbraw/zinc/03/06/87/1132030687.db2.gz BBPFMNOHINGUIM-LLVKDONJSA-N 1 1 291.778 3.944 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)c1 ZINC001141158483 1132031816 /nfs/dbraw/zinc/03/18/16/1132031816.db2.gz AVSWKUJXLXZNGS-MRXNPFEDSA-N 1 1 297.398 3.553 20 10 CHCDMO CC(C)COCC[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172483188 1132229165 /nfs/dbraw/zinc/22/91/65/1132229165.db2.gz JGHRBOBUSASWOC-INIZCTEOSA-N 1 1 292.467 3.636 20 10 CHCDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000840182636 1132248667 /nfs/dbraw/zinc/24/86/67/1132248667.db2.gz HVMNPYBEFWJPGV-LBPRGKRZSA-N 1 1 270.376 3.561 20 10 CHCDMO Cc1c(F)ccc(C[N@@H+](C)Cc2ccccc2O)c1F ZINC001231478258 1132298436 /nfs/dbraw/zinc/29/84/36/1132298436.db2.gz BLKYZKQAFKFFQK-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000840911545 1132307466 /nfs/dbraw/zinc/30/74/66/1132307466.db2.gz GVIQYBLJAKPRPB-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000840911545 1132307470 /nfs/dbraw/zinc/30/74/70/1132307470.db2.gz GVIQYBLJAKPRPB-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](Cc1ccccn1)C(C)C ZINC000840911658 1132308582 /nfs/dbraw/zinc/30/85/82/1132308582.db2.gz LTNIJTWFIGENEI-UHFFFAOYSA-N 1 1 297.446 3.867 20 10 CHCDMO C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)CC(F)(F)F ZINC000840963239 1132313749 /nfs/dbraw/zinc/31/37/49/1132313749.db2.gz JHSODNULRUEUBE-ZETCQYMHSA-N 1 1 299.695 3.863 20 10 CHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC001231589326 1132318281 /nfs/dbraw/zinc/31/82/81/1132318281.db2.gz BXCALENGCWRAMG-SFHVURJKSA-N 1 1 299.414 3.935 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(C)c2O)cn1 ZINC001231592087 1132320662 /nfs/dbraw/zinc/32/06/62/1132320662.db2.gz BEQYISHMEWKBJR-KRWDZBQOSA-N 1 1 282.387 3.741 20 10 CHCDMO CCCc1ccc(C[N@H+]2CCc3cccc(O)c3C2)cc1 ZINC001142367731 1132374267 /nfs/dbraw/zinc/37/42/67/1132374267.db2.gz WPKJRNBYKLMGPP-UHFFFAOYSA-N 1 1 281.399 3.903 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3sccc3C2)c(O)c1 ZINC001231844980 1132379186 /nfs/dbraw/zinc/37/91/86/1132379186.db2.gz UWZQABBCRXEMME-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@](C)(CF)C2)cc1Cl 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C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(Cl)cc1O ZINC000841747557 1132389816 /nfs/dbraw/zinc/38/98/16/1132389816.db2.gz CLCOWCLOJCMSSL-PWSUYJOCSA-N 1 1 283.799 3.654 20 10 CHCDMO CC[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)N1CCCC1 ZINC000841746226 1132390622 /nfs/dbraw/zinc/39/06/22/1132390622.db2.gz WFZMOZYWQBVEDD-JSGCOSHPSA-N 1 1 296.842 3.571 20 10 CHCDMO C[C@H]([NH2+]CCCc1nccs1)c1ccc(Cl)cc1O ZINC000841747238 1132390832 /nfs/dbraw/zinc/39/08/32/1132390832.db2.gz DQLJGXPMZWBBNO-JTQLQIEISA-N 1 1 296.823 3.786 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841759174 1132393674 /nfs/dbraw/zinc/39/36/74/1132393674.db2.gz OGMAIMQFNKQKDY-IJLUTSLNSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@H]([NH2+][C@@H](CO)CC1CCCCC1)c1ccc(F)cc1O ZINC000841763004 1132395808 /nfs/dbraw/zinc/39/58/08/1132395808.db2.gz SVZSIRNCWMXDJX-SWLSCSKDSA-N 1 1 295.398 3.513 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@H]21)c1ccc(Cl)cc1O ZINC000841761534 1132397258 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ZINC001232266480 1132447360 /nfs/dbraw/zinc/44/73/60/1132447360.db2.gz UNDDBBVXKVLDNM-UHFFFAOYSA-N 1 1 271.788 3.676 20 10 CHCDMO C[N@@H+](Cc1ccc(C(F)(F)F)o1)Cc1ccccc1O ZINC001232446421 1132471083 /nfs/dbraw/zinc/47/10/83/1132471083.db2.gz MEXCOQNRYXFLME-UHFFFAOYSA-N 1 1 285.265 3.636 20 10 CHCDMO COc1cccc(C)c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232623420 1132496538 /nfs/dbraw/zinc/49/65/38/1132496538.db2.gz OZQAUFFGURMLSZ-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1O ZINC001143111134 1132504504 /nfs/dbraw/zinc/50/45/04/1132504504.db2.gz YUVNJEDCUPDIMT-MRXNPFEDSA-N 1 1 295.373 3.921 20 10 CHCDMO COc1cccc(C[N@H+]2CCCC[C@@H]2C2CCC2)c1O ZINC000843437599 1132535149 /nfs/dbraw/zinc/53/51/49/1132535149.db2.gz OSJBHCAUYGVRQD-OAHLLOKOSA-N 1 1 275.392 3.555 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC001233286225 1132594275 /nfs/dbraw/zinc/59/42/75/1132594275.db2.gz KTHQTNUOQZIUQA-INIZCTEOSA-N 1 1 295.373 3.921 20 10 CHCDMO 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C[N@H+](Cc1c(O)ccc(Cl)c1F)C1CC(C)(C)C1 ZINC001206216414 1133672145 /nfs/dbraw/zinc/67/21/45/1133672145.db2.gz XCBJPHKMMGKNDY-UHFFFAOYSA-N 1 1 271.763 3.805 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CC(C)(C)C1 ZINC001206216414 1133672148 /nfs/dbraw/zinc/67/21/48/1133672148.db2.gz XCBJPHKMMGKNDY-UHFFFAOYSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1[C@H](C)C[N@H+](Cc2c(O)ccc(Cl)c2F)[C@H]1C ZINC001206342868 1133692998 /nfs/dbraw/zinc/69/29/98/1133692998.db2.gz MRHLZOWJTJKEBH-BBBLOLIVSA-N 1 1 271.763 3.661 20 10 CHCDMO C[C@@H]1[C@H](C)C[N@@H+](Cc2c(O)ccc(Cl)c2F)[C@H]1C ZINC001206342868 1133692999 /nfs/dbraw/zinc/69/29/99/1133692999.db2.gz MRHLZOWJTJKEBH-BBBLOLIVSA-N 1 1 271.763 3.661 20 10 CHCDMO C[C@@]1(CC[NH2+]Cc2ccc(Cl)cc2O)C[C@@]1(F)Cl ZINC001206516832 1133712820 /nfs/dbraw/zinc/71/28/20/1133712820.db2.gz GAOFKKAJXAZPOZ-OLZOCXBDSA-N 1 1 292.181 3.840 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@H]2[C@H]3CC[C@H](C3)[C@@]2(C)C1 ZINC001207692487 1133839724 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ZINC000527936719 330298024 /nfs/dbraw/zinc/29/80/24/330298024.db2.gz QYCOAYPOZBDYMK-INIZCTEOSA-N 1 1 295.398 3.731 20 10 CHCDMO CCC[N@@H+](Cc1csc(CC)n1)Cc1ccccc1O ZINC000068973678 521692925 /nfs/dbraw/zinc/69/29/25/521692925.db2.gz NGJORUASIJORBU-UHFFFAOYSA-N 1 1 290.432 3.823 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)C2CC2)cc1C ZINC000290516714 525316588 /nfs/dbraw/zinc/31/65/88/525316588.db2.gz PVPPLBOSNQELHB-UHFFFAOYSA-N 1 1 282.387 3.569 20 10 CHCDMO C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc2ccccc2c1[O-] ZINC000045663349 525333388 /nfs/dbraw/zinc/33/33/88/525333388.db2.gz QJBOKJNGVLLYQB-AWEZNQCLSA-N 1 1 286.419 3.538 20 10 CHCDMO Cc1c[nH]nc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000290320252 526020912 /nfs/dbraw/zinc/02/09/12/526020912.db2.gz BMXDJGDYQGFRNL-UHFFFAOYSA-N 1 1 299.418 3.759 20 10 CHCDMO Cc1cn[nH]c1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000290320252 526020921 /nfs/dbraw/zinc/02/09/21/526020921.db2.gz BMXDJGDYQGFRNL-UHFFFAOYSA-N 1 1 299.418 3.759 20 10 CHCDMO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000290320252 526020925 /nfs/dbraw/zinc/02/09/25/526020925.db2.gz BMXDJGDYQGFRNL-UHFFFAOYSA-N 1 1 299.418 3.759 20 10 CHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000131021438 526134400 /nfs/dbraw/zinc/13/44/00/526134400.db2.gz HMKBFDVYAXKGPK-ZDUSSCGKSA-N 1 1 258.365 3.539 20 10 CHCDMO CCSCC[C@@H](C)[N@@H+](C)Cc1c(C)cc(OC)cc1O ZINC001179962692 1121936923 /nfs/dbraw/zinc/93/69/23/1121936923.db2.gz QSOGNUCPDSYRON-CYBMUJFWSA-N 1 1 297.464 3.673 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001182574260 1122175870 /nfs/dbraw/zinc/17/58/70/1122175870.db2.gz LYXHEKBGNUTVCN-FZMZJTMJSA-N 1 1 265.784 3.810 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000775736971 1122928773 /nfs/dbraw/zinc/92/87/73/1122928773.db2.gz ILUUJUATUVMVHB-NSHDSACASA-N 1 1 253.773 3.586 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1cscn1)c1ccc(F)cc1O ZINC000850511828 1123278385 /nfs/dbraw/zinc/27/83/85/1123278385.db2.gz NYMSIYLOIVXHAS-SKDRFNHKSA-N 1 1 280.368 3.790 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@@H]2C)c1O ZINC000228631310 1123634131 /nfs/dbraw/zinc/63/41/31/1123634131.db2.gz UOJRBWXJCDTQKG-QWRGUYRKSA-N 1 1 283.799 3.675 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001140465427 1131751491 /nfs/dbraw/zinc/75/14/91/1131751491.db2.gz NAGBPWHMYKRBBB-BXUZGUMPSA-N 1 1 265.784 3.810 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(C)(C)C)c(O)c1 ZINC001140854932 1131947932 /nfs/dbraw/zinc/94/79/32/1131947932.db2.gz GZNOWCRITPHCDZ-UHFFFAOYSA-N 1 1 278.440 3.716 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233451278 1132625029 /nfs/dbraw/zinc/62/50/29/1132625029.db2.gz DXUHNSWBYDVYPG-JTQLQIEISA-N 1 1 273.298 3.785 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233455195 1132625056 /nfs/dbraw/zinc/62/50/56/1132625056.db2.gz AIUFQSYHEHDKON-SNVBAGLBSA-N 1 1 273.298 3.643 20 10 CHCDMO C[C@H]([NH2+]CCN(C)C1CCCC1)c1ccc(Cl)cc1[O-] ZINC000841747768 1125579662 /nfs/dbraw/zinc/57/96/62/1125579662.db2.gz SKIPVKNTXWLHCD-LBPRGKRZSA-N 1 1 296.842 3.571 20 10 CHCDMO Cc1cccc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)n1 ZINC000841750805 1125582965 /nfs/dbraw/zinc/58/29/65/1125582965.db2.gz BPQYPYXEBILQQK-LBPRGKRZSA-N 1 1 290.794 3.642 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)[C@H]1CCCOC1 ZINC000841755027 1125593858 /nfs/dbraw/zinc/59/38/58/1125593858.db2.gz XLNCJYKOLAKZNY-WOPDTQHZSA-N 1 1 283.799 3.511 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000054495163 1125600399 /nfs/dbraw/zinc/60/03/99/1125600399.db2.gz LNGMLOMANYTXHO-AWEZNQCLSA-N 1 1 297.398 3.546 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(Cl)cc1O ZINC000841758909 1125600824 /nfs/dbraw/zinc/60/08/24/1125600824.db2.gz WDYBQUHMKUHBTH-GIFSMMMISA-N 1 1 265.784 3.885 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246942430 1125652017 /nfs/dbraw/zinc/65/20/17/1125652017.db2.gz LORYEGKHNWUYEZ-HNAYVOBHSA-N 1 1 297.398 3.546 20 10 CHCDMO CCOc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886505147 1125681415 /nfs/dbraw/zinc/68/14/15/1125681415.db2.gz NHUJVOKUXDGKLC-GFCCVEGCSA-N 1 1 289.350 3.781 20 10 CHCDMO COc1cccc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886507682 1125681443 /nfs/dbraw/zinc/68/14/43/1125681443.db2.gz VDCIQRXAMHRSAW-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO COC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886547471 1125689230 /nfs/dbraw/zinc/68/92/30/1125689230.db2.gz LYQJWJPEUIVLCE-DOMZBBRYSA-N 1 1 289.350 3.570 20 10 CHCDMO C[C@H]([NH2+]CC1(CCO)CCCCC1)c1c(O)cccc1F ZINC000886536085 1125685825 /nfs/dbraw/zinc/68/58/25/1125685825.db2.gz AFFIVOWKSVTSAX-ZDUSSCGKSA-N 1 1 295.398 3.515 20 10 CHCDMO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1c(O)cccc1F ZINC000886572107 1125691601 /nfs/dbraw/zinc/69/16/01/1125691601.db2.gz YNDHQSGWZDVING-GFCCVEGCSA-N 1 1 271.335 3.871 20 10 CHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886589998 1125693976 /nfs/dbraw/zinc/69/39/76/1125693976.db2.gz LIYHFOYGFAFUTQ-RKDXNWHRSA-N 1 1 279.277 3.913 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1c(O)cccc1F ZINC000886605767 1125696773 /nfs/dbraw/zinc/69/67/73/1125696773.db2.gz YDPADUFDGCQDGM-VHSXEESVSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)CC(F)(F)F ZINC000886625584 1125699719 /nfs/dbraw/zinc/69/97/19/1125699719.db2.gz VHTWNCROOSKYOO-IUCAKERBSA-N 1 1 279.277 3.770 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1c(O)cccc1F ZINC000886638680 1125700577 /nfs/dbraw/zinc/70/05/77/1125700577.db2.gz ZPUMHDVHMQSFBF-BMIGLBTASA-N 1 1 287.334 3.575 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1c(O)cccc1F ZINC000886640382 1125701332 /nfs/dbraw/zinc/70/13/32/1125701332.db2.gz XXOMTEZLKCGDHZ-IUCAKERBSA-N 1 1 292.181 3.766 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1c(O)cccc1F ZINC000886732584 1125714974 /nfs/dbraw/zinc/71/49/74/1125714974.db2.gz KQMMFUDFFKNFGQ-CHWSQXEVSA-N 1 1 293.382 3.531 20 10 CHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000093593588 1125769988 /nfs/dbraw/zinc/76/99/88/1125769988.db2.gz FCPSDBRQDRZNHQ-OAHLLOKOSA-N 1 1 297.398 3.699 20 10 CHCDMO COc1cc(C[N@@H+](CCC(C)C)C2CC2)c(O)cc1C ZINC000768441840 1129855721 /nfs/dbraw/zinc/85/57/21/1129855721.db2.gz OTDZETXEWKKESP-UHFFFAOYSA-N 1 1 277.408 3.720 20 10 CHCDMO CCOc1ccc(C[N@@H+](CC)CCC(F)(F)F)c(O)c1 ZINC000769224871 1129895742 /nfs/dbraw/zinc/89/57/42/1129895742.db2.gz DIUYKLUUZPPORZ-UHFFFAOYSA-N 1 1 291.313 3.565 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(OC)c1 ZINC000302741657 1126740932 /nfs/dbraw/zinc/74/09/32/1126740932.db2.gz QDKIIZOFFUGJLM-UHFFFAOYSA-N 1 1 298.430 3.783 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[C@@H](C)C1 ZINC001170159377 1130396137 /nfs/dbraw/zinc/39/61/37/1130396137.db2.gz TXYYZFUVCUXCCI-PBHICJAKSA-N 1 1 260.425 3.763 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000179591835 1126830992 /nfs/dbraw/zinc/83/09/92/1126830992.db2.gz NVOMIVUUHWAQIV-CQSZACIVSA-N 1 1 289.400 3.799 20 10 CHCDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccccc2O)s1 ZINC000179579035 1126831189 /nfs/dbraw/zinc/83/11/89/1126831189.db2.gz ZPWFWTKPFRQMPP-LBPRGKRZSA-N 1 1 290.432 3.913 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@@H]2C)c1 ZINC000781895504 1130745180 /nfs/dbraw/zinc/74/51/80/1130745180.db2.gz UHGJYEFPENYHIO-NSHDSACASA-N 1 1 298.224 3.838 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1ccc(F)cc1O ZINC000698085006 1127061997 /nfs/dbraw/zinc/06/19/97/1127061997.db2.gz JJKKWOPHIAEGBP-QMMMGPOBSA-N 1 1 269.703 3.629 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1cc(C(F)(F)F)ccc1O ZINC001237137094 1131056069 /nfs/dbraw/zinc/05/60/69/1131056069.db2.gz LPSYGZNMORMICB-JTQLQIEISA-N 1 1 273.298 3.785 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+](C)C(C2CC2)C2CC2)c1 ZINC000164244550 1127158143 /nfs/dbraw/zinc/15/81/43/1127158143.db2.gz HAAFUABYGRHTGN-UHFFFAOYSA-N 1 1 259.393 3.629 20 10 CHCDMO [O-]c1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@H](F)CC1 ZINC001237933622 1131153365 /nfs/dbraw/zinc/15/33/65/1131153365.db2.gz FBRNRZNDLXCMCP-SNVBAGLBSA-N 1 1 275.726 3.509 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001237933622 1131153368 /nfs/dbraw/zinc/15/33/68/1131153368.db2.gz FBRNRZNDLXCMCP-SNVBAGLBSA-N 1 1 275.726 3.509 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@H](F)CC1 ZINC001237933622 1131153371 /nfs/dbraw/zinc/15/33/71/1131153371.db2.gz FBRNRZNDLXCMCP-SNVBAGLBSA-N 1 1 275.726 3.509 20 10 CHCDMO CC[C@H]([NH2+]Cc1nc(C)cs1)c1ccc(F)cc1O ZINC000285784583 1127243190 /nfs/dbraw/zinc/24/31/90/1127243190.db2.gz UJVHWUNGEOSUAK-LBPRGKRZSA-N 1 1 280.368 3.537 20 10 CHCDMO CC[C@H]([NH2+]Cc1sc(C)nc1C)c1ccc(F)cc1O ZINC000285975250 1127250390 /nfs/dbraw/zinc/25/03/90/1127250390.db2.gz HJMLHFNHPTZAMK-ZDUSSCGKSA-N 1 1 294.395 3.846 20 10 CHCDMO CC[C@H]([NH2+]CC[C@H]1CCO[C@@H](C)C1)c1ccc(F)cc1O ZINC000286002752 1127253102 /nfs/dbraw/zinc/25/31/02/1127253102.db2.gz HRBRAKOTHIYCRK-XEZPLFJOSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000286107466 1127258610 /nfs/dbraw/zinc/25/86/10/1127258610.db2.gz MYRTWMXECQMXCG-DZGCQCFKSA-N 1 1 281.371 3.531 20 10 CHCDMO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000286166519 1127262068 /nfs/dbraw/zinc/26/20/68/1127262068.db2.gz PQEXDFHJZTXYSB-GXTWGEPZSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@H]([NH2+]CCCCOC(C)C)c1ccc(F)cc1O ZINC000286211176 1127262645 /nfs/dbraw/zinc/26/26/45/1127262645.db2.gz RUNGWMKOPPVXEW-HNNXBMFYSA-N 1 1 283.387 3.777 20 10 CHCDMO C[C@H]1[C@@H](C)[N@H+](Cc2cc(Cl)cc(F)c2[O-])C[C@H]1C ZINC001308826186 1127498266 /nfs/dbraw/zinc/49/82/66/1127498266.db2.gz UTIAKTMPTBTGRI-OPRDCNLKSA-N 1 1 271.763 3.661 20 10 CHCDMO CCc1nocc1C[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC000293664298 1127511168 /nfs/dbraw/zinc/51/11/68/1127511168.db2.gz OBRRCLTXJRUISK-UHFFFAOYSA-N 1 1 296.370 3.728 20 10 CHCDMO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)C1CCCC1 ZINC000228607184 1127572005 /nfs/dbraw/zinc/57/20/05/1127572005.db2.gz CXDJQZYLDLRPHA-UHFFFAOYSA-N 1 1 283.799 3.819 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2C(C)C)c1O ZINC000228606815 1127572076 /nfs/dbraw/zinc/57/20/76/1127572076.db2.gz XVRBCTIZXDRJQT-ZDUSSCGKSA-N 1 1 283.799 3.675 20 10 CHCDMO C[C@@H]([NH2+]CCCc1ccccc1)c1ccc(F)cc1O ZINC000062744997 1127772575 /nfs/dbraw/zinc/77/25/75/1127772575.db2.gz QLMUCEYOAJXSQG-CYBMUJFWSA-N 1 1 273.351 3.815 20 10 CHCDMO C[C@H]([NH2+]CCc1ccccc1F)c1ccc(F)cc1O ZINC000062744820 1127772199 /nfs/dbraw/zinc/77/21/99/1127772199.db2.gz ZWSISWKARCTUSZ-NSHDSACASA-N 1 1 277.314 3.564 20 10 CHCDMO C[C@@H]([NH2+]C1CCCCCC1)c1ccc(F)cc1O ZINC000062744995 1127772257 /nfs/dbraw/zinc/77/22/57/1127772257.db2.gz LVAHQWKPZZFHPD-LLVKDONJSA-N 1 1 251.345 3.905 20 10 CHCDMO C[C@H]([NH2+]CCCOC1CCCCC1)c1ccc(F)cc1O ZINC000062745328 1127773232 /nfs/dbraw/zinc/77/32/32/1127773232.db2.gz WXQLZOTTXIXDNR-ZDUSSCGKSA-N 1 1 295.398 3.921 20 10 CHCDMO CC[NH+](CC)CCC[N@@H+](CC)Cc1cccc(Cl)c1[O-] ZINC000230745031 1127773767 /nfs/dbraw/zinc/77/37/67/1127773767.db2.gz SQXAXSBAMFYMDZ-UHFFFAOYSA-N 1 1 298.858 3.599 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCC3(CC3)C2)c1 ZINC001233284385 1127942908 /nfs/dbraw/zinc/94/29/08/1127942908.db2.gz SJNMISMNBJMOQN-UHFFFAOYSA-N 1 1 259.393 3.676 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccccc2O)[C@H]1c1ccccc1 ZINC000245585647 1128042250 /nfs/dbraw/zinc/04/22/50/1128042250.db2.gz DKAZEJLOWUVRGO-SUMWQHHRSA-N 1 1 253.345 3.585 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168440948 1128067388 /nfs/dbraw/zinc/06/73/88/1128067388.db2.gz NQGVBKDWBKSSSY-QGZVFWFLSA-N 1 1 285.362 3.521 20 10 CHCDMO Cc1cc(F)c(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(F)c1 ZINC000927095308 1128216304 /nfs/dbraw/zinc/21/63/04/1128216304.db2.gz ZSRWKOHQTVYPKG-JTQLQIEISA-N 1 1 295.304 3.969 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1c(O)cccc1F ZINC000927100881 1128217292 /nfs/dbraw/zinc/21/72/92/1128217292.db2.gz VEYCDXOPPPEORI-NWDGAFQWSA-N 1 1 295.398 3.776 20 10 CHCDMO COCC[N@H+](Cc1cc(C(C)C)c(C)cc1O)CC(C)C ZINC000914783557 1128242814 /nfs/dbraw/zinc/24/28/14/1128242814.db2.gz UKDXGTSYXYHIDI-UHFFFAOYSA-N 1 1 293.451 3.928 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)C[C@@H](C)c2ccccc2)c1O ZINC000754726488 1128298902 /nfs/dbraw/zinc/29/89/02/1128298902.db2.gz JNONDLAZLNRLFC-OAHLLOKOSA-N 1 1 299.414 3.945 20 10 CHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(C)cc(C)c2O)on1 ZINC000754727541 1128299304 /nfs/dbraw/zinc/29/93/04/1128299304.db2.gz IJMBXFZSWMPXFZ-HNNXBMFYSA-N 1 1 286.375 3.643 20 10 CHCDMO CCCC[N@@H+](C/C=C(\C)COC)Cc1ccccc1O ZINC000930350655 1128314975 /nfs/dbraw/zinc/31/49/75/1128314975.db2.gz ILJFVXHVRNDVCL-XNTDXEJSSA-N 1 1 277.408 3.587 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)Cc1cc(C)nnc1C ZINC000930351264 1128315229 /nfs/dbraw/zinc/31/52/29/1128315229.db2.gz NIHYGXTUNXQXRW-UHFFFAOYSA-N 1 1 299.418 3.601 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)Cc1cccc(F)c1 ZINC001168499303 1128340712 /nfs/dbraw/zinc/34/07/12/1128340712.db2.gz YSNTUAOEGIEVTK-AWEZNQCLSA-N 1 1 287.378 3.984 20 10 CHCDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccccc1O ZINC000780793302 1128451736 /nfs/dbraw/zinc/45/17/36/1128451736.db2.gz LCBADQPOALYTCU-ZYHUDNBSSA-N 1 1 273.298 3.555 20 10 CHCDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585508 1128568734 /nfs/dbraw/zinc/56/87/34/1128568734.db2.gz GOYDXGNFMNBJGY-IFXJQAMLSA-N 1 1 296.414 3.953 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccccc1O ZINC000155868638 1128617218 /nfs/dbraw/zinc/61/72/18/1128617218.db2.gz ZELQKZIZXMCOMW-WBVHZDCISA-N 1 1 292.467 3.799 20 10 CHCDMO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)cc2F)cc1 ZINC000920258872 1128675103 /nfs/dbraw/zinc/67/51/03/1128675103.db2.gz ZZCMSTNLLUFXGW-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(F)cc2F)cc1 ZINC000920258872 1128675106 /nfs/dbraw/zinc/67/51/06/1128675106.db2.gz ZZCMSTNLLUFXGW-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779015209 1128680550 /nfs/dbraw/zinc/68/05/50/1128680550.db2.gz SEIDSULDUPEGOU-LBPRGKRZSA-N 1 1 271.335 3.651 20 10 CHCDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1cc(F)ccc1O ZINC000779020259 1128683243 /nfs/dbraw/zinc/68/32/43/1128683243.db2.gz LBGSTMVPFPJIGN-HIFRSBDPSA-N 1 1 285.362 3.909 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)cc1 ZINC000799736021 1117898682 /nfs/dbraw/zinc/89/86/82/1117898682.db2.gz GFPGFAOIPBXYJH-MAUKXSAKSA-N 1 1 290.451 3.532 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1cccc(OC)c1O ZINC000179523319 1128746302 /nfs/dbraw/zinc/74/63/02/1128746302.db2.gz ZFDNJLNTHZYCPV-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000705476319 1117973137 /nfs/dbraw/zinc/97/31/37/1117973137.db2.gz IVWLSLRUMCCUNK-LLVKDONJSA-N 1 1 253.773 3.668 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccccc2O)[C@H](c2ccco2)C1 ZINC000179582887 1128748802 /nfs/dbraw/zinc/74/88/02/1128748802.db2.gz OCOGKZNCGYAXLV-ZFWWWQNUSA-N 1 1 271.360 3.958 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(F)cc2)c1O ZINC000179646486 1128751691 /nfs/dbraw/zinc/75/16/91/1128751691.db2.gz XIVAXHVANWEFCE-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179664453 1128753769 /nfs/dbraw/zinc/75/37/69/1128753769.db2.gz JXJIDMODUSWZAU-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C#N)cc1)Cc1cccc(C)c1O ZINC000179721331 1128755107 /nfs/dbraw/zinc/75/51/07/1128755107.db2.gz KLCJZDIDFXCQHP-UHFFFAOYSA-N 1 1 294.398 3.985 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000179896455 1128764402 /nfs/dbraw/zinc/76/44/02/1128764402.db2.gz QBVFGXYALKMNJX-UHFFFAOYSA-N 1 1 296.345 3.571 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000179896455 1128764404 /nfs/dbraw/zinc/76/44/04/1128764404.db2.gz QBVFGXYALKMNJX-UHFFFAOYSA-N 1 1 296.345 3.571 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000179910267 1128765605 /nfs/dbraw/zinc/76/56/05/1128765605.db2.gz GATLHGGQSMOWPC-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO C[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCc2ccccc21 ZINC000179905795 1128766136 /nfs/dbraw/zinc/76/61/36/1128766136.db2.gz DTJXNQPEYWITBK-INIZCTEOSA-N 1 1 271.335 3.651 20 10 CHCDMO CCN(C)c1ccc([C@H](C)N[C@H](C)C[NH+](CC)CC)cc1 ZINC000765765569 1118269059 /nfs/dbraw/zinc/26/90/59/1118269059.db2.gz GWVDUNGJCPIVRN-CVEARBPZSA-N 1 1 291.483 3.524 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000076074013 1128768615 /nfs/dbraw/zinc/76/86/15/1128768615.db2.gz CGQCRPWOUJZLOZ-IBGZPJMESA-N 1 1 299.414 3.646 20 10 CHCDMO CC[C@@H](N[C@@H](C)C[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000765770362 1118322448 /nfs/dbraw/zinc/32/24/48/1118322448.db2.gz WRPBHXRJVVSCTO-MAUKXSAKSA-N 1 1 291.483 3.524 20 10 CHCDMO CCc1cccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1O ZINC001204542812 1118476293 /nfs/dbraw/zinc/47/62/93/1118476293.db2.gz IOVUFLHBEHDGKE-JKSUJKDBSA-N 1 1 291.460 3.815 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000180234924 1128782554 /nfs/dbraw/zinc/78/25/54/1128782554.db2.gz PSEQHFQVZRPVKW-WWGRRREGSA-N 1 1 275.392 3.554 20 10 CHCDMO Cc1ccc2cc(C[N@H+](C)Cc3ccccc3O)ccc2n1 ZINC000189740452 1128783616 /nfs/dbraw/zinc/78/36/16/1128783616.db2.gz BOTKJJFEVHNFQH-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)C1(O)CCCC1)c1ccc(F)cc1O ZINC000834907240 1118624546 /nfs/dbraw/zinc/62/45/46/1118624546.db2.gz ZIOCVZHZWGNEGA-LBPRGKRZSA-N 1 1 295.398 3.513 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1 ZINC000754723444 1118644235 /nfs/dbraw/zinc/64/42/35/1118644235.db2.gz KJYOQUQXSULEQB-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1Br)C1CCCCC1 ZINC000707145004 1118647799 /nfs/dbraw/zinc/64/77/99/1118647799.db2.gz DGWWJFIIYGEKIQ-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO CC[C@@H]([NH2+]CCCOCC(C)C)c1ccc(F)cc1O ZINC000796676494 1118685242 /nfs/dbraw/zinc/68/52/42/1118685242.db2.gz RUUIOFYEXNKXFW-OAHLLOKOSA-N 1 1 283.387 3.635 20 10 CHCDMO CC(C)(C)[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708401471 1119437450 /nfs/dbraw/zinc/43/74/50/1119437450.db2.gz TWFVUBLVWHQVNF-NSHDSACASA-N 1 1 269.335 3.538 20 10 CHCDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708401471 1119437452 /nfs/dbraw/zinc/43/74/52/1119437452.db2.gz TWFVUBLVWHQVNF-NSHDSACASA-N 1 1 269.335 3.538 20 10 CHCDMO CCC[N@@H+](Cc1cnc(CC)s1)Cc1ccccc1O ZINC000092704946 1119565018 /nfs/dbraw/zinc/56/50/18/1119565018.db2.gz NARKVBDFSJYWTL-UHFFFAOYSA-N 1 1 290.432 3.823 20 10 CHCDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccccc1O ZINC000179580528 1119751862 /nfs/dbraw/zinc/75/18/62/1119751862.db2.gz XEHIIQGXXJSQSB-YOEHRIQHSA-N 1 1 267.372 3.770 20 10 CHCDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ccccc1O ZINC000179581126 1119751931 /nfs/dbraw/zinc/75/19/31/1119751931.db2.gz CPMVWRVXCVEBHN-LBPRGKRZSA-N 1 1 261.390 3.517 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c1 ZINC000092009950 1119792226 /nfs/dbraw/zinc/79/22/26/1119792226.db2.gz FWCFHPGHRSZBJZ-LBPRGKRZSA-N 1 1 275.392 3.554 20 10 CHCDMO CCOC[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000177629891 1119836763 /nfs/dbraw/zinc/83/67/63/1119836763.db2.gz XLCFZZBNDLUBIT-HNNXBMFYSA-N 1 1 291.435 3.682 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2ccc(F)cc21 ZINC000177716238 1119847172 /nfs/dbraw/zinc/84/71/72/1119847172.db2.gz KOEHVQSWRAWMAC-MRXNPFEDSA-N 1 1 271.335 3.651 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2ccc(F)cc21 ZINC000177716250 1119847189 /nfs/dbraw/zinc/84/71/89/1119847189.db2.gz KOEHVQSWRAWMAC-INIZCTEOSA-N 1 1 271.335 3.651 20 10 CHCDMO C[C@H]([NH2+]CC(F)(F)C(C)(C)C)c1ccccc1O ZINC000850571948 1119983849 /nfs/dbraw/zinc/98/38/49/1119983849.db2.gz FTHLUNXYRAQHQX-JTQLQIEISA-N 1 1 257.324 3.724 20 10 CHCDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116438857 1120119129 /nfs/dbraw/zinc/11/91/29/1120119129.db2.gz RPJMEZLRRZWCGW-OAHLLOKOSA-N 1 1 258.409 3.661 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+](C)C(C)(C)C)c1O ZINC000394389053 1120121263 /nfs/dbraw/zinc/12/12/63/1120121263.db2.gz ZPPKKEDGAMUQKZ-UHFFFAOYSA-N 1 1 286.213 3.693 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001236793269 1128892701 /nfs/dbraw/zinc/89/27/01/1128892701.db2.gz JTPYKAHXMHKBMA-NXEZZACHSA-N 1 1 286.202 3.931 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)cc1O ZINC001140954441 1120145477 /nfs/dbraw/zinc/14/54/77/1120145477.db2.gz RNYJPUQKXRDVNS-UHFFFAOYSA-N 1 1 298.430 3.789 20 10 CHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000180250144 1120269723 /nfs/dbraw/zinc/26/97/23/1120269723.db2.gz XKEFECGUDUDGFX-KGLIPLIRSA-N 1 1 283.412 3.637 20 10 CHCDMO C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)c1ccc(F)cc1O ZINC000756443668 1120350229 /nfs/dbraw/zinc/35/02/29/1120350229.db2.gz TZXQCIPKWJCUDK-IGCXYCKISA-N 1 1 295.398 3.777 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141155600 1120413284 /nfs/dbraw/zinc/41/32/84/1120413284.db2.gz ARIMXXQPHCVCRR-UHFFFAOYSA-N 1 1 271.360 3.508 20 10 CHCDMO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186834463 1120676163 /nfs/dbraw/zinc/67/61/63/1120676163.db2.gz WGWKPUSFSHZRQJ-NUTKFTJISA-N 1 1 295.398 3.776 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c(O)c1 ZINC001237045366 1128952256 /nfs/dbraw/zinc/95/22/56/1128952256.db2.gz JOKSHVAPZGCUJR-LBPRGKRZSA-N 1 1 283.362 3.993 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(O)c1 ZINC001237045361 1128952765 /nfs/dbraw/zinc/95/27/65/1128952765.db2.gz JOKSHVAPZGCUJR-GFCCVEGCSA-N 1 1 283.362 3.993 20 10 CHCDMO Oc1ccccc1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000057707897 1120998852 /nfs/dbraw/zinc/99/88/52/1120998852.db2.gz LLMOOUUJDOKOPK-UHFFFAOYSA-N 1 1 282.387 3.995 20 10 CHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000317455759 1121011080 /nfs/dbraw/zinc/01/10/80/1121011080.db2.gz WXKABYFSNNYJAE-HNNXBMFYSA-N 1 1 299.414 3.772 20 10 CHCDMO CO[C@@H](C)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000182382064 1128963722 /nfs/dbraw/zinc/96/37/22/1128963722.db2.gz DLCOCQXCHGSMHW-HOTGVXAUSA-N 1 1 299.414 3.990 20 10 CHCDMO Oc1ccc(F)c(Cl)c1C[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001237123798 1128982021 /nfs/dbraw/zinc/98/20/21/1128982021.db2.gz LGCPLBWEMYMJSA-QWRGUYRKSA-N 1 1 283.774 3.807 20 10 CHCDMO C[N@H+]1CCC=C(N(c2ccccc2)c2ccc(N)cc2)C1 ZINC001175579951 1121397981 /nfs/dbraw/zinc/39/79/81/1121397981.db2.gz INWIRNUWIOUAMR-UHFFFAOYSA-N 1 1 279.387 3.626 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC001137837759 1121405590 /nfs/dbraw/zinc/40/55/90/1121405590.db2.gz TWZDCFPZOYRIAL-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC001137837759 1121405593 /nfs/dbraw/zinc/40/55/93/1121405593.db2.gz TWZDCFPZOYRIAL-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706225411 1121421426 /nfs/dbraw/zinc/42/14/26/1121421426.db2.gz IWFINHNGSNCMRB-NEPJUHHUSA-N 1 1 263.356 3.762 20 10 CHCDMO C[C@@H](c1cccs1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000893947248 1121444718 /nfs/dbraw/zinc/44/47/18/1121444718.db2.gz VKZXXVJVXOOXNM-VIFPVBQESA-N 1 1 283.343 3.925 20 10 CHCDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000893947248 1121444721 /nfs/dbraw/zinc/44/47/21/1121444721.db2.gz VKZXXVJVXOOXNM-VIFPVBQESA-N 1 1 283.343 3.925 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC000727825266 1121750578 /nfs/dbraw/zinc/75/05/78/1121750578.db2.gz XMPMZAAUHCQWDE-AWEZNQCLSA-N 1 1 285.387 3.928 20 10 CHCDMO Cn1c[nH+]c2cc(NCc3cccc4c3CCC4)ccc21 ZINC001178037697 1121765689 /nfs/dbraw/zinc/76/56/89/1121765689.db2.gz XFQUHPODLYCIHP-UHFFFAOYSA-N 1 1 277.371 3.674 20 10 CHCDMO CCn1ccnc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000732204420 1121913167 /nfs/dbraw/zinc/91/31/67/1121913167.db2.gz KZOOSTXFXVZCDS-UHFFFAOYSA-N 1 1 299.418 3.553 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](C)[C@@H]1C ZINC001179858353 1121915537 /nfs/dbraw/zinc/91/55/37/1121915537.db2.gz DBJLRRYTVWTFNH-ZFWWWQNUSA-N 1 1 260.425 3.681 20 10 CHCDMO COc1ccccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC001180489212 1121990669 /nfs/dbraw/zinc/99/06/69/1121990669.db2.gz WSJCNYIBGBYDBY-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO C[N@H+](Cc1cc(F)cc(F)c1O)[C@@H]1CCc2ccccc21 ZINC001180531718 1121995098 /nfs/dbraw/zinc/99/50/98/1121995098.db2.gz JIKQTRICQXYDKH-MRXNPFEDSA-N 1 1 289.325 3.790 20 10 CHCDMO C[N@@H+](Cc1cc(F)cc(F)c1O)[C@@H]1CCc2ccccc21 ZINC001180531718 1121995107 /nfs/dbraw/zinc/99/51/07/1121995107.db2.gz JIKQTRICQXYDKH-MRXNPFEDSA-N 1 1 289.325 3.790 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000733609737 1122001106 /nfs/dbraw/zinc/00/11/06/1122001106.db2.gz HXASFAPXLMUONC-KRWDZBQOSA-N 1 1 270.420 3.826 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(O)cc2O)cc1 ZINC001204275659 1122001456 /nfs/dbraw/zinc/00/14/56/1122001456.db2.gz XWBQHJLPQFFNKY-KRWDZBQOSA-N 1 1 283.371 3.743 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001180673489 1122004367 /nfs/dbraw/zinc/00/43/67/1122004367.db2.gz OLAOFOVTMCWWLH-LBPRGKRZSA-N 1 1 296.405 3.899 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCCCCCCC1 ZINC000322041421 1122016329 /nfs/dbraw/zinc/01/63/29/1122016329.db2.gz GPYFBEYZVWOXJV-UHFFFAOYSA-N 1 1 251.345 3.688 20 10 CHCDMO C[C@H]1CC[C@@H](C[NH2+]Cc2ccc(Cl)cc2O)C1 ZINC001181399749 1122054222 /nfs/dbraw/zinc/05/42/22/1122054222.db2.gz MBYXIZQUTFBDSU-WDEREUQCSA-N 1 1 253.773 3.571 20 10 CHCDMO CSC1(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001181555410 1122063891 /nfs/dbraw/zinc/06/38/91/1122063891.db2.gz MIDJQNQOEYAZAP-UHFFFAOYSA-N 1 1 290.476 3.614 20 10 CHCDMO CCOC[C@@H]1CCCC[N@H+]1Cc1c(O)cc(C)cc1Cl ZINC001182284857 1122130779 /nfs/dbraw/zinc/13/07/79/1122130779.db2.gz IXIIYQWPKPGIJO-ZDUSSCGKSA-N 1 1 297.826 3.745 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC001182575065 1122176127 /nfs/dbraw/zinc/17/61/27/1122176127.db2.gz VVJKFTGWRMKSKD-TZMCWYRMSA-N 1 1 289.325 3.564 20 10 CHCDMO CCC(C)(C)OC1C[NH+](Cc2cc(C(C)C)ccc2O)C1 ZINC001182918303 1122195815 /nfs/dbraw/zinc/19/58/15/1122195815.db2.gz MIYIXLMCNQADTH-UHFFFAOYSA-N 1 1 291.435 3.905 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@@H]2CC2(C)C)c(Cl)c1 ZINC001183074291 1122201780 /nfs/dbraw/zinc/20/17/80/1122201780.db2.gz DIKSQLBZMIREMS-NSHDSACASA-N 1 1 267.800 3.832 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)c(O)c1 ZINC000162717479 1122202877 /nfs/dbraw/zinc/20/28/77/1122202877.db2.gz PEOHLFCCAJHLAM-CQSZACIVSA-N 1 1 289.400 3.799 20 10 CHCDMO C[C@@H](C[N@@H+](C)Cc1c(O)cccc1Cl)c1nccs1 ZINC000273150053 1122222116 /nfs/dbraw/zinc/22/21/16/1122222116.db2.gz HKVCDFXDLKYUTO-JTQLQIEISA-N 1 1 296.823 3.738 20 10 CHCDMO Oc1cccc2c1C[N@H+](C/C=C\c1ccc(F)cc1F)C2 ZINC001183453704 1122223653 /nfs/dbraw/zinc/22/36/53/1122223653.db2.gz GJTKTCSQRVCXRA-RQOWECAXSA-N 1 1 287.309 3.699 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C/C=C\c1ccc(F)cc1F)C2 ZINC001183453704 1122223657 /nfs/dbraw/zinc/22/36/57/1122223657.db2.gz GJTKTCSQRVCXRA-RQOWECAXSA-N 1 1 287.309 3.699 20 10 CHCDMO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)CCO1 ZINC000273354420 1122228968 /nfs/dbraw/zinc/22/89/68/1122228968.db2.gz CHUHSRZFOXEGLI-VHDGCEQUSA-N 1 1 295.398 3.776 20 10 CHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000825321977 1122427297 /nfs/dbraw/zinc/42/72/97/1122427297.db2.gz TYIPKVXEYXMKPF-CYBMUJFWSA-N 1 1 297.826 3.603 20 10 CHCDMO Cc1cc(C)cc(C[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000775147302 1122443995 /nfs/dbraw/zinc/44/39/95/1122443995.db2.gz BFVKCIJKSNLWGY-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1cc(C[N@H+]2CC(C)(C)C2(C)C)ccc1N(C)C ZINC001191390892 1122595080 /nfs/dbraw/zinc/59/50/80/1122595080.db2.gz SCLZYFGFINSEEY-UHFFFAOYSA-N 1 1 260.425 3.681 20 10 CHCDMO CC[C@@H]([NH2+]Cc1occc1C)c1ccc(F)cc1O ZINC000293637069 1122716299 /nfs/dbraw/zinc/71/62/99/1122716299.db2.gz KNLGWYYDASUURT-CYBMUJFWSA-N 1 1 263.312 3.674 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1O ZINC000775633291 1122837278 /nfs/dbraw/zinc/83/72/78/1122837278.db2.gz HQKQDDSJUDJYEW-MRXNPFEDSA-N 1 1 253.345 3.648 20 10 CHCDMO Cc1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC000775650345 1122865167 /nfs/dbraw/zinc/86/51/67/1122865167.db2.gz YNRSZSYUDPHYCR-QGZVFWFLSA-N 1 1 299.439 3.991 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]2C2CC2)c1O ZINC000775677154 1122901269 /nfs/dbraw/zinc/90/12/69/1122901269.db2.gz HYIOATRCGSAIDK-AWEZNQCLSA-N 1 1 265.784 3.728 20 10 CHCDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682508 1122901819 /nfs/dbraw/zinc/90/18/19/1122901819.db2.gz ZNJYCOGTWUHNEW-QWHCGFSZSA-N 1 1 277.408 3.800 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000775723510 1122924964 /nfs/dbraw/zinc/92/49/64/1122924964.db2.gz HICQJELAMBRUPG-UONOGXRCSA-N 1 1 297.851 3.906 20 10 CHCDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000775732057 1122928912 /nfs/dbraw/zinc/92/89/12/1122928912.db2.gz LORGETNJVBQSEM-CZUORRHYSA-N 1 1 277.408 3.801 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC2(CCCC2)CC1 ZINC000160232645 1122947620 /nfs/dbraw/zinc/94/76/20/1122947620.db2.gz VVYSYCVKDZNHLA-UHFFFAOYSA-N 1 1 263.356 3.688 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2C[C@H](C)CC2(C)C)cc1 ZINC001197360113 1122954192 /nfs/dbraw/zinc/95/41/92/1122954192.db2.gz UWZNKLBMLFQNAF-CQSZACIVSA-N 1 1 260.425 3.763 20 10 CHCDMO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccc(N(C)C)cc1 ZINC000775830482 1122984671 /nfs/dbraw/zinc/98/46/71/1122984671.db2.gz KAONJBUKQIHSOM-MJWAUXSNSA-N 1 1 273.207 3.722 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCC3(CC(F)C3)CC2)cc1 ZINC001203937882 1123034278 /nfs/dbraw/zinc/03/42/78/1123034278.db2.gz XEGWWQZBPFJDPH-UHFFFAOYSA-N 1 1 290.426 3.857 20 10 CHCDMO CCc1cc(OC)ccc1CNc1ccc2c(c1)[nH+]cn2C ZINC001201114603 1123073989 /nfs/dbraw/zinc/07/39/89/1123073989.db2.gz JBWKJCXVXGYWRK-UHFFFAOYSA-N 1 1 295.386 3.756 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC=CCC1 ZINC001201428518 1123100172 /nfs/dbraw/zinc/10/01/72/1123100172.db2.gz QMKRMOGOIMPZHI-MRXNPFEDSA-N 1 1 272.436 3.931 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(C)cc(Br)c1O)C1CC1 ZINC000850381390 1123261030 /nfs/dbraw/zinc/26/10/30/1123261030.db2.gz DEOUBMQZTNKNOH-CYBMUJFWSA-N 1 1 298.224 3.741 20 10 CHCDMO COCc1csc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000850532488 1123286380 /nfs/dbraw/zinc/28/63/80/1123286380.db2.gz MKBUCCYRYVRVRQ-JTQLQIEISA-N 1 1 295.379 3.590 20 10 CHCDMO CC(C)CC1([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000850566335 1123293553 /nfs/dbraw/zinc/29/35/53/1123293553.db2.gz LRFQIJXBNXYPIB-NSHDSACASA-N 1 1 251.345 3.761 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000749840177 1123393509 /nfs/dbraw/zinc/39/35/09/1123393509.db2.gz JRPMZSVQRDUSDX-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)CC2CC(F)(F)C2)c1O ZINC001237686044 1129128163 /nfs/dbraw/zinc/12/81/63/1129128163.db2.gz GDWLMTSXHCTDRT-UHFFFAOYSA-N 1 1 289.753 3.831 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)CC2)c1O ZINC000228631210 1123634465 /nfs/dbraw/zinc/63/44/65/1123634465.db2.gz HLIBFECXFGVBKI-LLVKDONJSA-N 1 1 283.799 3.676 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000228630092 1123634516 /nfs/dbraw/zinc/63/45/16/1123634516.db2.gz XNMFLNZZYHFXNK-LLVKDONJSA-N 1 1 283.799 3.676 20 10 CHCDMO CCCC[N@@H+](Cc1ccnc(F)c1)Cc1ccccc1O ZINC000859296611 1123694178 /nfs/dbraw/zinc/69/41/78/1123694178.db2.gz MBYOIGUPRCMJLD-UHFFFAOYSA-N 1 1 288.366 3.729 20 10 CHCDMO C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2ccccc2c1[O-] ZINC000194987770 1129140510 /nfs/dbraw/zinc/14/05/10/1129140510.db2.gz REHDTCVHYYGHRY-CQSZACIVSA-N 1 1 298.430 3.538 20 10 CHCDMO CCC[N@@H+](Cc1cccc2n[nH]cc21)Cc1ccccc1O ZINC000862237389 1123794007 /nfs/dbraw/zinc/79/40/07/1123794007.db2.gz NLMDCYSUIFCAHL-UHFFFAOYSA-N 1 1 295.386 3.681 20 10 CHCDMO CCCC[N@@H+](Cc1nc(C)c(C)[nH]1)Cc1ccccc1O ZINC000862354906 1123801196 /nfs/dbraw/zinc/80/11/96/1123801196.db2.gz AECYHCRTBYOPPM-UHFFFAOYSA-N 1 1 287.407 3.534 20 10 CHCDMO CN(C)c1ccc(/C=C\Cn2c[nH+]c3c2CCCC3)cc1 ZINC000862432285 1123808662 /nfs/dbraw/zinc/80/86/62/1123808662.db2.gz XUCDQUWXVFCNQI-WAYWQWQTSA-N 1 1 281.403 3.541 20 10 CHCDMO CCC(O)(CC)C[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000862538687 1123818153 /nfs/dbraw/zinc/81/81/53/1123818153.db2.gz CPNHVNMDZFUDRE-UHFFFAOYSA-N 1 1 287.403 3.528 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccccc2)c1 ZINC000119380991 1123858732 /nfs/dbraw/zinc/85/87/32/1123858732.db2.gz SALXSSZFKOMOMW-CQSZACIVSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC3(CCC3)C[C@H]2C)c1O ZINC000763644825 1129150764 /nfs/dbraw/zinc/15/07/64/1129150764.db2.gz ADRZVTADAVHPDK-LLVKDONJSA-N 1 1 295.810 3.819 20 10 CHCDMO Oc1c(Cl)cc(Cl)cc1CNc1[nH+]ccn1C1CC1 ZINC000840887896 1124003044 /nfs/dbraw/zinc/00/30/44/1124003044.db2.gz ZYSLIVHKDWLSGI-UHFFFAOYSA-N 1 1 298.173 3.843 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CCSC1)c1ccc(Cl)cc1O ZINC000866403881 1124063670 /nfs/dbraw/zinc/06/36/70/1124063670.db2.gz SLDHLVWHHLXMKI-MNOVXSKESA-N 1 1 285.840 3.839 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cc(F)cc(F)c1O ZINC000866450762 1124067588 /nfs/dbraw/zinc/06/75/88/1124067588.db2.gz ZARFCCWCPZXOCW-LJUAHTATSA-N 1 1 273.298 3.602 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccc(C)o1)c1ccc(F)cc1O ZINC000866478536 1124070393 /nfs/dbraw/zinc/07/03/93/1124070393.db2.gz JJTZMPOZQYYOCH-AWEZNQCLSA-N 1 1 263.312 3.674 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000184233263 1129177539 /nfs/dbraw/zinc/17/75/39/1129177539.db2.gz WDNHNJAAKHGTPS-AWEZNQCLSA-N 1 1 293.407 3.564 20 10 CHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccncc1 ZINC000123383302 1124589152 /nfs/dbraw/zinc/58/91/52/1124589152.db2.gz TWKFDZGYWXYJCW-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccncc1 ZINC000123383302 1124589157 /nfs/dbraw/zinc/58/91/57/1124589157.db2.gz TWKFDZGYWXYJCW-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872262124 1124702126 /nfs/dbraw/zinc/70/21/26/1124702126.db2.gz QDHUSCDMNKWFOZ-KRWDZBQOSA-N 1 1 289.419 3.624 20 10 CHCDMO CCCC[N@@H+](Cc1ccns1)Cc1ccccc1O ZINC000877503635 1125037138 /nfs/dbraw/zinc/03/71/38/1125037138.db2.gz RZIALGXENFZSRW-UHFFFAOYSA-N 1 1 276.405 3.651 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)cc1O)[C@@H](C)c1cccnc1 ZINC000877532190 1125040416 /nfs/dbraw/zinc/04/04/16/1125040416.db2.gz SUECZHVKRJBVCS-AWEZNQCLSA-N 1 1 270.376 3.679 20 10 CHCDMO C[C@H](C[N@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877702964 1125066515 /nfs/dbraw/zinc/06/65/15/1125066515.db2.gz MLRZJTWCALLCEX-CYBMUJFWSA-N 1 1 253.345 3.512 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2C[C@H](C)CC[C@@H]2C)c1O ZINC000228667692 1125250740 /nfs/dbraw/zinc/25/07/40/1125250740.db2.gz DBHQOHCKZFQTJF-MNOVXSKESA-N 1 1 283.799 3.675 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCc2ccccc2C1 ZINC000211486143 1125306938 /nfs/dbraw/zinc/30/69/38/1125306938.db2.gz PKGXQWNXWQFBIE-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)o1 ZINC000882903818 1125361483 /nfs/dbraw/zinc/36/14/83/1125361483.db2.gz KKZLPNCKDXWDNS-NOZJJQNGSA-N 1 1 293.313 3.677 20 10 CHCDMO Cc1cccc(C)c1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883048488 1125369560 /nfs/dbraw/zinc/36/95/60/1125369560.db2.gz PQKXNEGUSSPVEI-UHFFFAOYSA-N 1 1 277.314 3.577 20 10 CHCDMO CC[N@H+](Cc1cc(Cl)ccc1O)C1CCCC1 ZINC000132152058 1125415435 /nfs/dbraw/zinc/41/54/35/1125415435.db2.gz PZEHMLIGEHXSOZ-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO CC[N@@H+](Cc1cc(Cl)ccc1O)C1CCCC1 ZINC000132152058 1125415437 /nfs/dbraw/zinc/41/54/37/1125415437.db2.gz PZEHMLIGEHXSOZ-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000132817236 1125422921 /nfs/dbraw/zinc/42/29/21/1125422921.db2.gz RHGRXSWZJQCHLN-INIZCTEOSA-N 1 1 259.393 3.855 20 10 CHCDMO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(F)c(Cl)cc1O ZINC001237947516 1129225032 /nfs/dbraw/zinc/22/50/32/1129225032.db2.gz QIUVRLSLORTTJW-UWVGGRQHSA-N 1 1 271.763 3.948 20 10 CHCDMO CC[C@H]([NH2+]CCc1ccc(C)nc1)c1ccc(F)cc1O ZINC000796762406 1129273976 /nfs/dbraw/zinc/27/39/76/1129273976.db2.gz RQERTVFYLFMDIS-INIZCTEOSA-N 1 1 288.366 3.518 20 10 CHCDMO CCOc1cccc(C[N@@H+]([C@H](C)C2CC2)C2CC2)c1O ZINC000092009597 1129377420 /nfs/dbraw/zinc/37/74/20/1129377420.db2.gz ZVIBAUIOOYTHHA-GFCCVEGCSA-N 1 1 275.392 3.554 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738257255 1129391548 /nfs/dbraw/zinc/39/15/48/1129391548.db2.gz VQYOTGVQTMKCEY-AWEZNQCLSA-N 1 1 284.403 3.953 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2cccnc2)cc1 ZINC000738300210 1129392125 /nfs/dbraw/zinc/39/21/25/1129392125.db2.gz UTLODTFGGIHIAN-UHFFFAOYSA-N 1 1 297.446 3.602 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1ccc(F)cc1O ZINC000248490335 1129419744 /nfs/dbraw/zinc/41/97/44/1129419744.db2.gz IBJKRORTWGEZRJ-GIYVSIDVSA-N 1 1 297.373 3.768 20 10 CHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861681 1129421065 /nfs/dbraw/zinc/42/10/65/1129421065.db2.gz QXGUYJRCLQFRBM-DLBZAZTESA-N 1 1 291.435 3.644 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)cc1C ZINC000093324682 1129421080 /nfs/dbraw/zinc/42/10/80/1129421080.db2.gz LMYQKRKXEJPWBG-HNNXBMFYSA-N 1 1 299.414 3.778 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2cccn2C)c1 ZINC000093845512 1129428517 /nfs/dbraw/zinc/42/85/17/1129428517.db2.gz VGHDGPYBMCKZMK-QGZVFWFLSA-N 1 1 284.403 3.766 20 10 CHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868900 1129428749 /nfs/dbraw/zinc/42/87/49/1129428749.db2.gz PTYRMXCXPXMXPZ-CABCVRRESA-N 1 1 279.449 3.807 20 10 CHCDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc(N(C)C)cc1 ZINC000746136880 1129626956 /nfs/dbraw/zinc/62/69/56/1129626956.db2.gz KUMHGAOLDVPWTC-UHFFFAOYSA-N 1 1 297.446 3.602 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Br)ccc1O ZINC000097814917 1129629983 /nfs/dbraw/zinc/62/99/83/1129629983.db2.gz YSERRPMMHCTHGS-PHIMTYICSA-N 1 1 298.224 3.918 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)o1 ZINC000768131257 1129834490 /nfs/dbraw/zinc/83/44/90/1129834490.db2.gz ZGQTYNDPFPKRJQ-UHFFFAOYSA-N 1 1 272.392 3.594 20 10 CHCDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1c(O)cccc1Cl ZINC000768199819 1129839629 /nfs/dbraw/zinc/83/96/29/1129839629.db2.gz ZITJNQYMTMYDNE-HNNXBMFYSA-N 1 1 290.794 3.721 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000768193821 1129842475 /nfs/dbraw/zinc/84/24/75/1129842475.db2.gz RICIQDSLOLCBMD-UHFFFAOYSA-N 1 1 297.807 3.748 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@@H+](C1CC1)C1CCCC1 ZINC000768252766 1129846422 /nfs/dbraw/zinc/84/64/22/1129846422.db2.gz OZUBRPXWGXDRAJ-UHFFFAOYSA-N 1 1 265.784 3.953 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCSC2)cc1F ZINC000768263617 1129848257 /nfs/dbraw/zinc/84/82/57/1129848257.db2.gz VWLZOICLKWPPAS-AWEZNQCLSA-N 1 1 296.455 3.609 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c1 ZINC000768261223 1129848279 /nfs/dbraw/zinc/84/82/79/1129848279.db2.gz AFAOMFMVSACQIQ-DZGCQCFKSA-N 1 1 277.408 3.801 20 10 CHCDMO CC(C)[N@@H+](Cc1ccn(C)c1)Cc1ccc(N(C)C)cc1 ZINC000768351867 1129852242 /nfs/dbraw/zinc/85/22/42/1129852242.db2.gz LJSQAWNUSWSUSC-UHFFFAOYSA-N 1 1 285.435 3.502 20 10 CHCDMO CC[N@@H+](CCc1ccccc1)Cc1cc(OC)c(C)cc1O ZINC000768440229 1129856505 /nfs/dbraw/zinc/85/65/05/1129856505.db2.gz UODSFOBEUQGRMO-UHFFFAOYSA-N 1 1 299.414 3.774 20 10 CHCDMO CC(C)OCCC[N@@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000768449306 1129857509 /nfs/dbraw/zinc/85/75/09/1129857509.db2.gz ZCBYFECISBYSJR-UHFFFAOYSA-N 1 1 291.435 3.518 20 10 CHCDMO CCC1(CC)C[N@@H+](Cc2cccc(OC)c2O)CCS1 ZINC000768529398 1129860139 /nfs/dbraw/zinc/86/01/39/1129860139.db2.gz VPAIYAUTKXBUGN-UHFFFAOYSA-N 1 1 295.448 3.508 20 10 CHCDMO CCOc1ccc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c(O)c1 ZINC000768533360 1129860836 /nfs/dbraw/zinc/86/08/36/1129860836.db2.gz VTWWXQNEIFEFCN-LBPRGKRZSA-N 1 1 275.392 3.554 20 10 CHCDMO CC(C)[N@H+](Cc1c(O)cccc1Cl)CC1CC1 ZINC000768675804 1129865708 /nfs/dbraw/zinc/86/57/08/1129865708.db2.gz VVYIADKTIGKXJR-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000768848450 1129877618 /nfs/dbraw/zinc/87/76/18/1129877618.db2.gz CDKSJYFAYYXNLN-BPUTZDHNSA-N 1 1 289.419 3.801 20 10 CHCDMO CC[C@@H]1COCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000768882132 1129879518 /nfs/dbraw/zinc/87/95/18/1129879518.db2.gz QALPZBCPNMTURP-GOSISDBHSA-N 1 1 297.398 3.670 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1 ZINC000768930231 1129882589 /nfs/dbraw/zinc/88/25/89/1129882589.db2.gz NQWDGQCZKNOKOB-AWEZNQCLSA-N 1 1 283.371 3.656 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCOc3ccccc3[C@H]2C)c1 ZINC000768930232 1129882818 /nfs/dbraw/zinc/88/28/18/1129882818.db2.gz NQWDGQCZKNOKOB-CQSZACIVSA-N 1 1 283.371 3.656 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)C1Cc2ccccc2C1 ZINC000769033733 1129886522 /nfs/dbraw/zinc/88/65/22/1129886522.db2.gz NEASIQBAGDSYKK-UHFFFAOYSA-N 1 1 287.790 3.645 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CC(C)(C)[C@@H]1c1ccccc1 ZINC000769084669 1129890551 /nfs/dbraw/zinc/89/05/51/1129890551.db2.gz JNCUHEYEHGRQGF-SFHVURJKSA-N 1 1 297.398 3.984 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3C)C2)c1 ZINC000769231407 1129895944 /nfs/dbraw/zinc/89/59/44/1129895944.db2.gz ATJHJUMJZBJLTF-MRXNPFEDSA-N 1 1 281.399 3.999 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000769319137 1129902588 /nfs/dbraw/zinc/90/25/88/1129902588.db2.gz RIVGGOCCWABTDF-OAHLLOKOSA-N 1 1 297.398 3.670 20 10 CHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)[C@@H]2CCOC2)cc1 ZINC000769331643 1129903155 /nfs/dbraw/zinc/90/31/55/1129903155.db2.gz VFVRVJARGSTKFG-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000769353025 1129904055 /nfs/dbraw/zinc/90/40/55/1129904055.db2.gz RHHMCFYAKXONLH-AWEZNQCLSA-N 1 1 267.372 3.820 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000769353156 1129904246 /nfs/dbraw/zinc/90/42/46/1129904246.db2.gz SYNNKAUQELVVCU-CQSZACIVSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(C[N@H+]2CCCC3(CCCCC3)C2)c1O ZINC000769405424 1129907193 /nfs/dbraw/zinc/90/71/93/1129907193.db2.gz VFKWKDFEWPBHLQ-UHFFFAOYSA-N 1 1 289.419 3.947 20 10 CHCDMO CCOc1ccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC000769482773 1129909296 /nfs/dbraw/zinc/90/92/96/1129909296.db2.gz HYGNJLBSKFSLMM-AWEZNQCLSA-N 1 1 297.398 3.738 20 10 CHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)CC[C@H](C)O)cc1 ZINC000769452443 1129910984 /nfs/dbraw/zinc/91/09/84/1129910984.db2.gz RPTJEFKCXNKKBT-INIZCTEOSA-N 1 1 292.467 3.516 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)c1O ZINC000769452313 1129911101 /nfs/dbraw/zinc/91/11/01/1129911101.db2.gz WFTWRKAGZIDEEO-KBPBESRZSA-N 1 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C[N@@H+](Cc1nccs1)Cc1cccc(C(C)(C)C)c1O ZINC001143111890 1132503987 /nfs/dbraw/zinc/50/39/87/1132503987.db2.gz HVIMHACICFCTEZ-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO C[N@@H+](Cc1cccc2ncsc21)Cc1ccccc1O ZINC001232736112 1132513018 /nfs/dbraw/zinc/51/30/18/1132513018.db2.gz IZSCWNUSQSRQAS-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc(N(C)C)cc1O ZINC001232840938 1132529485 /nfs/dbraw/zinc/52/94/85/1132529485.db2.gz NKUMFFGRHBLRTD-UHFFFAOYSA-N 1 1 298.430 3.789 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001232840453 1132529514 /nfs/dbraw/zinc/52/95/14/1132529514.db2.gz XOSMRRLOCKPUFL-WMLDXEAASA-N 1 1 288.435 3.613 20 10 CHCDMO C[N@@H+](Cc1c([O-])cc(Br)cc1F)C(C)(C)C ZINC001233030839 1132566054 /nfs/dbraw/zinc/56/60/54/1132566054.db2.gz OVRDPFPATOZSPE-UHFFFAOYSA-N 1 1 290.176 3.524 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCc3ccncc3C2)c1 ZINC001233286191 1132595731 /nfs/dbraw/zinc/59/57/31/1132595731.db2.gz JGWVGKJSBGDCKZ-UHFFFAOYSA-N 1 1 296.414 3.643 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419503 1132621755 /nfs/dbraw/zinc/62/17/55/1132621755.db2.gz ZWEIGLYAACWYKE-UHFFFAOYSA-N 1 1 273.298 3.643 20 10 CHCDMO Cc1cccc(CNc2[nH+]cnc3c2ccn3C(C)C)c1O ZINC001160769271 1132980680 /nfs/dbraw/zinc/98/06/80/1132980680.db2.gz DQXJFOQCTVVHMX-UHFFFAOYSA-N 1 1 296.374 3.638 20 10 CHCDMO CCc1ccc(NCc2cc(F)c(N(C)C)cc2F)[nH+]c1 ZINC001203465290 1133331256 /nfs/dbraw/zinc/33/12/56/1133331256.db2.gz WPWIYSSDZZFLDX-UHFFFAOYSA-N 1 1 291.345 3.600 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)C/C=C/c2ccccc2)c1O ZINC001203614029 1133344266 /nfs/dbraw/zinc/34/42/66/1133344266.db2.gz NKSITEQZCZVTBU-DHZHZOJOSA-N 1 1 297.398 3.936 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCC3(CCC3)C2)c1O ZINC001203614640 1133344819 /nfs/dbraw/zinc/34/48/19/1133344819.db2.gz CQCZACBADUAZNK-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1ccc(OC)cc1O ZINC001203629990 1133345873 /nfs/dbraw/zinc/34/58/73/1133345873.db2.gz PTLHQNZBOBRMQP-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203881200 1133378319 /nfs/dbraw/zinc/37/83/19/1133378319.db2.gz NHECBRXPGRZIEK-NSHDSACASA-N 1 1 291.778 3.944 20 10 CHCDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(O)c(O)c1 ZINC001203881200 1133378326 /nfs/dbraw/zinc/37/83/26/1133378326.db2.gz NHECBRXPGRZIEK-NSHDSACASA-N 1 1 291.778 3.944 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@](C)(CF)C2)cc1 ZINC001203940627 1133385836 /nfs/dbraw/zinc/38/58/36/1133385836.db2.gz RTGDFWQCMWOKEU-QGZVFWFLSA-N 1 1 278.415 3.714 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)cc1 ZINC001203939954 1133385905 /nfs/dbraw/zinc/38/59/05/1133385905.db2.gz GUSXOEQCQBWSMQ-SJORKVTESA-N 1 1 296.405 3.805 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)cc1 ZINC001203939954 1133385908 /nfs/dbraw/zinc/38/59/08/1133385908.db2.gz GUSXOEQCQBWSMQ-SJORKVTESA-N 1 1 296.405 3.805 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2cccc(F)c2)cc1 ZINC001203937083 1133386337 /nfs/dbraw/zinc/38/63/37/1133386337.db2.gz JXBJAWNWZBLICT-UHFFFAOYSA-N 1 1 286.394 3.566 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1C[C@H]1C1CCCC1 ZINC001204089791 1133408057 /nfs/dbraw/zinc/40/80/57/1133408057.db2.gz RAEPUQGRAZYYLS-RISCZKNCSA-N 1 1 281.346 3.586 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C2CC2)c2ccccc21 ZINC001204232608 1133423235 /nfs/dbraw/zinc/42/32/35/1133423235.db2.gz GFBDVADDHZDMAP-UHFFFAOYSA-N 1 1 254.377 3.500 20 10 CHCDMO CCC[N@@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204232832 1133423307 /nfs/dbraw/zinc/42/33/07/1133423307.db2.gz JXIZOKXDMYESOM-UHFFFAOYSA-N 1 1 256.393 3.748 20 10 CHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001204323773 1133436682 /nfs/dbraw/zinc/43/66/82/1133436682.db2.gz JAJPKDRZANNJNH-QZTJIDSGSA-N 1 1 284.447 3.909 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC001204321163 1133437302 /nfs/dbraw/zinc/43/73/02/1133437302.db2.gz HHQZIIRPZPFCKS-HZPDHXFCSA-N 1 1 272.436 3.907 20 10 CHCDMO C[C@]1(F)CC[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1F ZINC001204324783 1133437747 /nfs/dbraw/zinc/43/77/47/1133437747.db2.gz OMZYAQXVCMFDML-SJORKVTESA-N 1 1 294.389 3.559 20 10 CHCDMO C[C@]1(F)CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1F ZINC001204324783 1133437751 /nfs/dbraw/zinc/43/77/51/1133437751.db2.gz OMZYAQXVCMFDML-SJORKVTESA-N 1 1 294.389 3.559 20 10 CHCDMO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C(C)(C)C ZINC001205998159 1133640277 /nfs/dbraw/zinc/64/02/77/1133640277.db2.gz JTTXSGLFDFIATK-CMDGGOBGSA-N 1 1 260.425 3.886 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1cc(Cl)ccc1F)CC2 ZINC001206028029 1133644401 /nfs/dbraw/zinc/64/44/01/1133644401.db2.gz IMYVNETUPRQDBE-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cc(Cl)ccc1F)CC2 ZINC001206028029 1133644404 /nfs/dbraw/zinc/64/44/04/1133644404.db2.gz IMYVNETUPRQDBE-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CCC1(c2ccccc2)C[NH+](Cc2cccc(F)c2O)C1 ZINC001206224481 1133672816 /nfs/dbraw/zinc/67/28/16/1133672816.db2.gz SDQIXZXIFQIXMT-UHFFFAOYSA-N 1 1 285.362 3.695 20 10 CHCDMO Cc1ccc(C[NH2+]Cc2c(O)cccc2F)c(Cl)c1 ZINC001207622612 1133831591 /nfs/dbraw/zinc/83/15/91/1133831591.db2.gz OPIMRRAFZVMNBT-UHFFFAOYSA-N 1 1 279.742 3.783 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1CCSCC1 ZINC001207756648 1133845989 /nfs/dbraw/zinc/84/59/89/1133845989.db2.gz KTTWMGWCUFCGDG-UHFFFAOYSA-N 1 1 292.492 3.718 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000166373250 1133916342 /nfs/dbraw/zinc/91/63/42/1133916342.db2.gz BHIZMTGXBIWCPY-AWEZNQCLSA-N 1 1 271.335 3.521 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000166373250 1133916346 /nfs/dbraw/zinc/91/63/46/1133916346.db2.gz BHIZMTGXBIWCPY-AWEZNQCLSA-N 1 1 271.335 3.521 20 10 CHCDMO CC[N@@H+](CCCc1ccc(F)cc1)Cc1ccccc1O ZINC001208775973 1133943315 /nfs/dbraw/zinc/94/33/15/1133943315.db2.gz XHWVXGGMTPYZEG-UHFFFAOYSA-N 1 1 287.378 3.986 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC001209517007 1134032179 /nfs/dbraw/zinc/03/21/79/1134032179.db2.gz WKIFWMWXKZWGND-CALCHBBNSA-N 1 1 266.388 3.546 20 10 CHCDMO C[N@@H+](Cc1c[nH]c2cc(F)ccc12)Cc1ccccc1O ZINC001209693933 1134052429 /nfs/dbraw/zinc/05/24/29/1134052429.db2.gz FGWQLMMSVKKXSS-UHFFFAOYSA-N 1 1 284.334 3.645 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1c(F)cccc1Cl)CC2 ZINC000090558634 180004674 /nfs/dbraw/zinc/00/46/74/180004674.db2.gz UMUGXKYHDMKIOF-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1c(F)cccc1Cl)CC2 ZINC000090558634 180004675 /nfs/dbraw/zinc/00/46/75/180004675.db2.gz UMUGXKYHDMKIOF-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2ccco2)c1O ZINC000184679027 262026316 /nfs/dbraw/zinc/02/63/16/262026316.db2.gz YKQRWCIZUFIMMM-JTQLQIEISA-N 1 1 295.766 3.840 20 10 CHCDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000274273979 328210446 /nfs/dbraw/zinc/21/04/46/328210446.db2.gz XBSCIZOHKHYCDB-YUMQZZPRSA-N 1 1 297.811 3.617 20 10 CHCDMO CCC[N@@H+](Cc1ccnc(C)c1)Cc1ccccc1O ZINC000527535754 330263173 /nfs/dbraw/zinc/26/31/73/330263173.db2.gz SSULHDWTAIAOHA-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(F)c1O ZINC000164960666 331305430 /nfs/dbraw/zinc/30/54/30/331305430.db2.gz BXAHQVIXAJCQLZ-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@H](C)c1cccnc1 ZINC000290656207 521286056 /nfs/dbraw/zinc/28/60/56/521286056.db2.gz ZJAIZEKOEOIVQA-OAHLLOKOSA-N 1 1 284.403 3.987 20 10 CHCDMO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cccc(C)c1O ZINC000280888831 523558989 /nfs/dbraw/zinc/55/89/89/523558989.db2.gz DEBLYLWUXRSTEG-MRXNPFEDSA-N 1 1 299.418 3.644 20 10 CHCDMO Cc1cccc(CNc2cc(C3CC3)cc[nH+]2)c1O ZINC000290905397 524440911 /nfs/dbraw/zinc/44/09/11/524440911.db2.gz MMEHUGDEWPCJBI-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000062744930 524594463 /nfs/dbraw/zinc/59/44/63/524594463.db2.gz PMSUUIQUVCCWPE-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000279940520 526330493 /nfs/dbraw/zinc/33/04/93/526330493.db2.gz YSWCINSKRFDYLX-MRXNPFEDSA-N 1 1 289.325 3.838 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)[C@H](C)C1 ZINC000707145792 1118648076 /nfs/dbraw/zinc/64/80/76/1118648076.db2.gz HJJZHDSLWDVUJY-GHMZBOCLSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)CCCO)c1cc(Cl)c(Cl)cc1O ZINC000192949842 1119340622 /nfs/dbraw/zinc/34/06/22/1119340622.db2.gz CDZDJEMBHRJCLQ-DTWKUNHWSA-N 1 1 292.206 3.511 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(Cl)cc1O ZINC000850571699 1123295706 /nfs/dbraw/zinc/29/57/06/1123295706.db2.gz UBUUVTHZKOGOFD-QWRGUYRKSA-N 1 1 283.799 3.511 20 10 CHCDMO CC[C@H]([NH2+]C1(C2CCC2)CC1)c1ccc(F)cc1O ZINC000846208161 1131695893 /nfs/dbraw/zinc/69/58/93/1131695893.db2.gz WDRXAMPXWHQUSN-AWEZNQCLSA-N 1 1 263.356 3.905 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCC[C@H]1F ZINC000840962774 1132314390 /nfs/dbraw/zinc/31/43/90/1132314390.db2.gz NESJOQYFMGEGGM-GHMZBOCLSA-N 1 1 275.726 3.555 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccsc2)cc1Cl ZINC001232269617 1132447833 /nfs/dbraw/zinc/44/78/33/1132447833.db2.gz HFASVPVQVXFJQT-UHFFFAOYSA-N 1 1 297.807 3.748 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc(F)c1F)CC1CCCCC1 ZINC001233335481 1132603804 /nfs/dbraw/zinc/60/38/04/1132603804.db2.gz WYZJLTIQMBTEDT-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO C[N@H+](Cc1c(O)ccc(F)c1F)CC1CCCCC1 ZINC001233335481 1132603811 /nfs/dbraw/zinc/60/38/11/1132603811.db2.gz WYZJLTIQMBTEDT-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO CC(C)C(C)(C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000219274497 1125675590 /nfs/dbraw/zinc/67/55/90/1125675590.db2.gz BCLKBAUGKIMSFP-LLVKDONJSA-N 1 1 253.361 3.864 20 10 CHCDMO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886491742 1125680126 /nfs/dbraw/zinc/68/01/26/1125680126.db2.gz OPANHAUOGGXUJG-NEPJUHHUSA-N 1 1 289.350 3.952 20 10 CHCDMO CO[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886508831 1125681942 /nfs/dbraw/zinc/68/19/42/1125681942.db2.gz OEWPTTQFQHSQTN-BLLLJJGKSA-N 1 1 289.350 3.570 20 10 CHCDMO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886561799 1125691671 /nfs/dbraw/zinc/69/16/71/1125691671.db2.gz JKODCZZBYJHLKW-RYUDHWBXSA-N 1 1 288.366 3.901 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1c(O)cccc1F ZINC000886607369 1125696368 /nfs/dbraw/zinc/69/63/68/1125696368.db2.gz QLCDOXIKXVRLRJ-DOMZBBRYSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1c(O)cccc1F ZINC000886607371 1125696763 /nfs/dbraw/zinc/69/67/63/1125696763.db2.gz QLCDOXIKXVRLRJ-SWLSCSKDSA-N 1 1 293.382 3.531 20 10 CHCDMO C[N@@H+](C/C=C/c1ccccc1)Cc1ccccc1O ZINC000220114880 1125699137 /nfs/dbraw/zinc/69/91/37/1125699137.db2.gz SAIXOUIWFJLWOV-JXMROGBWSA-N 1 1 253.345 3.537 20 10 CHCDMO Cc1csc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886618908 1125699516 /nfs/dbraw/zinc/69/95/16/1125699516.db2.gz OAYCOKISZHUOEN-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1c(O)cccc1F ZINC000886650022 1125702840 /nfs/dbraw/zinc/70/28/40/1125702840.db2.gz NMRPPZDXBZKKDR-VIFPVBQESA-N 1 1 275.314 3.863 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1c(O)cccc1F ZINC000886732586 1125715206 /nfs/dbraw/zinc/71/52/06/1125715206.db2.gz KQMMFUDFFKNFGQ-QWHCGFSZSA-N 1 1 293.382 3.531 20 10 CHCDMO CC[N@@H+](Cc1cc(OC)c(C)cc1O)[C@@H](C)C(C)C ZINC000768439024 1129856245 /nfs/dbraw/zinc/85/62/45/1129856245.db2.gz DGQFLWNFHMAEHF-ZDUSSCGKSA-N 1 1 265.397 3.576 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2F)cc1 ZINC000302735346 1126740877 /nfs/dbraw/zinc/74/08/77/1126740877.db2.gz GPUMEPXLQSDDOO-UHFFFAOYSA-N 1 1 272.367 3.524 20 10 CHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Cl)[C@@H]1C1CC1 ZINC000811513992 1130619681 /nfs/dbraw/zinc/61/96/81/1130619681.db2.gz YWWKIGLCNKZTFL-CQSZACIVSA-N 1 1 265.784 3.666 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)CCC2CCOCC2)c1O ZINC000180380143 1126843148 /nfs/dbraw/zinc/84/31/48/1126843148.db2.gz CAWIRBSYSWDFME-UHFFFAOYSA-N 1 1 297.826 3.603 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccncc1 ZINC000185541003 1126900593 /nfs/dbraw/zinc/90/05/93/1126900593.db2.gz MVJKWRSYELLVFW-ABAIWWIYSA-N 1 1 274.339 3.728 20 10 CHCDMO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc(F)cc(F)c1O ZINC000797069922 1130958415 /nfs/dbraw/zinc/95/84/15/1130958415.db2.gz HFINHVABHMBYAE-ZETCQYMHSA-N 1 1 295.251 3.664 20 10 CHCDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1O ZINC000271235795 1127073589 /nfs/dbraw/zinc/07/35/89/1127073589.db2.gz CJMCEKWHJKSWOQ-NSHDSACASA-N 1 1 259.374 3.573 20 10 CHCDMO CCc1ccc(C[N@H+]2CCCC(F)(F)CC2)c(O)c1 ZINC001236783955 1131005647 /nfs/dbraw/zinc/00/56/47/1131005647.db2.gz PWGQDRWXTWMRPW-UHFFFAOYSA-N 1 1 269.335 3.576 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(N(C)C)cc1 ZINC000271429312 1127080932 /nfs/dbraw/zinc/08/09/32/1127080932.db2.gz AWFGVTZZPMBLSK-IRXDYDNUSA-N 1 1 298.434 3.594 20 10 CHCDMO C[C@@H]1C[C@@H](F)CN1Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236794836 1131008082 /nfs/dbraw/zinc/00/80/82/1131008082.db2.gz VGXBGHBGXYPJEY-VXNVDRBHSA-N 1 1 278.154 3.631 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000156006650 1127093325 /nfs/dbraw/zinc/09/33/25/1127093325.db2.gz JFSRRRJONGAJNE-MRXNPFEDSA-N 1 1 297.398 3.780 20 10 CHCDMO C[C@]1(CF)CC[N@@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237135524 1131054072 /nfs/dbraw/zinc/05/40/72/1131054072.db2.gz JGUQVRAZASRHRI-CYBMUJFWSA-N 1 1 291.288 3.593 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121279 1131054104 /nfs/dbraw/zinc/05/41/04/1131054104.db2.gz AQKUMRFWRAEFFV-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1C[N@H+](Cc2cccc(Cl)c2[O-])CC[C@@H]1C ZINC000164383242 1127162344 /nfs/dbraw/zinc/16/23/44/1127162344.db2.gz FCWFAEUQTAHYHO-QWRGUYRKSA-N 1 1 253.773 3.524 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](Cc2ccccc2)C2CC2)c1O ZINC000124272377 1127359591 /nfs/dbraw/zinc/35/95/91/1127359591.db2.gz JPLIAPWGUWFDET-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)cc1Cl ZINC001231868668 1127544648 /nfs/dbraw/zinc/54/46/48/1127544648.db2.gz VZFCSVJBRITMFE-ZIAGYGMSSA-N 1 1 289.753 3.626 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)cc1Cl ZINC001231868668 1127544650 /nfs/dbraw/zinc/54/46/50/1127544650.db2.gz VZFCSVJBRITMFE-ZIAGYGMSSA-N 1 1 289.753 3.626 20 10 CHCDMO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1ccccc1O ZINC000295021422 1127614156 /nfs/dbraw/zinc/61/41/56/1127614156.db2.gz CHCXHIZSFFOLDW-DMDPSCGWSA-N 1 1 287.325 3.944 20 10 CHCDMO C[C@H](CCc1ccco1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062745137 1127773172 /nfs/dbraw/zinc/77/31/72/1127773172.db2.gz IUSQLUHBZOBLBR-VXGBXAGGSA-N 1 1 277.339 3.796 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(C)cc1O ZINC000373559703 1127849199 /nfs/dbraw/zinc/84/91/99/1127849199.db2.gz CPXRPEVAYCWMQT-GJZGRUSLSA-N 1 1 285.391 3.542 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cccc(O)c3C2)c1C ZINC001205096208 1128136351 /nfs/dbraw/zinc/13/63/51/1128136351.db2.gz XAWQKVGBRBYNFE-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001138220613 1128148035 /nfs/dbraw/zinc/14/80/35/1128148035.db2.gz IWDLKKYJJOYHDH-AEFFLSMTSA-N 1 1 270.420 3.661 20 10 CHCDMO C[C@@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1O ZINC000926915070 1128202421 /nfs/dbraw/zinc/20/24/21/1128202421.db2.gz DOGFAADLRZGRHL-HFBAOOFYSA-N 1 1 295.810 3.655 20 10 CHCDMO C[C@@H]([N@@H+](C)Cc1cc2c(cc1O)CCC2)C(C)(C)C ZINC000914568108 1128211911 /nfs/dbraw/zinc/21/19/11/1128211911.db2.gz AJUKVMATHOVMFD-GFCCVEGCSA-N 1 1 261.409 3.747 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(F)cc1O ZINC000927061951 1128213293 /nfs/dbraw/zinc/21/32/93/1128213293.db2.gz VMZZNKTWAQRLAV-XHDPSFHLSA-N 1 1 286.350 3.655 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[NH+]1CC2(C1)CCCCC2 ZINC001237949912 1129227144 /nfs/dbraw/zinc/22/71/44/1129227144.db2.gz OPWMKZYXEYQECD-UHFFFAOYSA-N 1 1 283.774 3.951 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000915205269 1128291056 /nfs/dbraw/zinc/29/10/56/1128291056.db2.gz AESGSXURNUVIMI-CYBMUJFWSA-N 1 1 259.393 3.503 20 10 CHCDMO CCCC[N@@H+](Cc1cnc(CC)o1)Cc1ccccc1O ZINC000930352899 1128315523 /nfs/dbraw/zinc/31/55/23/1128315523.db2.gz ZQPDUXRHBFOYFC-UHFFFAOYSA-N 1 1 288.391 3.745 20 10 CHCDMO C[C@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CCOC1(C)C ZINC000763204487 1128376111 /nfs/dbraw/zinc/37/61/11/1128376111.db2.gz KPOVTLAWKUMORN-CYBMUJFWSA-N 1 1 285.387 3.545 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1O ZINC000156101432 1128625716 /nfs/dbraw/zinc/62/57/16/1128625716.db2.gz ZJVHKDXCYSXTCL-ZFWWWQNUSA-N 1 1 275.392 3.555 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)C2CCCCC2)c1 ZINC000157507227 1128655855 /nfs/dbraw/zinc/65/58/55/1128655855.db2.gz VRDZXHDULQAWNY-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc3[nH]ccc32)cc1 ZINC000155187430 1128664987 /nfs/dbraw/zinc/66/49/87/1128664987.db2.gz KREULBICKKVDMU-UHFFFAOYSA-N 1 1 293.414 3.866 20 10 CHCDMO CCOCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000158637125 1128669872 /nfs/dbraw/zinc/66/98/72/1128669872.db2.gz DULPPXPZVSEDDI-UHFFFAOYSA-N 1 1 290.451 3.535 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH+](C(C)C)C(C)C)c1O ZINC000778959258 1128672439 /nfs/dbraw/zinc/67/24/39/1128672439.db2.gz YLEYYHDWOKXBGG-UHFFFAOYSA-N 1 1 283.799 3.867 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000778998924 1128675328 /nfs/dbraw/zinc/67/53/28/1128675328.db2.gz FNCFFEWHLGLSCY-ZAQWFSBCSA-N 1 1 275.367 3.542 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000779014951 1128679476 /nfs/dbraw/zinc/67/94/76/1128679476.db2.gz MMJKWKSVMJBVHO-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000920484962 1128684240 /nfs/dbraw/zinc/68/42/40/1128684240.db2.gz LLRYEZKHHWJQIX-MRXNPFEDSA-N 1 1 259.393 3.501 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(C)c1 ZINC000185066655 1117759488 /nfs/dbraw/zinc/75/94/88/1117759488.db2.gz FMJIBBUEHCGBTG-CYBMUJFWSA-N 1 1 273.351 3.999 20 10 CHCDMO C[N@H+](Cc1cscn1)Cc1c(O)ccc2ccccc21 ZINC000049048529 1128741213 /nfs/dbraw/zinc/74/12/13/1128741213.db2.gz MFMZTMKOWKBJES-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO C[N@@H+](Cc1cscn1)Cc1c(O)ccc2ccccc21 ZINC000049048529 1128741215 /nfs/dbraw/zinc/74/12/15/1128741215.db2.gz MFMZTMKOWKBJES-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCSC2(CCCCC2)C1 ZINC000179581029 1128749263 /nfs/dbraw/zinc/74/92/63/1128749263.db2.gz FXQOCLQKZQZNFB-UHFFFAOYSA-N 1 1 277.433 3.644 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](C(C)C)CC2)c1 ZINC000211391347 1118024157 /nfs/dbraw/zinc/02/41/57/1118024157.db2.gz XLJTVNPEDFEVDM-AWEZNQCLSA-N 1 1 277.408 3.659 20 10 CHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000179910250 1128765914 /nfs/dbraw/zinc/76/59/14/1128765914.db2.gz GATLHGGQSMOWPC-LBPRGKRZSA-N 1 1 289.350 3.733 20 10 CHCDMO CCN(C)c1ccc([C@H](C)N[C@@H](C)C[NH+](CC)CC)cc1 ZINC000765765571 1118267694 /nfs/dbraw/zinc/26/76/94/1118267694.db2.gz GWVDUNGJCPIVRN-HOTGVXAUSA-N 1 1 291.483 3.524 20 10 CHCDMO C[N@H+](Cc1ccc(Br)cc1O)C[C@@H]1CC1(C)C ZINC001659739848 1118487794 /nfs/dbraw/zinc/48/77/94/1118487794.db2.gz UXNYDEXEIQOWCE-NSHDSACASA-N 1 1 298.224 3.633 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707136585 1118641512 /nfs/dbraw/zinc/64/15/12/1118641512.db2.gz TTXVBQVBFLZLEE-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140465267 1118740428 /nfs/dbraw/zinc/74/04/28/1118740428.db2.gz LZSLHUZGJPRPKT-NSHDSACASA-N 1 1 253.773 3.810 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000386462294 1118850292 /nfs/dbraw/zinc/85/02/92/1118850292.db2.gz GCKYHFHYFOKYRB-TXEJJXNPSA-N 1 1 265.784 3.668 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+]([C@H](C)C2CC2)C2CC2)c1 ZINC000092009952 1119050359 /nfs/dbraw/zinc/05/03/59/1119050359.db2.gz FWCFHPGHRSZBJZ-GFCCVEGCSA-N 1 1 275.392 3.554 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)C1CCC1)c1ccc(F)cc1O ZINC000796845605 1119211727 /nfs/dbraw/zinc/21/17/27/1119211727.db2.gz BRYKVRFEHADYPX-IINYFYTJSA-N 1 1 251.345 3.761 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2Cc3ccccc3C(C)(C)C2)c1 ZINC001140622824 1119293940 /nfs/dbraw/zinc/29/39/40/1119293940.db2.gz AJIXXFJQCGEKPW-UHFFFAOYSA-N 1 1 281.399 3.994 20 10 CHCDMO CCC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CCC1 ZINC000708390544 1119424264 /nfs/dbraw/zinc/42/42/64/1119424264.db2.gz QTLSCSPXLXOBBP-CQSZACIVSA-N 1 1 269.335 3.729 20 10 CHCDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccccc1O ZINC000179580489 1119751618 /nfs/dbraw/zinc/75/16/18/1119751618.db2.gz XEHIIQGXXJSQSB-RHSMWYFYSA-N 1 1 267.372 3.770 20 10 CHCDMO CCC[N@@H+](Cc1cnn(C(C)C)c1)Cc1ccccc1O ZINC000179745382 1119759139 /nfs/dbraw/zinc/75/91/39/1119759139.db2.gz WXUKJXWZIZENNN-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[NH+]1CC2CC(C2)C1 ZINC001236799267 1128893251 /nfs/dbraw/zinc/89/32/51/1128893251.db2.gz NBSBWDCCHDDSQG-UHFFFAOYSA-N 1 1 272.175 3.541 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC000715705064 1120238842 /nfs/dbraw/zinc/23/88/42/1120238842.db2.gz YLKPYXDUEUMDAA-MRVPVSSYSA-N 1 1 290.176 3.524 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143104691 1120350270 /nfs/dbraw/zinc/35/02/70/1120350270.db2.gz XGMSMPJJENNEHF-JSGCOSHPSA-N 1 1 279.399 3.870 20 10 CHCDMO Cc1ccc([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)c(O)c1 ZINC000185472027 1120377979 /nfs/dbraw/zinc/37/79/79/1120377979.db2.gz SVJLIERDAQNINP-WMLDXEAASA-N 1 1 292.467 3.718 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000922843070 1120609528 /nfs/dbraw/zinc/60/95/28/1120609528.db2.gz OXYDOVWFFMHXDX-LBPRGKRZSA-N 1 1 299.386 3.578 20 10 CHCDMO C[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(F)cc1O ZINC000186585378 1120609691 /nfs/dbraw/zinc/60/96/91/1120609691.db2.gz ASUSBOIDNYVFDP-ZDUSSCGKSA-N 1 1 285.362 3.957 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccc(F)cc1O ZINC000857082339 1120628577 /nfs/dbraw/zinc/62/85/77/1120628577.db2.gz MUBCFYKZHMIDPT-IUCAKERBSA-N 1 1 292.181 3.766 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCc2sccc2C1 ZINC000124290576 1120655760 /nfs/dbraw/zinc/65/57/60/1120655760.db2.gz JFPJFMQNNZGRQR-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO CCC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)CC(C)C ZINC000313675078 1120765880 /nfs/dbraw/zinc/76/58/80/1120765880.db2.gz NZGMQZATDKWKKH-UHFFFAOYSA-N 1 1 281.371 3.602 20 10 CHCDMO CCC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)CC(C)C ZINC000313675078 1120765883 /nfs/dbraw/zinc/76/58/83/1120765883.db2.gz NZGMQZATDKWKKH-UHFFFAOYSA-N 1 1 281.371 3.602 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000162898980 1120925170 /nfs/dbraw/zinc/92/51/70/1120925170.db2.gz KAJKSUVNDKSEAF-UHFFFAOYSA-N 1 1 277.408 3.627 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(F)cc1O ZINC000282484691 1121022005 /nfs/dbraw/zinc/02/20/05/1121022005.db2.gz HIINGIUJFWQPMW-LRDDRELGSA-N 1 1 293.382 3.531 20 10 CHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1c(O)cccc1Cl ZINC000399564285 1121039469 /nfs/dbraw/zinc/03/94/69/1121039469.db2.gz HDYNPRYLMMFESM-GHMZBOCLSA-N 1 1 253.773 3.666 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000228172140 1121184130 /nfs/dbraw/zinc/18/41/30/1121184130.db2.gz MTUKZRQVZJZBKJ-BXUZGUMPSA-N 1 1 265.784 3.810 20 10 CHCDMO C[C@H](Cc1ccccc1F)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000756446479 1121240291 /nfs/dbraw/zinc/24/02/91/1121240291.db2.gz QPSQDWBRRJCHGM-VXGBXAGGSA-N 1 1 291.341 3.952 20 10 CHCDMO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)c1ccc(F)cc1O ZINC000248582383 1121574678 /nfs/dbraw/zinc/57/46/78/1121574678.db2.gz WGWKPUSFSHZRQJ-PVUWLOKVSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@H]1CCC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001177240680 1121718887 /nfs/dbraw/zinc/71/88/87/1121718887.db2.gz QIUVQUGCTDJPKI-VHSXEESVSA-N 1 1 271.763 3.853 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000773766756 1121808004 /nfs/dbraw/zinc/80/80/04/1121808004.db2.gz VHPIIYCYRCELOW-AWEZNQCLSA-N 1 1 260.425 3.763 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](C)[C@H]1C ZINC001179858350 1121917102 /nfs/dbraw/zinc/91/71/02/1121917102.db2.gz DBJLRRYTVWTFNH-DZGCQCFKSA-N 1 1 260.425 3.681 20 10 CHCDMO Cc1ccc(C[N@@H+](C2CC2)C2CCCCC2)c(O)c1 ZINC001180064219 1121945490 /nfs/dbraw/zinc/94/54/90/1121945490.db2.gz DASWVQHSHBMDRV-UHFFFAOYSA-N 1 1 259.393 3.998 20 10 CHCDMO CCOC[C@@H]1CCC[N@@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001180235073 1121967833 /nfs/dbraw/zinc/96/78/33/1121967833.db2.gz VALCMSUQWNKIJK-OAHLLOKOSA-N 1 1 291.435 3.764 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC001180317491 1121973804 /nfs/dbraw/zinc/97/38/04/1121973804.db2.gz GZHLBNIXTDVKPR-INIZCTEOSA-N 1 1 274.452 3.929 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC001204277265 1122008506 /nfs/dbraw/zinc/00/85/06/1122008506.db2.gz XMLXTRAEDYJVPL-MRXNPFEDSA-N 1 1 287.334 3.574 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001181861542 1122087541 /nfs/dbraw/zinc/08/75/41/1122087541.db2.gz VPPQNHVKFVTVBW-CALCHBBNSA-N 1 1 272.436 3.683 20 10 CHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H](C3CC3)C2)cc1F ZINC001182184784 1122117496 /nfs/dbraw/zinc/11/74/96/1122117496.db2.gz UPGFFRFPBHMXCZ-ZDUSSCGKSA-N 1 1 294.389 3.653 20 10 CHCDMO CC[N@@H+](Cc1occc1C)Cc1c(C)cc(OC)cc1O ZINC001182424608 1122151896 /nfs/dbraw/zinc/15/18/96/1122151896.db2.gz VKEOWMKAYWAJLH-UHFFFAOYSA-N 1 1 289.375 3.633 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C(C)(C)O ZINC000774284335 1122153398 /nfs/dbraw/zinc/15/33/98/1122153398.db2.gz FDUOHGNAMGTGBI-JGVFFNPUSA-N 1 1 292.206 3.509 20 10 CHCDMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(F)c(F)cc1O)CC2 ZINC001182685559 1122182862 /nfs/dbraw/zinc/18/28/62/1122182862.db2.gz RYKNWRKSYBMWBS-MRXNPFEDSA-N 1 1 289.325 3.756 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CC1CCC(F)CC1 ZINC001182704958 1122183679 /nfs/dbraw/zinc/18/36/79/1122183679.db2.gz RYRRORFWZXFCJX-UHFFFAOYSA-N 1 1 271.763 3.664 20 10 CHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC23CCCC3)cc1F ZINC001182756318 1122185125 /nfs/dbraw/zinc/18/51/25/1122185125.db2.gz ZDKJCJCPIGIXHG-UHFFFAOYSA-N 1 1 280.362 3.549 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC001182872881 1122192595 /nfs/dbraw/zinc/19/25/95/1122192595.db2.gz HDXIJBIUUJLREI-GOSISDBHSA-N 1 1 289.419 3.518 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618485 1122218462 /nfs/dbraw/zinc/21/84/62/1122218462.db2.gz LNRUGYBZQLRVPI-BLLLJJGKSA-N 1 1 259.393 3.501 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001184339773 1122271761 /nfs/dbraw/zinc/27/17/61/1122271761.db2.gz SJDLNZIBLGWONC-CQSZACIVSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001184339773 1122271764 /nfs/dbraw/zinc/27/17/64/1122271764.db2.gz SJDLNZIBLGWONC-CQSZACIVSA-N 1 1 277.383 3.934 20 10 CHCDMO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)CC2)c(O)c1 ZINC001184351655 1122272757 /nfs/dbraw/zinc/27/27/57/1122272757.db2.gz RIWXNDVSDIRZJI-LJQANCHMSA-N 1 1 297.398 3.664 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000775152741 1122446037 /nfs/dbraw/zinc/44/60/37/1122446037.db2.gz RWZUYLLNECCRJI-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232477 1122586666 /nfs/dbraw/zinc/58/66/66/1122586666.db2.gz IAEMVYMARYNBJA-GOEBONIOSA-N 1 1 260.425 3.763 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)ccc1N(C)C ZINC001192261693 1122636582 /nfs/dbraw/zinc/63/65/82/1122636582.db2.gz FYJMTLGRARWPNT-DZGCQCFKSA-N 1 1 260.425 3.539 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645542 1122655021 /nfs/dbraw/zinc/65/50/21/1122655021.db2.gz OJSPZLDCYYXLOD-ZBFHGGJFSA-N 1 1 260.425 3.906 20 10 CHCDMO C[N@@H+](Cc1cccc(O)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775633832 1122839316 /nfs/dbraw/zinc/83/93/16/1122839316.db2.gz LVJLIGSXOSCQPP-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3sccc3[C@H]2C)c1 ZINC000775647672 1122862019 /nfs/dbraw/zinc/86/20/19/1122862019.db2.gz XWTQYEGNPKIIPW-LLVKDONJSA-N 1 1 289.400 3.582 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1O ZINC000775670798 1122889407 /nfs/dbraw/zinc/88/94/07/1122889407.db2.gz OBMIBBGJROGBFZ-MRXNPFEDSA-N 1 1 281.399 3.999 20 10 CHCDMO COc1ccc2c(c1)CCC[N@H+](Cc1cccc(C)c1O)C2 ZINC000775678453 1122900951 /nfs/dbraw/zinc/90/09/51/1122900951.db2.gz ZOKKNJPHJOAQAW-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775698650 1122911665 /nfs/dbraw/zinc/91/16/65/1122911665.db2.gz QANLWFXKDNHVPO-GOSISDBHSA-N 1 1 297.398 3.910 20 10 CHCDMO Cc1cccc(C[N@H+]2CCCC23CCCCC3)c1O ZINC000775725491 1122926343 /nfs/dbraw/zinc/92/63/43/1122926343.db2.gz MKPITNXNQHZHSL-UHFFFAOYSA-N 1 1 259.393 3.999 20 10 CHCDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000775732052 1122928546 /nfs/dbraw/zinc/92/85/46/1122928546.db2.gz LORGETNJVBQSEM-BBRMVZONSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc21 ZINC001197552640 1122960247 /nfs/dbraw/zinc/96/02/47/1122960247.db2.gz LPVJAHPLSPWLPM-OAHLLOKOSA-N 1 1 280.415 3.872 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(C)cc(C)c2O)cc1 ZINC000216024266 1123021979 /nfs/dbraw/zinc/02/19/79/1123021979.db2.gz BOODFMRWYVGTRJ-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)ccc1O ZINC000776012511 1123036277 /nfs/dbraw/zinc/03/62/77/1123036277.db2.gz HFNQRRYJXWAIKQ-SKDRFNHKSA-N 1 1 291.288 3.694 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CC2CCCCC2)cc1 ZINC001201401646 1123092600 /nfs/dbraw/zinc/09/26/00/1123092600.db2.gz OQKXLHZQWJUXTK-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H]2C)c(C)n1-c1ccccc1 ZINC001137853996 1123214047 /nfs/dbraw/zinc/21/40/47/1123214047.db2.gz DNKYANOPJAMAHZ-CYBMUJFWSA-N 1 1 254.377 3.688 20 10 CHCDMO COC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000825536685 1123221421 /nfs/dbraw/zinc/22/14/21/1123221421.db2.gz LHYYMPVRSDDNLB-CYBMUJFWSA-N 1 1 297.826 3.603 20 10 CHCDMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(F)cc1O ZINC000107929250 1123229417 /nfs/dbraw/zinc/22/94/17/1123229417.db2.gz OMKCPAGQPJCNHW-VIFPVBQESA-N 1 1 281.277 3.660 20 10 CHCDMO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cscn1 ZINC000850359699 1123256428 /nfs/dbraw/zinc/25/64/28/1123256428.db2.gz OMBCRTUUIRENEU-DSYXLKISSA-N 1 1 287.432 3.573 20 10 CHCDMO COC1CC(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)C1 ZINC000850481275 1123273162 /nfs/dbraw/zinc/27/31/62/1123273162.db2.gz FTBVZCRHOSMBBL-ZBOXLXRLSA-N 1 1 283.799 3.511 20 10 CHCDMO CC[C@H]([NH2+]CCC(C)(C)F)c1ccc(F)cc1O ZINC000850531625 1123284865 /nfs/dbraw/zinc/28/48/65/1123284865.db2.gz LPFMSEIVAJOZGR-LBPRGKRZSA-N 1 1 257.324 3.710 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCO[C@H](C)C2)cc1 ZINC000851716689 1123373650 /nfs/dbraw/zinc/37/36/50/1123373650.db2.gz PQPRKLPLTKJEJB-CRAIPNDOSA-N 1 1 290.451 3.532 20 10 CHCDMO Cc1cc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)ccn1 ZINC000856722361 1123566295 /nfs/dbraw/zinc/56/62/95/1123566295.db2.gz WBHSPRVSYLUMEQ-UHFFFAOYSA-N 1 1 297.446 3.867 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccns1)c1ccc(F)cc1O ZINC000858577677 1123665088 /nfs/dbraw/zinc/66/50/88/1123665088.db2.gz UNZOSWGHYOXFLG-SKDRFNHKSA-N 1 1 280.368 3.790 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc2ccccc2c1O ZINC000194990344 1129140290 /nfs/dbraw/zinc/14/02/90/1129140290.db2.gz JVNWZBGSDUMWSJ-GJZGRUSLSA-N 1 1 298.430 3.538 20 10 CHCDMO C[N@@H+](CCSc1ccccc1)Cc1ccccc1O ZINC000117881601 1123763367 /nfs/dbraw/zinc/76/33/67/1123763367.db2.gz XDBRUVUUOKITNB-UHFFFAOYSA-N 1 1 273.401 3.616 20 10 CHCDMO COc1cccc2c1C[N@@H+](Cc1cc(C)c(C)cc1O)C2 ZINC000862529031 1123817298 /nfs/dbraw/zinc/81/72/98/1123817298.db2.gz HEVLYVXCVDEHHR-UHFFFAOYSA-N 1 1 283.371 3.533 20 10 CHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670533 1123924068 /nfs/dbraw/zinc/92/40/68/1123924068.db2.gz XRVJLMONKNLURK-YGRLFVJLSA-N 1 1 299.336 3.654 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c1O ZINC000794684947 1123927672 /nfs/dbraw/zinc/92/76/72/1123927672.db2.gz KKWHZTJELVSDSQ-CQSZACIVSA-N 1 1 277.408 3.720 20 10 CHCDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC000093149711 1123960903 /nfs/dbraw/zinc/96/09/03/1123960903.db2.gz VLJHOOUUJVUHIJ-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCCOc2ccccc2)cc1C ZINC000071895690 1129167247 /nfs/dbraw/zinc/16/72/47/1129167247.db2.gz DWHCJEXWXDWURZ-UHFFFAOYSA-N 1 1 299.414 3.910 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000122884187 1124544453 /nfs/dbraw/zinc/54/44/53/1124544453.db2.gz ASXAVKXZOQKKFU-CYBMUJFWSA-N 1 1 289.448 3.758 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872261325 1124699624 /nfs/dbraw/zinc/69/96/24/1124699624.db2.gz DMAHFRPWATVALZ-KRWDZBQOSA-N 1 1 289.419 3.624 20 10 CHCDMO CCCOc1ccc(C[NH2+]Cc2nccs2)cc1C ZINC000873016049 1124733945 /nfs/dbraw/zinc/73/39/45/1124733945.db2.gz DGXHEDXYLXFQMM-UHFFFAOYSA-N 1 1 276.405 3.530 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)[C@@H]2CCSC2)cc1C(C)C ZINC000125021786 1124834021 /nfs/dbraw/zinc/83/40/21/1124834021.db2.gz ZLZJVNULGSBAEK-CQSZACIVSA-N 1 1 279.449 3.761 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2c(C)cccc2O)s1 ZINC000876714733 1124973777 /nfs/dbraw/zinc/97/37/77/1124973777.db2.gz CNYDETLLGVLKLQ-LBPRGKRZSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(O)c1 ZINC000877547095 1125043209 /nfs/dbraw/zinc/04/32/09/1125043209.db2.gz WQHLXGKGXHXZOH-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1cccc(O)c1CNc1cccc(C2CC2)[nH+]1 ZINC000877551183 1125044080 /nfs/dbraw/zinc/04/40/80/1125044080.db2.gz XDRMAYSAPAOXFV-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C2 ZINC000877702920 1125066721 /nfs/dbraw/zinc/06/67/21/1125066721.db2.gz JZXKFAAQDQFZOF-HOTGVXAUSA-N 1 1 265.356 3.512 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@@H]2C2CC2)c(O)c(C(C)(C)C)c1 ZINC000826043626 1125157791 /nfs/dbraw/zinc/15/77/91/1125157791.db2.gz MSTUQJHWBQESRC-MRXNPFEDSA-N 1 1 289.419 3.683 20 10 CHCDMO C[C@@H]([NH2+]Cc1cccc2cccnc21)c1ccc(F)cc1O ZINC000127654026 1125207835 /nfs/dbraw/zinc/20/78/35/1125207835.db2.gz UBOWDLGXQPJEDN-GFCCVEGCSA-N 1 1 296.345 3.930 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000882881666 1125359529 /nfs/dbraw/zinc/35/95/29/1125359529.db2.gz YEAOBOOTCHWDTN-INIZCTEOSA-N 1 1 289.325 3.911 20 10 CHCDMO COc1ccccc1[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882879786 1125359915 /nfs/dbraw/zinc/35/99/15/1125359915.db2.gz MRSSXGXCIUIXPS-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CC(C)OCCC[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC000382806792 1125396257 /nfs/dbraw/zinc/39/62/57/1125396257.db2.gz YJPAKHODAMIPTK-UHFFFAOYSA-N 1 1 287.403 3.792 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000131584758 1125398397 /nfs/dbraw/zinc/39/83/97/1125398397.db2.gz HBGQZTPAHLHUSS-QGZVFWFLSA-N 1 1 283.371 3.738 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)[C@@H]1CCCOC1 ZINC000883353289 1125400140 /nfs/dbraw/zinc/40/01/40/1125400140.db2.gz ROCJJEFFUDVLAS-ZOWXZIJZSA-N 1 1 297.826 3.901 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000131994172 1125413069 /nfs/dbraw/zinc/41/30/69/1125413069.db2.gz SLXRACAULUNPFG-QGZVFWFLSA-N 1 1 283.371 3.520 20 10 CHCDMO C[C@@H]([N@H+](C)Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000132557538 1125419951 /nfs/dbraw/zinc/41/99/51/1125419951.db2.gz AHFDZYKACLWTKI-SNVBAGLBSA-N 1 1 255.789 3.912 20 10 CHCDMO C[C@@H]([N@@H+](C)Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000132557538 1125419952 /nfs/dbraw/zinc/41/99/52/1125419952.db2.gz AHFDZYKACLWTKI-SNVBAGLBSA-N 1 1 255.789 3.912 20 10 CHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000245636847 1129214205 /nfs/dbraw/zinc/21/42/05/1129214205.db2.gz XGLFVBJYTAXYJL-KXBFYZLASA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1csc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000379133699 1129285848 /nfs/dbraw/zinc/28/58/48/1129285848.db2.gz QBFIAQYTHVMVLT-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCC[C@@H](SC)C2)c1O ZINC000092064104 1129379375 /nfs/dbraw/zinc/37/93/75/1129379375.db2.gz ABOWQAUTYDVLHX-CQSZACIVSA-N 1 1 295.448 3.508 20 10 CHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861685 1129420847 /nfs/dbraw/zinc/42/08/47/1129420847.db2.gz QXGUYJRCLQFRBM-IRXDYDNUSA-N 1 1 291.435 3.644 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1O ZINC000093439508 1129423728 /nfs/dbraw/zinc/42/37/28/1129423728.db2.gz BMFAKQRJJXWPPS-SFHVURJKSA-N 1 1 287.403 3.723 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)c1O ZINC000093689639 1129427279 /nfs/dbraw/zinc/42/72/79/1129427279.db2.gz SEURTYUTNDHCMB-PBHICJAKSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1cc(F)ccc1CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000094950729 1129456412 /nfs/dbraw/zinc/45/64/12/1129456412.db2.gz MKLWWFVNFSXNLX-LBPRGKRZSA-N 1 1 291.341 3.872 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)cc1C ZINC000742159871 1129468420 /nfs/dbraw/zinc/46/84/20/1129468420.db2.gz UHBSSGMTUMXIFP-OAHLLOKOSA-N 1 1 281.399 3.956 20 10 CHCDMO Oc1ccccc1C[N@@H+](CC1CCC1)C1CCCC1 ZINC000743847418 1129539333 /nfs/dbraw/zinc/53/93/33/1129539333.db2.gz BVSUMISTDUPERP-UHFFFAOYSA-N 1 1 259.393 3.937 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CC1(Cl)Cl ZINC000743869856 1129542202 /nfs/dbraw/zinc/54/22/02/1129542202.db2.gz CODHIQIETJJYJE-LBPRGKRZSA-N 1 1 288.218 3.798 20 10 CHCDMO C[C@H]1CC(C[NH2+]Cc2cc(F)c(F)cc2O)C[C@H](C)C1 ZINC001206612968 1129544259 /nfs/dbraw/zinc/54/42/59/1129544259.db2.gz PARDQGOSBVSXAD-GHMZBOCLSA-N 1 1 283.362 3.832 20 10 CHCDMO CSC[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000798181868 1129826868 /nfs/dbraw/zinc/82/68/68/1129826868.db2.gz AOUQHIUNKHORJN-IUCAKERBSA-N 1 1 293.354 3.813 20 10 CHCDMO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)CC(C)(C)C ZINC000380484070 1129831464 /nfs/dbraw/zinc/83/14/64/1129831464.db2.gz VDVGIFWUSVABJO-UHFFFAOYSA-N 1 1 281.371 3.602 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)CC(C)(C)C ZINC000380484070 1129831467 /nfs/dbraw/zinc/83/14/67/1129831467.db2.gz VDVGIFWUSVABJO-UHFFFAOYSA-N 1 1 281.371 3.602 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)Cc1ccccc1F ZINC000768172142 1129839550 /nfs/dbraw/zinc/83/95/50/1129839550.db2.gz NAJLXSXUXULDTI-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO 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CCCC[N@@H+](CCC(=O)C(C)(C)C)Cc1ccccc1O ZINC000801598562 1129931739 /nfs/dbraw/zinc/93/17/39/1129931739.db2.gz CCPZPOMNWQTNJW-UHFFFAOYSA-N 1 1 291.435 4.000 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000770356080 1129945625 /nfs/dbraw/zinc/94/56/25/1129945625.db2.gz RTYDEZHYMXDCPZ-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000770356080 1129945627 /nfs/dbraw/zinc/94/56/27/1129945627.db2.gz RTYDEZHYMXDCPZ-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000770508584 1129948245 /nfs/dbraw/zinc/94/82/45/1129948245.db2.gz AGMXYQNIUGQOBN-KRWDZBQOSA-N 1 1 285.362 3.738 20 10 CHCDMO Cc1ccc([C@H]2CSCC[N@H+]2Cc2ccccc2O)cc1 ZINC000770509534 1129949141 /nfs/dbraw/zinc/94/91/41/1129949141.db2.gz DAMNZOYDYJVQSX-QGZVFWFLSA-N 1 1 299.439 3.991 20 10 CHCDMO CCC[N@H+](Cc1ncc(Cl)s1)Cc1ccccc1O ZINC000770631229 1129954282 /nfs/dbraw/zinc/95/42/82/1129954282.db2.gz GXVNLKZAGSSZKA-UHFFFAOYSA-N 1 1 296.823 3.914 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261.287 3.860 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788646130 1130197604 /nfs/dbraw/zinc/19/76/04/1130197604.db2.gz BHGBHQMTXXLGKU-GUBZILKMSA-N 1 1 273.298 3.718 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@@H](C)CC(C)(C)C2)c1O ZINC000753574193 1130218860 /nfs/dbraw/zinc/21/88/60/1130218860.db2.gz CKUJULFGACNRKD-ZDUSSCGKSA-N 1 1 277.408 3.659 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)CC1CCCC1 ZINC000789327431 1130243868 /nfs/dbraw/zinc/24/38/68/1130243868.db2.gz OYLKYVDDHUMFEY-QGZVFWFLSA-N 1 1 291.435 3.545 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)C1CCCCC1 ZINC000789325602 1130243938 /nfs/dbraw/zinc/24/39/38/1130243938.db2.gz BOYFCKKBIPDCCB-SFHVURJKSA-N 1 1 291.435 3.545 20 10 CHCDMO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001170103195 1130245938 /nfs/dbraw/zinc/24/59/38/1130245938.db2.gz DMSDDSUQIZJJTK-ZYHUDNBSSA-N 1 1 290.794 3.872 20 10 CHCDMO C[C@H]1CCSCC[N@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000790479222 1130315285 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ZINC000811513750 1130619715 /nfs/dbraw/zinc/61/97/15/1130619715.db2.gz OMEVMJCDGDRZBF-MRXNPFEDSA-N 1 1 276.399 3.512 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCOCC2(CCC2)C1 ZINC000758988959 1130632411 /nfs/dbraw/zinc/63/24/11/1130632411.db2.gz UDRBADFHTMITFZ-UHFFFAOYSA-N 1 1 297.398 3.548 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c1 ZINC000780793935 1130693002 /nfs/dbraw/zinc/69/30/02/1130693002.db2.gz YXIMDSQOQOJZMW-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO COCC[N@@H+](Cc1cccc(-c2ccccc2)c1O)C(C)C ZINC001234996230 1130700997 /nfs/dbraw/zinc/70/09/97/1130700997.db2.gz XFKJCUUODIBVEV-UHFFFAOYSA-N 1 1 299.414 3.916 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)C2(C)CC2)c1 ZINC000781627616 1130732161 /nfs/dbraw/zinc/73/21/61/1130732161.db2.gz BTMVQUQIYFDISK-SNVBAGLBSA-N 1 1 298.224 3.741 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)C2(C)CC2)c1 ZINC000781627613 1130732521 /nfs/dbraw/zinc/73/25/21/1130732521.db2.gz BTMVQUQIYFDISK-JTQLQIEISA-N 1 1 298.224 3.741 20 10 CHCDMO CC(C)(C)c1ccc(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)c(O)c1 ZINC001235673833 1130766899 /nfs/dbraw/zinc/76/68/99/1130766899.db2.gz AJIOQVFEGCBEHZ-DOTOQJQBSA-N 1 1 297.389 3.962 20 10 CHCDMO CC(C)(C)c1ccc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(O)c1 ZINC001235684585 1130768235 /nfs/dbraw/zinc/76/82/35/1130768235.db2.gz YQMXCWCJWUMOMD-OCCSQVGLSA-N 1 1 295.373 3.777 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cc1C(C)C ZINC000783546677 1130836183 /nfs/dbraw/zinc/83/61/83/1130836183.db2.gz SLLSXRTVRJWXLG-KKUMJFAQSA-N 1 1 291.435 3.822 20 10 CHCDMO COc1cc(C[N@H+]2CCCC3(CCCC3)C2)c(O)cc1C ZINC000783541526 1130836379 /nfs/dbraw/zinc/83/63/79/1130836379.db2.gz CNFDOLSRAOFYJZ-UHFFFAOYSA-N 1 1 289.419 3.865 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@@H]2CC=CCC2)cc1C ZINC000784012795 1130867329 /nfs/dbraw/zinc/86/73/29/1130867329.db2.gz FYIONJCZCQZSIQ-OAHLLOKOSA-N 1 1 259.393 3.797 20 10 CHCDMO CCCC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCN1 ZINC001236135771 1130874337 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3.502 20 10 CHCDMO Cc1cc(C[N@@H+](C)C[C@H]2CC2(C)C)ccc1N(C)C ZINC001139672978 1131628161 /nfs/dbraw/zinc/62/81/61/1131628161.db2.gz MGUDZHFKSPKFNV-OAHLLOKOSA-N 1 1 260.425 3.539 20 10 CHCDMO COc1ccc2c(c1)C[N@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140182498 1131673081 /nfs/dbraw/zinc/67/30/81/1131673081.db2.gz SOTFZAVFYKNPGO-UHFFFAOYSA-N 1 1 283.371 3.533 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)c1O ZINC001140178698 1131673197 /nfs/dbraw/zinc/67/31/97/1131673197.db2.gz VBIJPIQVIMKICQ-WFASDCNBSA-N 1 1 261.409 3.877 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001140178697 1131673425 /nfs/dbraw/zinc/67/34/25/1131673425.db2.gz VBIJPIQVIMKICQ-SWLSCSKDSA-N 1 1 261.409 3.877 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001140178290 1131673569 /nfs/dbraw/zinc/67/35/69/1131673569.db2.gz HDBHFSMZYIOMFX-UHFFFAOYSA-N 1 1 283.362 3.876 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCC3(CCC3)C2)c1O ZINC001140184776 1131674655 /nfs/dbraw/zinc/67/46/55/1131674655.db2.gz HYRHANYAFXCPAP-UHFFFAOYSA-N 1 1 259.393 3.775 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CCc2ccccc2F)c1O ZINC001140185027 1131674664 /nfs/dbraw/zinc/67/46/64/1131674664.db2.gz ONNQCCGDWHBBPV-UHFFFAOYSA-N 1 1 287.378 3.823 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)C(F)F)c1ccc(N(C)C)cc1 ZINC000834827071 1131707861 /nfs/dbraw/zinc/70/78/61/1131707861.db2.gz IAOSSEDXGDYHTK-KGLIPLIRSA-N 1 1 270.367 3.837 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000834883957 1131717479 /nfs/dbraw/zinc/71/74/79/1131717479.db2.gz VKLRVCOJRLOOPX-CHWSQXEVSA-N 1 1 293.382 3.531 20 10 CHCDMO Cc1cc(C)c(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)cn1 ZINC000834902098 1131726639 /nfs/dbraw/zinc/72/66/39/1131726639.db2.gz DQTBYGZWMUUCET-LLVKDONJSA-N 1 1 292.329 3.533 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001140462208 1131748540 /nfs/dbraw/zinc/74/85/40/1131748540.db2.gz AKDOIHLNVAPKHL-VXGBXAGGSA-N 1 1 265.784 3.668 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+](C)Cc2ccccc2Cl)c1O ZINC001140745991 1131905868 /nfs/dbraw/zinc/90/58/68/1131905868.db2.gz RQSNBJORIRGSTQ-UHFFFAOYSA-N 1 1 291.778 3.692 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CC[C@H](C3CCCCC3)C2)c1O ZINC001140749274 1131906338 /nfs/dbraw/zinc/90/63/38/1131906338.db2.gz UXQDCVVPXFDPSC-HNNXBMFYSA-N 1 1 289.419 3.808 20 10 CHCDMO Cc1c(O)ccc(C[N@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001140747943 1131906654 /nfs/dbraw/zinc/90/66/54/1131906654.db2.gz ONQKCCCQSUGSAC-UHFFFAOYSA-N 1 1 299.414 3.859 20 10 CHCDMO CCCC[N@@H+](C)Cc1ccc(N(C)C)cc1Cl ZINC001140921875 1131963998 /nfs/dbraw/zinc/96/39/98/1131963998.db2.gz UBCNSVQCSSXZGQ-UHFFFAOYSA-N 1 1 254.805 3.638 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](C)C[C@H]2C)c(O)c1 ZINC001140856346 1131948977 /nfs/dbraw/zinc/94/89/77/1131948977.db2.gz YNPDZGGLYAEWFX-LSDHHAIUSA-N 1 1 290.451 3.859 20 10 CHCDMO CC[N@@H+](Cc1c(O)cc(OC)cc1OC)C1CCCCC1 ZINC001141032221 1131988580 /nfs/dbraw/zinc/98/85/80/1131988580.db2.gz WMLCSCWMIJROSW-UHFFFAOYSA-N 1 1 293.407 3.564 20 10 CHCDMO CCCC[N@@H+](CCC)Cc1ccc2c(c1)OCCN2C ZINC001141143400 1132028486 /nfs/dbraw/zinc/02/84/86/1132028486.db2.gz XQISUIIQVQFFMV-UHFFFAOYSA-N 1 1 276.424 3.527 20 10 CHCDMO CC(C)(C)[N@@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141155730 1132029835 /nfs/dbraw/zinc/02/98/35/1132029835.db2.gz HVFSYANCTKTQAO-UHFFFAOYSA-N 1 1 285.387 3.899 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CC[C@@H](C3CCCCC3)C2)c1 ZINC001141161768 1132030771 /nfs/dbraw/zinc/03/07/71/1132030771.db2.gz XGOPWVYQDONKLH-CQSZACIVSA-N 1 1 275.392 3.500 20 10 CHCDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001171778858 1132095498 /nfs/dbraw/zinc/09/54/98/1132095498.db2.gz QULLHEQMNXDWPE-AEFFLSMTSA-N 1 1 290.451 3.532 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248880807 1132151139 /nfs/dbraw/zinc/15/11/39/1132151139.db2.gz NLKYEAKSFSEJGL-GFCCVEGCSA-N 1 1 297.826 3.564 20 10 CHCDMO C[C@@H]1CC[C@@H]([N@H+]2CCc3cccc(O)c3C2)C[C@@H]1C ZINC001172379578 1132171531 /nfs/dbraw/zinc/17/15/31/1132171531.db2.gz ORFCPCVCZOOULJ-VNHYZAJKSA-N 1 1 259.393 3.575 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CCOC(C)C ZINC001172455799 1132239050 /nfs/dbraw/zinc/23/90/50/1132239050.db2.gz XMADVYYXNKHMFO-MRXNPFEDSA-N 1 1 292.467 3.778 20 10 CHCDMO COC[C@@]1(C)CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840108691 1132247508 /nfs/dbraw/zinc/24/75/08/1132247508.db2.gz RLORZTFUPLRSFK-SFHVURJKSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[NH+]1CC(Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231320916 1132281837 /nfs/dbraw/zinc/28/18/37/1132281837.db2.gz YWWFGKGICDSKLP-UHFFFAOYSA-N 1 1 297.358 3.891 20 10 CHCDMO C[C@H]1CC[N@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231467504 1132297374 /nfs/dbraw/zinc/29/73/74/1132297374.db2.gz HKAMRGBSCCXKHJ-AWEZNQCLSA-N 1 1 283.371 3.565 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000840911222 1132307881 /nfs/dbraw/zinc/30/78/81/1132307881.db2.gz XYFTTXVZCREGHH-IBGZPJMESA-N 1 1 295.430 3.793 20 10 CHCDMO Cc1ncsc1C[N@@H+](C)Cc1c(O)cc(C)cc1Cl ZINC000840914234 1132307927 /nfs/dbraw/zinc/30/79/27/1132307927.db2.gz ROBBSANCEKYKAW-UHFFFAOYSA-N 1 1 296.823 3.751 20 10 CHCDMO Cc1ncsc1C[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC000840914234 1132307932 /nfs/dbraw/zinc/30/79/32/1132307932.db2.gz ROBBSANCEKYKAW-UHFFFAOYSA-N 1 1 296.823 3.751 20 10 CHCDMO COC[C@@H]1CCCC[N@@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840938175 1132309954 /nfs/dbraw/zinc/30/99/54/1132309954.db2.gz LPAAESJIJODXRC-CYBMUJFWSA-N 1 1 297.826 3.603 20 10 CHCDMO CSCCC[N@@H+](C)Cc1c(O)cc(C)cc1Cl ZINC000840942513 1132311549 /nfs/dbraw/zinc/31/15/49/1132311549.db2.gz ZIXGDOQSCHHJJT-UHFFFAOYSA-N 1 1 273.829 3.539 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2c(O)cc(C)cc2Cl)CC1(C)C ZINC000840950729 1132311785 /nfs/dbraw/zinc/31/17/85/1132311785.db2.gz NKXNNASLUYCHRH-OAHLLOKOSA-N 1 1 297.826 3.601 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC001231592204 1132320749 /nfs/dbraw/zinc/32/07/49/1132320749.db2.gz GDRVVPJKQQDSQC-UHFFFAOYSA-N 1 1 269.388 3.895 20 10 CHCDMO COc1ccc(C[C@H](C)C[NH2+]c2ccc(N)cc2)cc1F ZINC000841040164 1132323645 /nfs/dbraw/zinc/32/36/45/1132323645.db2.gz KVJRNNLHGBCLFT-LBPRGKRZSA-N 1 1 288.366 3.707 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3ccsc3C2)c(O)c1 ZINC001231846533 1132378074 /nfs/dbraw/zinc/37/80/74/1132378074.db2.gz NSYMHYXAMPQLSQ-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)Cc2ccc(F)cc2F)c(O)c1 ZINC001231846125 1132378220 /nfs/dbraw/zinc/37/82/20/1132378220.db2.gz BHWGRGPOCDCMPH-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO CCCC[N@@H+](CCC)Cc1ccc(N(C)C)cc1OC ZINC001231851755 1132378623 /nfs/dbraw/zinc/37/86/23/1132378623.db2.gz HHSJWAXGBPLISC-UHFFFAOYSA-N 1 1 278.440 3.773 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001231854226 1132378719 /nfs/dbraw/zinc/37/87/19/1132378719.db2.gz BYJYKHKWFWCPLE-GOSISDBHSA-N 1 1 296.414 3.708 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3cc(F)ccc3C2)c(O)c1 ZINC001231848688 1132379221 /nfs/dbraw/zinc/37/92/21/1132379221.db2.gz JKKYNMZJZWQEJS-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)cc1Cl ZINC001231868665 1132385628 /nfs/dbraw/zinc/38/56/28/1132385628.db2.gz VZFCSVJBRITMFE-KBPBESRZSA-N 1 1 289.753 3.626 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)ccc2ccccc21 ZINC001231878802 1132389301 /nfs/dbraw/zinc/38/93/01/1132389301.db2.gz UTRGFOLCMIPYHF-QAPCUYQASA-N 1 1 297.398 3.546 20 10 CHCDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000841751242 1132389471 /nfs/dbraw/zinc/38/94/71/1132389471.db2.gz GILNYKLJBVAPJH-YUMQZZPRSA-N 1 1 297.811 3.617 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@]3(C2)CCCCO3)ccc2ccccc21 ZINC001231879380 1132389643 /nfs/dbraw/zinc/38/96/43/1132389643.db2.gz DECJKGSGNDSMGP-IBGZPJMESA-N 1 1 297.398 3.690 20 10 CHCDMO CCC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CCOCC1 ZINC000841748552 1132389753 /nfs/dbraw/zinc/38/97/53/1132389753.db2.gz AOPYWZCGKYBKCJ-GFCCVEGCSA-N 1 1 297.826 3.903 20 10 CHCDMO Oc1c(C[N@H+]2CCCC[C@H](F)C2)ccc2ccccc21 ZINC001231879614 1132389846 /nfs/dbraw/zinc/38/98/46/1132389846.db2.gz KQWUXYXZOIFHKB-HNNXBMFYSA-N 1 1 273.351 3.869 20 10 CHCDMO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccc(Cl)cc1O ZINC000841754234 1132391746 /nfs/dbraw/zinc/39/17/46/1132391746.db2.gz JIQZSZVAHUCXSS-FFFUXKDYSA-N 1 1 295.810 3.510 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(Cl)cc1O ZINC000841760902 1132396833 /nfs/dbraw/zinc/39/68/33/1132396833.db2.gz VSESTFJRCPURRM-VXGBXAGGSA-N 1 1 290.794 3.895 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC2(CCCC2)CC1 ZINC001142512695 1132402974 /nfs/dbraw/zinc/40/29/74/1132402974.db2.gz IKWAHNBIEWQQBW-UHFFFAOYSA-N 1 1 281.346 3.827 20 10 CHCDMO Cc1cccc(CC[N@@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001142524981 1132403192 /nfs/dbraw/zinc/40/31/92/1132403192.db2.gz RPBMVXPAVREZBF-UHFFFAOYSA-N 1 1 291.341 3.653 20 10 CHCDMO Cc1cccc(CC[N@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001142524981 1132403194 /nfs/dbraw/zinc/40/31/94/1132403194.db2.gz RPBMVXPAVREZBF-UHFFFAOYSA-N 1 1 291.341 3.653 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001142526972 1132403221 /nfs/dbraw/zinc/40/32/21/1132403221.db2.gz DFVTYTMPHLIQOO-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001142526972 1132403224 /nfs/dbraw/zinc/40/32/24/1132403224.db2.gz DFVTYTMPHLIQOO-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1Cl ZINC001232268505 1132447525 /nfs/dbraw/zinc/44/75/25/1132447525.db2.gz PWNWTMISVAYUKC-ZWNOBZJWSA-N 1 1 281.783 3.516 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)CC(F)F ZINC000842892389 1132474727 /nfs/dbraw/zinc/47/47/27/1132474727.db2.gz CAJPBLCFGTWUGF-IUCAKERBSA-N 1 1 277.742 3.988 20 10 CHCDMO CCO[C@@H]1CCC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110412 1132503931 /nfs/dbraw/zinc/50/39/31/1132503931.db2.gz FMBSCLTUWRSNDU-OAHLLOKOSA-N 1 1 291.435 3.691 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC3(CC=CC3)[C@H]2C(C)C)c1 ZINC000843432104 1132532319 /nfs/dbraw/zinc/53/23/19/1132532319.db2.gz QOOXWHZGGYRVEU-QGZVFWFLSA-N 1 1 287.403 3.577 20 10 CHCDMO CC[N@@H+](CCSC)Cc1ccc2ccccc2c1O ZINC000843437364 1132535463 /nfs/dbraw/zinc/53/54/63/1132535463.db2.gz FAMTUBGHKHVTSV-UHFFFAOYSA-N 1 1 275.417 3.730 20 10 CHCDMO CC[N@@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC001233193796 1132578376 /nfs/dbraw/zinc/57/83/76/1132578376.db2.gz FQAQUKTVDLJZAX-UHFFFAOYSA-N 1 1 294.192 3.760 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)c1 ZINC000132364373 1132581967 /nfs/dbraw/zinc/58/19/67/1132581967.db2.gz OTAORSCZHKPULD-HUUCEWRRSA-N 1 1 259.393 3.713 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC001233285887 1132594167 /nfs/dbraw/zinc/59/41/67/1132594167.db2.gz WTJXFMKUOOAYTK-CQSZACIVSA-N 1 1 265.372 3.624 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1 ZINC001233284249 1132594600 /nfs/dbraw/zinc/59/46/00/1132594600.db2.gz NMIWTOBNFWOTRO-OCCSQVGLSA-N 1 1 295.373 3.777 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCc3cnccc3C2)c1 ZINC001233284446 1132594908 /nfs/dbraw/zinc/59/49/08/1132594908.db2.gz VCPKXEMNKOORAC-UHFFFAOYSA-N 1 1 296.414 3.643 20 10 CHCDMO CO[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286426 1132595341 /nfs/dbraw/zinc/59/53/41/1132595341.db2.gz UAVFJLAGOQPRSM-INIZCTEOSA-N 1 1 291.435 3.691 20 10 CHCDMO CC(C)O[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286824 1132595356 /nfs/dbraw/zinc/59/53/56/1132595356.db2.gz KBSFBRPJKHGEGU-INIZCTEOSA-N 1 1 291.435 3.689 20 10 CHCDMO C[N@@H+](CCc1ccccn1)Cc1cc(C(C)(C)C)ccc1O ZINC001233283803 1132595554 /nfs/dbraw/zinc/59/55/54/1132595554.db2.gz WMQZGOIOBDHYFY-UHFFFAOYSA-N 1 1 298.430 3.759 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1 ZINC001233286087 1132595950 /nfs/dbraw/zinc/59/59/50/1132595950.db2.gz DWHJYFPHVONNJP-GASCZTMLSA-N 1 1 273.420 3.778 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)[C@H](C)C1 ZINC001233287428 1132596580 /nfs/dbraw/zinc/59/65/80/1132596580.db2.gz PELSODCVZDZLGW-CZUORRHYSA-N 1 1 291.435 3.689 20 10 CHCDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233418431 1132619573 /nfs/dbraw/zinc/61/95/73/1132619573.db2.gz GXAXQPKMEHTQSX-GHMZBOCLSA-N 1 1 287.325 3.889 20 10 CHCDMO Oc1cc(Cl)ccc1Nc1cc[nH+]c2ccccc12 ZINC001174039743 1132704756 /nfs/dbraw/zinc/70/47/56/1132704756.db2.gz AYHOWGULNMOINF-UHFFFAOYSA-N 1 1 270.719 3.759 20 10 CHCDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(OC)cc1O ZINC001203628997 1133345926 /nfs/dbraw/zinc/34/59/26/1133345926.db2.gz NANWTROLILLUOX-SFHVURJKSA-N 1 1 297.398 3.910 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)cc1 ZINC001203939373 1133385701 /nfs/dbraw/zinc/38/57/01/1133385701.db2.gz AHMBJKKDVYHXHI-ZBFHGGJFSA-N 1 1 294.389 3.620 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001203937650 1133386243 /nfs/dbraw/zinc/38/62/43/1133386243.db2.gz IYIFKMOYOFMTLQ-UHFFFAOYSA-N 1 1 282.431 3.947 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCCOC2)c2ccccc21 ZINC001204241175 1133423802 /nfs/dbraw/zinc/42/38/02/1133423802.db2.gz YUCKBINXKRTERP-MRXNPFEDSA-N 1 1 298.430 3.517 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccc(O)cc1O ZINC001204272272 1133427717 /nfs/dbraw/zinc/42/77/17/1133427717.db2.gz LPGUJZJNQIGFPZ-UHFFFAOYSA-N 1 1 271.360 3.508 20 10 CHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001204323775 1133437296 /nfs/dbraw/zinc/43/72/96/1133437296.db2.gz JAJPKDRZANNJNH-ROUUACIJSA-N 1 1 284.447 3.909 20 10 CHCDMO F[C@H]1CCCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325648 1133438382 /nfs/dbraw/zinc/43/83/82/1133438382.db2.gz SNQYLMPSBVFDJE-INIZCTEOSA-N 1 1 276.399 3.611 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3cccc(O)c3C2)cc1C ZINC001204354483 1133439985 /nfs/dbraw/zinc/43/99/85/1133439985.db2.gz FSNFKOYNHHQLSB-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)cc(F)c2O)c1 ZINC001205069849 1133522489 /nfs/dbraw/zinc/52/24/89/1133522489.db2.gz IASXNCOVAKYCIS-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(F)cc(F)c2O)c1 ZINC001205069849 1133522492 /nfs/dbraw/zinc/52/24/92/1133522492.db2.gz IASXNCOVAKYCIS-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1cccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1C ZINC001205095295 1133529277 /nfs/dbraw/zinc/52/92/77/1133529277.db2.gz BAMATVANSPFGTM-UHFFFAOYSA-N 1 1 297.398 3.663 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(Br)cc2O)[C@@H]1C ZINC001205470633 1133580584 /nfs/dbraw/zinc/58/05/84/1133580584.db2.gz BEHYKYJAGMWUDP-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001205489424 1133582252 /nfs/dbraw/zinc/58/22/52/1133582252.db2.gz QGWQXIDOALEZCZ-QNRLHKFMSA-N 1 1 272.436 3.886 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C)C2)cc1Cl ZINC001205550940 1133586966 /nfs/dbraw/zinc/58/69/66/1133586966.db2.gz GDYGHQJZCYHEMQ-JTQLQIEISA-N 1 1 253.773 3.586 20 10 CHCDMO CC(C)[C@@H]1[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001206040942 1133646619 /nfs/dbraw/zinc/64/66/19/1133646619.db2.gz QRXYWZJUPQVAHA-INIZCTEOSA-N 1 1 296.405 3.897 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC001206288923 1133683405 /nfs/dbraw/zinc/68/34/05/1133683405.db2.gz XLUMHKYIJJEYEW-QGZVFWFLSA-N 1 1 272.436 3.683 20 10 CHCDMO Cc1ccc(CC[N@H+]2Cc3cccc(O)c3C2)cc1C ZINC001207243890 1133782141 /nfs/dbraw/zinc/78/21/41/1133782141.db2.gz SXRQPPSCLGJMGA-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3ccsc3C2)cc1Cl ZINC001207719633 1133840709 /nfs/dbraw/zinc/84/07/09/1133840709.db2.gz NVIQHOCWTJVEMU-UHFFFAOYSA-N 1 1 293.819 3.974 20 10 CHCDMO Cc1ccc([C@H](C)CC[N@H+]2CCc3cccc(O)c3C2)o1 ZINC001208165850 1133893059 /nfs/dbraw/zinc/89/30/59/1133893059.db2.gz HFDHGCUQRCLRHV-CYBMUJFWSA-N 1 1 285.387 3.846 20 10 CHCDMO CC1=C[C@@H](C)[C@@H](C[N@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184004 1133901259 /nfs/dbraw/zinc/90/12/59/1133901259.db2.gz ZMQNCEMLDDXNEK-GDBMZVCRSA-N 1 1 271.404 3.743 20 10 CHCDMO C[N@@H+]1CC=C(Nc2cccc3c2C(=O)c2ccccc2-3)CC1 ZINC001208909816 1133962178 /nfs/dbraw/zinc/96/21/78/1133962178.db2.gz GTKGTXWEISQTET-UHFFFAOYSA-N 1 1 290.366 3.529 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CC2Cc3ccccc3C2)cc1 ZINC001209322675 1134005800 /nfs/dbraw/zinc/00/58/00/1134005800.db2.gz SVKISSQVMCYBLH-UHFFFAOYSA-N 1 1 294.442 3.599 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+](C)C2CCOCC2)cc1 ZINC001209517292 1134034756 /nfs/dbraw/zinc/03/47/56/1134034756.db2.gz CAZSDUACIADISR-UHFFFAOYSA-N 1 1 298.430 3.705 20 10 CHCDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000179555293 1134549272 /nfs/dbraw/zinc/54/92/72/1134549272.db2.gz ZLVHYTJMEOQIIC-QGZVFWFLSA-N 1 1 283.371 3.738 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1O ZINC000153552092 261080541 /nfs/dbraw/zinc/08/05/41/261080541.db2.gz NOLKLKGXDRVZDL-CQSZACIVSA-N 1 1 289.400 3.799 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000180178767 261845335 /nfs/dbraw/zinc/84/53/35/261845335.db2.gz TYDCFSCNDDRJBX-CYBMUJFWSA-N 1 1 271.360 3.599 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccoc2C)c1O ZINC000184683484 262025860 /nfs/dbraw/zinc/02/58/60/262025860.db2.gz KHDSLOYDQJBCRW-UHFFFAOYSA-N 1 1 295.766 3.588 20 10 CHCDMO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)s1 ZINC000186766274 262109433 /nfs/dbraw/zinc/10/94/33/262109433.db2.gz AGBZONXJJQWLDU-GXSJLCMTSA-N 1 1 294.395 3.751 20 10 CHCDMO CC(C)([NH2+]Cc1cccc(F)c1O)c1ccccc1F ZINC000292691795 519325054 /nfs/dbraw/zinc/32/50/54/519325054.db2.gz BLUIPPYKGWINCI-UHFFFAOYSA-N 1 1 277.314 3.695 20 10 CHCDMO CCC[N@@H+](CCc1ccccn1)Cc1cccc(C)c1O ZINC000289756474 521673326 /nfs/dbraw/zinc/67/33/26/521673326.db2.gz JMCYBDSHSGVAMS-UHFFFAOYSA-N 1 1 284.403 3.550 20 10 CHCDMO CCC[N@@H+](Cc1nc(C)c(C)s1)Cc1ccccc1O ZINC000088602565 521692811 /nfs/dbraw/zinc/69/28/11/521692811.db2.gz XWPOCPJTWXPSHD-UHFFFAOYSA-N 1 1 290.432 3.878 20 10 CHCDMO CCSc1cccc(C[NH2+]Cc2cccc(F)c2O)c1 ZINC000292784019 521757658 /nfs/dbraw/zinc/75/76/58/521757658.db2.gz LRGUETSZNNIYJS-UHFFFAOYSA-N 1 1 291.391 3.933 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000290488833 523121930 /nfs/dbraw/zinc/12/19/30/523121930.db2.gz OMTGQLULWYBLJN-KRWDZBQOSA-N 1 1 284.403 3.987 20 10 CHCDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc(C)ccc1O ZINC000281087836 523552905 /nfs/dbraw/zinc/55/29/05/523552905.db2.gz JXNXVMZPIZNUOE-INIZCTEOSA-N 1 1 299.418 3.644 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062747713 524092927 /nfs/dbraw/zinc/09/29/27/524092927.db2.gz BPUPEQRGQUJLDO-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062744976 524782873 /nfs/dbraw/zinc/78/28/73/524782873.db2.gz GIWGALUMECGIER-NEPJUHHUSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccn(C)c1)c1cc(Cl)c(Cl)cc1O ZINC000278356422 525542167 /nfs/dbraw/zinc/54/21/67/525542167.db2.gz BCNUDHVTEGRCJY-SECBINFHSA-N 1 1 299.201 3.888 20 10 CHCDMO C[C@H](O)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278973359 525714929 /nfs/dbraw/zinc/71/49/29/525714929.db2.gz CGPHPSMKYHZUPZ-IUCAKERBSA-N 1 1 292.206 3.511 20 10 CHCDMO Cc1cccc(C[N@H+](Cc2ccccn2)CC(C)C)c1O ZINC000055182847 570241271 /nfs/dbraw/zinc/24/12/71/570241271.db2.gz WNIYHVQRDXMURH-UHFFFAOYSA-N 1 1 284.403 3.754 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1 ZINC000312743310 1120589239 /nfs/dbraw/zinc/58/92/39/1120589239.db2.gz YDIXIHHPSBGZPO-CYBMUJFWSA-N 1 1 287.325 3.863 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645509 1122654882 /nfs/dbraw/zinc/65/48/82/1122654882.db2.gz NRIOPXPZMKGLTH-GOEBONIOSA-N 1 1 260.425 3.824 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(F)cc1O ZINC000850551820 1123290055 /nfs/dbraw/zinc/29/00/55/1123290055.db2.gz KAZYLZHCDKPRDC-DGCLKSJQSA-N 1 1 287.325 3.863 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000853564095 1123443986 /nfs/dbraw/zinc/44/39/86/1123443986.db2.gz JNWNAPCDIWICGD-CQSZACIVSA-N 1 1 265.372 3.581 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2C)c1O ZINC000037322572 1132028208 /nfs/dbraw/zinc/02/82/08/1132028208.db2.gz VJVQQHMAHDJXAC-SNVBAGLBSA-N 1 1 281.783 3.623 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248880808 1132151218 /nfs/dbraw/zinc/15/12/18/1132151218.db2.gz NLKYEAKSFSEJGL-LBPRGKRZSA-N 1 1 297.826 3.564 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000884482663 1125567593 /nfs/dbraw/zinc/56/75/93/1125567593.db2.gz GEDKAKKDTFRYBR-BEFAXECRSA-N 1 1 297.398 3.546 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CCOCC1 ZINC000841748661 1125577610 /nfs/dbraw/zinc/57/76/10/1125577610.db2.gz BBINLPMTLKMOJV-NHYWBVRUSA-N 1 1 297.826 3.901 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841755028 1125594445 /nfs/dbraw/zinc/59/44/45/1125594445.db2.gz FUUAJEIRJDTLRK-YWVKMMECSA-N 1 1 271.813 3.590 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1ccc(Cl)cc1O ZINC000841758722 1125600647 /nfs/dbraw/zinc/60/06/47/1125600647.db2.gz URRIHZBOTGGKJZ-PUYPPJJSSA-N 1 1 265.784 3.742 20 10 CHCDMO CCOc1cccc(C[N@@H+]2[C@H](CC)CC[C@@H]2C)c1O ZINC000136821571 1125647737 /nfs/dbraw/zinc/64/77/37/1125647737.db2.gz QXRZNKQAVXPVON-GXTWGEPZSA-N 1 1 263.381 3.554 20 10 CHCDMO CCOc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886505148 1125681013 /nfs/dbraw/zinc/68/10/13/1125681013.db2.gz NHUJVOKUXDGKLC-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO COc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccc1C ZINC000886515552 1125682663 /nfs/dbraw/zinc/68/26/63/1125682663.db2.gz NFQNOKYJZFFSGN-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886542611 1125686764 /nfs/dbraw/zinc/68/67/64/1125686764.db2.gz CPTQVEQXTIECLU-RYUDHWBXSA-N 1 1 274.339 3.647 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1c(O)cccc1F ZINC000886558703 1125690036 /nfs/dbraw/zinc/69/00/36/1125690036.db2.gz QFOTUYYSMUSEEW-HUBLWGQQSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2c(O)cccc2F)s1 ZINC000886589839 1125694158 /nfs/dbraw/zinc/69/41/58/1125694158.db2.gz HGYNBFCVIIPRSR-ONGXEEELSA-N 1 1 294.395 3.751 20 10 CHCDMO Cc1cccc(CCC[NH2+][C@H](C)c2c(O)cccc2F)n1 ZINC000886609122 1125696897 /nfs/dbraw/zinc/69/68/97/1125696897.db2.gz MLASGARGWFNZCN-CYBMUJFWSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1c(O)cccc1F ZINC000886638681 1125700785 /nfs/dbraw/zinc/70/07/85/1125700785.db2.gz ZPUMHDVHMQSFBF-BONVTDFDSA-N 1 1 287.334 3.575 20 10 CHCDMO COc1c(C)cccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886632955 1125701203 /nfs/dbraw/zinc/70/12/03/1125701203.db2.gz KIFUIRLXTKSFQA-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCc2ccsc2C1 ZINC000760284822 1125718409 /nfs/dbraw/zinc/71/84/09/1125718409.db2.gz GTJDVQFHXRISLJ-UHFFFAOYSA-N 1 1 296.395 3.560 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000300416155 1125726161 /nfs/dbraw/zinc/72/61/61/1125726161.db2.gz LPMLKPNHKOSOPK-OLZOCXBDSA-N 1 1 263.356 3.543 20 10 CHCDMO CSc1cc(C)cc(C[N@H+]2CCc3cccc(O)c3C2)c1 ZINC001238681239 1131231379 /nfs/dbraw/zinc/23/13/79/1131231379.db2.gz HPWGQSPGMCNXPP-UHFFFAOYSA-N 1 1 299.439 3.981 20 10 CHCDMO CCCC[N@@H+](C/C=C\Cl)Cc1ccccc1O ZINC000801597719 1129931788 /nfs/dbraw/zinc/93/17/88/1129931788.db2.gz NGFJTTVEMQAFTA-TWGQIWQCSA-N 1 1 253.773 3.747 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCCc1cccs1 ZINC000790980712 1130345349 /nfs/dbraw/zinc/34/53/49/1130345349.db2.gz CEOVBBCBGGJGPJ-UHFFFAOYSA-N 1 1 299.798 3.969 20 10 CHCDMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccccc1O ZINC000177676204 1126803667 /nfs/dbraw/zinc/80/36/67/1126803667.db2.gz PHXHHXZLOBAPGV-GFCCVEGCSA-N 1 1 288.391 3.871 20 10 CHCDMO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccccc1O ZINC000177676204 1126803669 /nfs/dbraw/zinc/80/36/69/1126803669.db2.gz PHXHHXZLOBAPGV-GFCCVEGCSA-N 1 1 288.391 3.871 20 10 CHCDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccccc1O)c1ccccc1 ZINC000179580165 1126831151 /nfs/dbraw/zinc/83/11/51/1126831151.db2.gz GAWAOEMWSXRRBI-KRWDZBQOSA-N 1 1 295.382 3.630 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc(C)c2O)s1 ZINC000180153903 1126840378 /nfs/dbraw/zinc/84/03/78/1126840378.db2.gz RLMJADHIDHPGOC-GFCCVEGCSA-N 1 1 290.432 3.967 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccncc2)cc1 ZINC000180866578 1126849301 /nfs/dbraw/zinc/84/93/01/1126849301.db2.gz SMNHQUPTBAODCZ-UHFFFAOYSA-N 1 1 283.419 3.560 20 10 CHCDMO CC[C@@](C)(O)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192841708 1126964617 /nfs/dbraw/zinc/96/46/17/1126964617.db2.gz GDNKLPMUSLGTEM-AMIZOPFISA-N 1 1 292.206 3.511 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237122555 1131056891 /nfs/dbraw/zinc/05/68/91/1131056891.db2.gz VYZMQHQWXPIRQT-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO CCc1cnc(C[N@H+](C)Cc2cc(C)cc(C)c2O)s1 ZINC000164447186 1127166311 /nfs/dbraw/zinc/16/63/11/1127166311.db2.gz RNYUPOXSWVGCDM-UHFFFAOYSA-N 1 1 290.432 3.660 20 10 CHCDMO CCc1cnc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)s1 ZINC000164447186 1127166312 /nfs/dbraw/zinc/16/63/12/1127166312.db2.gz RNYUPOXSWVGCDM-UHFFFAOYSA-N 1 1 290.432 3.660 20 10 CHCDMO Cc1occc1C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816496631 1131100870 /nfs/dbraw/zinc/10/08/70/1131100870.db2.gz QDNMFGQCQLCOCJ-UHFFFAOYSA-N 1 1 283.730 3.718 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816496631 1131100875 /nfs/dbraw/zinc/10/08/75/1131100875.db2.gz QDNMFGQCQLCOCJ-UHFFFAOYSA-N 1 1 283.730 3.718 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)c1O ZINC001237682048 1131126310 /nfs/dbraw/zinc/12/63/10/1131126310.db2.gz VLBHFAQCTCPCEV-TZMCWYRMSA-N 1 1 289.753 3.626 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)c1O ZINC001237682048 1131126313 /nfs/dbraw/zinc/12/63/13/1131126313.db2.gz VLBHFAQCTCPCEV-TZMCWYRMSA-N 1 1 289.753 3.626 20 10 CHCDMO CC[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000285899800 1127246165 /nfs/dbraw/zinc/24/61/65/1127246165.db2.gz BHCVFBZYYQBWLO-ZBFHGGJFSA-N 1 1 295.398 3.921 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2C[C@@H]2C)cc1 ZINC001308646015 1127413603 /nfs/dbraw/zinc/41/36/03/1127413603.db2.gz ZFPYXCOMONBRJH-HOCLYGCPSA-N 1 1 260.425 3.621 20 10 CHCDMO C[C@@H](c1ccccn1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293558094 1127505776 /nfs/dbraw/zinc/50/57/76/1127505776.db2.gz HTCAVWIIGRCXOP-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293558094 1127505777 /nfs/dbraw/zinc/50/57/77/1127505777.db2.gz HTCAVWIIGRCXOP-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293711170 1127514688 /nfs/dbraw/zinc/51/46/88/1127514688.db2.gz UTHMNVBWSPYSBN-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293711170 1127514691 /nfs/dbraw/zinc/51/46/91/1127514691.db2.gz UTHMNVBWSPYSBN-JTQLQIEISA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@H](c1cccnc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293748646 1127517472 /nfs/dbraw/zinc/51/74/72/1127517472.db2.gz XWASRFMNVJXZFL-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293748646 1127517475 /nfs/dbraw/zinc/51/74/75/1127517475.db2.gz XWASRFMNVJXZFL-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)cc1 ZINC001120370991 1127520879 /nfs/dbraw/zinc/52/08/79/1127520879.db2.gz LWUQCQQQUIUNQB-QGZVFWFLSA-N 1 1 256.393 3.591 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)CC(C)(C)C)c1O ZINC000228630971 1127576233 /nfs/dbraw/zinc/57/62/33/1127576233.db2.gz PVGRSZNCUNAZRT-UHFFFAOYSA-N 1 1 271.788 3.532 20 10 CHCDMO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)CC(C)C ZINC000228607256 1127571784 /nfs/dbraw/zinc/57/17/84/1127571784.db2.gz IXRCHPYQMHATEK-UHFFFAOYSA-N 1 1 271.788 3.532 20 10 CHCDMO CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000230662531 1127771606 /nfs/dbraw/zinc/77/16/06/1127771606.db2.gz CRYSXHDDTFNQEC-CYZMBNFOSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc(F)cc1O ZINC000062747634 1127773764 /nfs/dbraw/zinc/77/37/64/1127773764.db2.gz BRBFIYNDTGJHTP-AAEUAGOBSA-N 1 1 271.335 3.522 20 10 CHCDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785176 1128244622 /nfs/dbraw/zinc/24/46/22/1128244622.db2.gz RIUPUGBZQJNYNI-GUYCJALGSA-N 1 1 273.420 3.891 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000927101894 1128217692 /nfs/dbraw/zinc/21/76/92/1128217692.db2.gz PTAPCRWQLQAHDI-NWDGAFQWSA-N 1 1 295.398 3.776 20 10 CHCDMO COC/C(C)=C\C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000929635276 1128280272 /nfs/dbraw/zinc/28/02/72/1128280272.db2.gz IMUKOYSTXTVPMX-PTNGSMBKSA-N 1 1 289.419 3.730 20 10 CHCDMO Cc1cc(N(C)C)ccc1CNc1[nH+]c2ccccc2n1C ZINC000762532886 1128305295 /nfs/dbraw/zinc/30/52/95/1128305295.db2.gz HWSWFSGRKAGMRI-UHFFFAOYSA-N 1 1 294.402 3.560 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)Cc1cccc(F)c1 ZINC001168499305 1128340500 /nfs/dbraw/zinc/34/05/00/1128340500.db2.gz YSNTUAOEGIEVTK-CQSZACIVSA-N 1 1 287.378 3.984 20 10 CHCDMO CC(C)(C)c1ccc(C[N@H+]2CCC[C@H](F)C2)c(O)c1 ZINC001235677152 1128347275 /nfs/dbraw/zinc/34/72/75/1128347275.db2.gz BXYCAHBMEHRQFM-AWEZNQCLSA-N 1 1 265.372 3.624 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]1c1ccccc1)CCC2 ZINC000917446486 1128499782 /nfs/dbraw/zinc/49/97/82/1128499782.db2.gz VHZDCZMWPSWSPU-GOSISDBHSA-N 1 1 279.383 3.828 20 10 CHCDMO CC[N@@H+](Cc1cc2c(cc1O)CCC2)C1CCCC1 ZINC000917461959 1128499867 /nfs/dbraw/zinc/49/98/67/1128499867.db2.gz AJIMWFOHVVDKLY-UHFFFAOYSA-N 1 1 259.393 3.645 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccccn1)CCC2 ZINC000919952296 1128653884 /nfs/dbraw/zinc/65/38/84/1128653884.db2.gz TXVVVKRAANTHOY-SFHVURJKSA-N 1 1 294.398 3.613 20 10 CHCDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1cc(F)ccc1O ZINC000779022679 1128685293 /nfs/dbraw/zinc/68/52/93/1128685293.db2.gz FTTMQSNWRPCOEN-GUYCJALGSA-N 1 1 285.362 3.909 20 10 CHCDMO COc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)ccc1C ZINC000185193234 1117780663 /nfs/dbraw/zinc/78/06/63/1117780663.db2.gz KGPQRYYSCLOFOR-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1cc(F)ccc1O ZINC000185472218 1117828719 /nfs/dbraw/zinc/82/87/19/1117828719.db2.gz YDHCUGSVKSFKNS-BLLLJJGKSA-N 1 1 296.430 3.548 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccn1 ZINC000073394633 1118034138 /nfs/dbraw/zinc/03/41/38/1118034138.db2.gz LWYOIWKUTVFZEE-UHFFFAOYSA-N 1 1 295.430 3.704 20 10 CHCDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cccc(C)c1O ZINC000179698159 1128754410 /nfs/dbraw/zinc/75/44/10/1128754410.db2.gz SHWLJCQUTDLGKH-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC[C@@H](NCCC[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000764434038 1118091868 /nfs/dbraw/zinc/09/18/68/1118091868.db2.gz UGSOGNORDNTCIE-GOSISDBHSA-N 1 1 291.483 3.525 20 10 CHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@H](C)c1cccc(O)c1 ZINC000179770740 1128758291 /nfs/dbraw/zinc/75/82/91/1128758291.db2.gz SHEYTSOXCXPKRP-CQSZACIVSA-N 1 1 285.387 3.989 20 10 CHCDMO CC[C@@H](C)[N@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653567 1118188147 /nfs/dbraw/zinc/18/81/47/1118188147.db2.gz BOCUDLJRWPBEGN-CVEARBPZSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653567 1118188149 /nfs/dbraw/zinc/18/81/49/1118188149.db2.gz BOCUDLJRWPBEGN-CVEARBPZSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cncc(C)c2)cc1 ZINC000785439970 1118202124 /nfs/dbraw/zinc/20/21/24/1118202124.db2.gz SOLSONIBIJOKIW-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO CC[C@H](N[C@@H](C)C[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000765770370 1118322510 /nfs/dbraw/zinc/32/25/10/1118322510.db2.gz WRPBHXRJVVSCTO-YJBOKZPZSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)C[N@H+](CC)Cc1cc(F)cc(C(C)=O)c1O ZINC000093251804 1118593498 /nfs/dbraw/zinc/59/34/98/1118593498.db2.gz WMBHZYMOWUYRKP-LLVKDONJSA-N 1 1 281.371 3.602 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1cc(F)cc(C(C)=O)c1O ZINC000093251804 1118593500 /nfs/dbraw/zinc/59/35/00/1118593500.db2.gz WMBHZYMOWUYRKP-LLVKDONJSA-N 1 1 281.371 3.602 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707141272 1118648937 /nfs/dbraw/zinc/64/89/37/1118648937.db2.gz XFUNLARYAOMVIS-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@H]2C)ccc1N1CCCCC1 ZINC001167487153 1118717512 /nfs/dbraw/zinc/71/75/12/1118717512.db2.gz GNHUZSKWQJHJOW-MRXNPFEDSA-N 1 1 272.436 3.970 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001140461941 1118720578 /nfs/dbraw/zinc/72/05/78/1118720578.db2.gz ZKRCTTXQIJYXMN-LBPRGKRZSA-N 1 1 293.716 3.615 20 10 CHCDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000180670714 1128801233 /nfs/dbraw/zinc/80/12/33/1128801233.db2.gz AZQPJDPTKOMXCR-CYBMUJFWSA-N 1 1 267.438 3.664 20 10 CHCDMO C[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052569 1118830128 /nfs/dbraw/zinc/83/01/28/1118830128.db2.gz HGIPBKOSEGXUTD-ZRUQZJFASA-N 1 1 294.389 3.743 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)Cc1ccsc1 ZINC000190259212 1128808365 /nfs/dbraw/zinc/80/83/65/1128808365.db2.gz PEDAGZGWMPEMFP-ZDUSSCGKSA-N 1 1 275.417 3.907 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2[O-])C1 ZINC000708442161 1119467012 /nfs/dbraw/zinc/46/70/12/1119467012.db2.gz DOJJSMGFIVDNIT-CYBMUJFWSA-N 1 1 265.372 3.789 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC000708442161 1119467013 /nfs/dbraw/zinc/46/70/13/1119467013.db2.gz DOJJSMGFIVDNIT-CYBMUJFWSA-N 1 1 265.372 3.789 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000708442161 1119467014 /nfs/dbraw/zinc/46/70/14/1119467014.db2.gz DOJJSMGFIVDNIT-CYBMUJFWSA-N 1 1 265.372 3.789 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000179555468 1119751381 /nfs/dbraw/zinc/75/13/81/1119751381.db2.gz QAIAKOMVXIYADA-KRWDZBQOSA-N 1 1 267.372 3.599 20 10 CHCDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179568947 1119751397 /nfs/dbraw/zinc/75/13/97/1119751397.db2.gz QVGPOCOVRNFJMT-MRXNPFEDSA-N 1 1 283.371 3.738 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000179556340 1119751706 /nfs/dbraw/zinc/75/17/06/1119751706.db2.gz DDFJRVWORBRUAO-INIZCTEOSA-N 1 1 285.412 3.682 20 10 CHCDMO CCCC1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000160227570 1119950091 /nfs/dbraw/zinc/95/00/91/1119950091.db2.gz BCKXYTCPIHJRRG-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](F)CC2)c(O)c1 ZINC001140850038 1120029760 /nfs/dbraw/zinc/02/97/60/1120029760.db2.gz BBYYARNJNRCZMJ-OAHLLOKOSA-N 1 1 294.414 3.562 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC3(CC3)C2)c1[O-] ZINC000695086570 1120105238 /nfs/dbraw/zinc/10/52/38/1120105238.db2.gz TXGMMRIEIQHLEZ-UHFFFAOYSA-N 1 1 293.794 3.624 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC3(CC3)C2)c1O ZINC000695086570 1120105241 /nfs/dbraw/zinc/10/52/41/1120105241.db2.gz TXGMMRIEIQHLEZ-UHFFFAOYSA-N 1 1 293.794 3.624 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@@H](C)c1cccc(O)c1 ZINC000179942725 1120258658 /nfs/dbraw/zinc/25/86/58/1120258658.db2.gz SBZHNAUZWJSCRY-LBPRGKRZSA-N 1 1 289.350 3.820 20 10 CHCDMO CCCC[N@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765954129 1120281564 /nfs/dbraw/zinc/28/15/64/1120281564.db2.gz WGOIZKZYILUYKJ-MRXNPFEDSA-N 1 1 291.483 3.525 20 10 CHCDMO CCCC[N@@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765954129 1120281567 /nfs/dbraw/zinc/28/15/67/1120281567.db2.gz WGOIZKZYILUYKJ-MRXNPFEDSA-N 1 1 291.483 3.525 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000220294425 1120552645 /nfs/dbraw/zinc/55/26/45/1120552645.db2.gz GUGHSWIFABWSIF-KBPBESRZSA-N 1 1 291.435 3.607 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)cs1)Cc1ccccc1O ZINC000194345470 1120598165 /nfs/dbraw/zinc/59/81/65/1120598165.db2.gz SZFIKRVUOUXTND-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO CO[C@@H](C)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000248410936 1120707032 /nfs/dbraw/zinc/70/70/32/1120707032.db2.gz DLCOCQXCHGSMHW-JKSUJKDBSA-N 1 1 299.414 3.990 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](C)C1CC1)c1ccc(F)cc1O ZINC000796722051 1120713022 /nfs/dbraw/zinc/71/30/22/1120713022.db2.gz YQOVJYFESUCGMM-HZMBPMFUSA-N 1 1 251.345 3.618 20 10 CHCDMO CC[C@H]([NH2+]CC1CCC(OC)CC1)c1ccc(F)cc1O ZINC000796796181 1120748752 /nfs/dbraw/zinc/74/87/52/1120748752.db2.gz BKTZZGCAAHYNJY-PXCJXSSVSA-N 1 1 295.398 3.777 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000756759128 1120805092 /nfs/dbraw/zinc/80/50/92/1120805092.db2.gz UBLOWDDSRYQAHE-LRDDRELGSA-N 1 1 295.398 3.777 20 10 CHCDMO CCc1cccc(C[N@H+]2CCC[C@@H](CCF)C2)c1O ZINC000701676232 1121163727 /nfs/dbraw/zinc/16/37/27/1121163727.db2.gz XPHAIMGMNFLGGW-ZDUSSCGKSA-N 1 1 265.372 3.526 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C(C)C)c1O ZINC000228598922 1121190431 /nfs/dbraw/zinc/19/04/31/1121190431.db2.gz AJDQWRFASVJKTE-JTQLQIEISA-N 1 1 271.788 3.531 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1C ZINC000766118623 1121271941 /nfs/dbraw/zinc/27/19/41/1121271941.db2.gz NQACGLPXZITWIG-LBPRGKRZSA-N 1 1 287.325 3.783 20 10 CHCDMO CCCCC[N@@H+](Cc1cc2c(cc1O)OCO2)C(C)C ZINC000096630361 1121283843 /nfs/dbraw/zinc/28/38/43/1121283843.db2.gz LHXJLSOGOHENFG-UHFFFAOYSA-N 1 1 279.380 3.522 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1)CCC2 ZINC000766126110 1121288915 /nfs/dbraw/zinc/28/89/15/1121288915.db2.gz XHFZZZMKXFEMPG-NSHDSACASA-N 1 1 299.336 3.655 20 10 CHCDMO CCCC[N@@H+](Cc1nc(C)c(C)o1)Cc1ccccc1O ZINC000282533479 1121519957 /nfs/dbraw/zinc/51/99/57/1121519957.db2.gz VFWKITLJDGLYIK-UHFFFAOYSA-N 1 1 288.391 3.799 20 10 CHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccccc2O)CC12CC=CC2 ZINC000843432059 1121530761 /nfs/dbraw/zinc/53/07/61/1121530761.db2.gz PIZNLDJHCQNOQL-INIZCTEOSA-N 1 1 257.377 3.569 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccccc1F ZINC001203357008 1121806668 /nfs/dbraw/zinc/80/66/68/1121806668.db2.gz DBDWCKACAPXHAR-UHFFFAOYSA-N 1 1 259.324 3.553 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C(C)C)C2CCC2)cc1 ZINC000773773570 1121819749 /nfs/dbraw/zinc/81/97/49/1121819749.db2.gz OLKNZDFNBRIRRU-UHFFFAOYSA-N 1 1 260.425 3.906 20 10 CHCDMO COCC[N@H+](Cc1cc(C(C)C)ccc1O)CC(C)C ZINC001179942542 1121927802 /nfs/dbraw/zinc/92/78/02/1121927802.db2.gz RLOMCIKDXJJWSN-UHFFFAOYSA-N 1 1 279.424 3.620 20 10 CHCDMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001180030805 1121939954 /nfs/dbraw/zinc/93/99/54/1121939954.db2.gz PXPDJNDDNWTKFV-BIENSFFJSA-N 1 1 272.436 3.888 20 10 CHCDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC001180141993 1121951014 /nfs/dbraw/zinc/95/10/14/1121951014.db2.gz KFTXUQVVSIKOMQ-KSSFIOAISA-N 1 1 267.372 3.894 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC001180203730 1121963034 /nfs/dbraw/zinc/96/30/34/1121963034.db2.gz YJCBLTKYXIITKB-MAUKXSAKSA-N 1 1 289.419 3.517 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@H]12 ZINC001180271334 1121971732 /nfs/dbraw/zinc/97/17/32/1121971732.db2.gz ISFPEDDZHKSMQO-DAXOMENPSA-N 1 1 277.383 3.932 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001181205106 1122043524 /nfs/dbraw/zinc/04/35/24/1122043524.db2.gz IXEBGIAHOUTKQM-GFCCVEGCSA-N 1 1 283.362 3.929 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001181205106 1122043531 /nfs/dbraw/zinc/04/35/31/1122043531.db2.gz IXEBGIAHOUTKQM-GFCCVEGCSA-N 1 1 283.362 3.929 20 10 CHCDMO CCOC[C@H]1CCCC[N@H+]1Cc1c(O)cc(C)cc1Cl ZINC001182284847 1122130322 /nfs/dbraw/zinc/13/03/22/1122130322.db2.gz IXIIYQWPKPGIJO-CYBMUJFWSA-N 1 1 297.826 3.745 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)[C@H](C)[C@H]2C)c(Cl)c1 ZINC001182453745 1122161277 /nfs/dbraw/zinc/16/12/77/1122161277.db2.gz VREIVDASYNLTSK-SDDRHHMPSA-N 1 1 267.800 3.830 20 10 CHCDMO Oc1ccccc1CNc1cc[nH+]c2ccsc21 ZINC000774523797 1122178262 /nfs/dbraw/zinc/17/82/62/1122178262.db2.gz KOMIRQZIWABESJ-UHFFFAOYSA-N 1 1 256.330 3.614 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CCCC12CC2 ZINC001183196436 1122210709 /nfs/dbraw/zinc/21/07/09/1122210709.db2.gz BOWINQNFTVLNEX-NSHDSACASA-N 1 1 283.774 3.855 20 10 CHCDMO C/C=C\C[C@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC001183168713 1122211724 /nfs/dbraw/zinc/21/17/24/1122211724.db2.gz AHFYLVADGLGLBD-ZRMMWKCHSA-N 1 1 263.356 3.710 20 10 CHCDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC001183168713 1122211729 /nfs/dbraw/zinc/21/17/29/1122211729.db2.gz AHFYLVADGLGLBD-ZRMMWKCHSA-N 1 1 263.356 3.710 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C/C=C/c1ccc(F)cc1)C2 ZINC001183454769 1122223766 /nfs/dbraw/zinc/22/37/66/1122223766.db2.gz NNLMGLKHRJQLJF-NSCUHMNNSA-N 1 1 269.319 3.560 20 10 CHCDMO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1c(O)cccc1F ZINC001183920007 1122248232 /nfs/dbraw/zinc/24/82/32/1122248232.db2.gz SKOPYHSGBAIYLS-NWDGAFQWSA-N 1 1 253.361 3.836 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(OC)cc1O ZINC001203628494 1122363824 /nfs/dbraw/zinc/36/38/24/1122363824.db2.gz AXDAIRWWBYAUCN-QGZVFWFLSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)C2CCCCC2)c1 ZINC000775206449 1122481409 /nfs/dbraw/zinc/48/14/09/1122481409.db2.gz PAJQLIVIGBYPIZ-ZDUSSCGKSA-N 1 1 277.408 3.801 20 10 CHCDMO CC[C@@H]([NH2+]CCc1ccncc1C)c1ccc(F)cc1O ZINC000285938794 1122527704 /nfs/dbraw/zinc/52/77/04/1122527704.db2.gz DHLYBQIUBACVGM-MRXNPFEDSA-N 1 1 288.366 3.518 20 10 CHCDMO COc1ccc(N(C)C[C@@H]2CCCC[N@H+]2C(C)C)cc1F ZINC001191891259 1122620673 /nfs/dbraw/zinc/62/06/73/1122620673.db2.gz GZJSPCGIADSZSD-HNNXBMFYSA-N 1 1 294.414 3.533 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)[C@@H]2C)ccc1N1CCCCC1 ZINC001194702076 1122789079 /nfs/dbraw/zinc/78/90/79/1122789079.db2.gz OTGQCBLHNGTCGM-CVEARBPZSA-N 1 1 272.436 3.826 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCC(C)(C)O1 ZINC000775609986 1122799319 /nfs/dbraw/zinc/79/93/19/1122799319.db2.gz HVQLQENBRRPWND-HNNXBMFYSA-N 1 1 277.408 3.562 20 10 CHCDMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000080271800 1129079833 /nfs/dbraw/zinc/07/98/33/1129079833.db2.gz GUZGBVKJYWZCGU-NXEZZACHSA-N 1 1 280.368 3.708 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C(C)C)C2CCCCC2)c1 ZINC000775643355 1122851449 /nfs/dbraw/zinc/85/14/49/1122851449.db2.gz OMNYVANEKGGYSS-UHFFFAOYSA-N 1 1 277.408 3.944 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000775648094 1122856911 /nfs/dbraw/zinc/85/69/11/1122856911.db2.gz QPHOARKHUVGIHI-QGZVFWFLSA-N 1 1 297.398 3.608 20 10 CHCDMO Cc1cccc2c1CC[N@@H+](Cc1cc3c(cc1O)CCC3)C2 ZINC000729466905 1122894184 /nfs/dbraw/zinc/89/41/84/1122894184.db2.gz FQCIATFSZMEKLE-UHFFFAOYSA-N 1 1 293.410 3.748 20 10 CHCDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000894783028 1122905959 /nfs/dbraw/zinc/90/59/59/1122905959.db2.gz PHDXFLNEOGOGBY-OAHLLOKOSA-N 1 1 292.329 3.649 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000894783028 1122905962 /nfs/dbraw/zinc/90/59/62/1122905962.db2.gz PHDXFLNEOGOGBY-OAHLLOKOSA-N 1 1 292.329 3.649 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)C[C@H]2C)c1O ZINC000775716546 1122920541 /nfs/dbraw/zinc/92/05/41/1122920541.db2.gz XQOWBYHXVDIISE-GXSJLCMTSA-N 1 1 253.773 3.584 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2CCC(C)C)c1 ZINC000775730390 1122927396 /nfs/dbraw/zinc/92/73/96/1122927396.db2.gz APBRZTHCVMUTQT-OAHLLOKOSA-N 1 1 277.408 3.801 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000775735574 1122928664 /nfs/dbraw/zinc/92/86/64/1122928664.db2.gz WOYZNCZOUMBWTM-YOEHRIQHSA-N 1 1 267.372 3.894 20 10 CHCDMO CCCC1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC001201379352 1123094826 /nfs/dbraw/zinc/09/48/26/1123094826.db2.gz CTSARJSERNXALF-UHFFFAOYSA-N 1 1 271.763 3.855 20 10 CHCDMO CC[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc(F)cc(F)c1O ZINC001202454180 1123209217 /nfs/dbraw/zinc/20/92/17/1123209217.db2.gz AQAWJWILFUKQBF-GHMZBOCLSA-N 1 1 269.335 3.586 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccoc1)c1ccc(Cl)cc1O ZINC000850531036 1123284985 /nfs/dbraw/zinc/28/49/85/1123284985.db2.gz GMHNLVKSMIVDAS-SNVBAGLBSA-N 1 1 265.740 3.532 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)c1ccc(F)cc1O)C1CC1 ZINC000850540435 1123288121 /nfs/dbraw/zinc/28/81/21/1123288121.db2.gz MTKJVTAEJNIDLQ-KGLIPLIRSA-N 1 1 251.345 3.761 20 10 CHCDMO COc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1C ZINC000850579732 1123296425 /nfs/dbraw/zinc/29/64/25/1123296425.db2.gz ZABZSBCBDJSPSC-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc2cccnc21 ZINC000109770008 1123326523 /nfs/dbraw/zinc/32/65/23/1123326523.db2.gz KACJSFLLGUTHBC-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO CC[C@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC001204769372 1123425290 /nfs/dbraw/zinc/42/52/90/1123425290.db2.gz SZRHVJWAALEWMG-OSJSJHBBSA-N 1 1 290.476 3.593 20 10 CHCDMO C[C@]1(C2CC2)C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000853527807 1123442861 /nfs/dbraw/zinc/44/28/61/1123442861.db2.gz FFSAJYBOIXAKOF-LJQANCHMSA-N 1 1 297.398 3.546 20 10 CHCDMO CC1=C[C@H](C)C[N@H+](Cc2cccc(Br)c2O)C1 ZINC000797605475 1123459951 /nfs/dbraw/zinc/45/99/51/1123459951.db2.gz ROTFLKTXLGVVSG-JTQLQIEISA-N 1 1 296.208 3.553 20 10 CHCDMO CC1=C[C@H](C)C[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000797605475 1123459953 /nfs/dbraw/zinc/45/99/53/1123459953.db2.gz ROTFLKTXLGVVSG-JTQLQIEISA-N 1 1 296.208 3.553 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1c(F)cccc1Cl ZINC000112583569 1123494430 /nfs/dbraw/zinc/49/44/30/1123494430.db2.gz CQZYGYLBZRBBQL-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1c(F)cccc1Cl ZINC000112583569 1123494432 /nfs/dbraw/zinc/49/44/32/1123494432.db2.gz CQZYGYLBZRBBQL-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CCC(F)(F)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000858508786 1123659238 /nfs/dbraw/zinc/65/92/38/1123659238.db2.gz ZNBQVTPKRGVGKP-NSHDSACASA-N 1 1 257.324 3.705 20 10 CHCDMO C/C=C\C[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000858538326 1123659156 /nfs/dbraw/zinc/65/91/56/1123659156.db2.gz UEBUAMSFGSUXCP-TUUFMJSCSA-N 1 1 288.160 3.521 20 10 CHCDMO C[C@@H]([NH2+]Cc1cocn1)c1ccc(N2CCCCCC2)cc1 ZINC000777035329 1123661541 /nfs/dbraw/zinc/66/15/41/1123661541.db2.gz DPYRXIUJQGTDKJ-OAHLLOKOSA-N 1 1 299.418 3.906 20 10 CHCDMO CN(C)c1ccc(/C=C/Cn2c[nH+]c3c2CCCC3)cc1 ZINC000862432284 1123808876 /nfs/dbraw/zinc/80/88/76/1123808876.db2.gz XUCDQUWXVFCNQI-AATRIKPKSA-N 1 1 281.403 3.541 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473369 1123812975 /nfs/dbraw/zinc/81/29/75/1123812975.db2.gz OXWJAQQORYMDAT-SJORKVTESA-N 1 1 290.476 3.531 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c(Cl)c1 ZINC000862473605 1123813135 /nfs/dbraw/zinc/81/31/35/1123813135.db2.gz WUVCEEPWLRASFF-NEPJUHHUSA-N 1 1 297.851 3.824 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC3(CC3)CC2)c(O)c1 ZINC000862538882 1123818081 /nfs/dbraw/zinc/81/80/81/1123818081.db2.gz GMYMRPPGSMTKGA-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCCC2(CC2)CC1 ZINC000863329634 1123861253 /nfs/dbraw/zinc/86/12/53/1123861253.db2.gz DGMRBOLMHDNGEB-UHFFFAOYSA-N 1 1 282.387 3.707 20 10 CHCDMO CN(C)c1ccc(CNc2cc[nH+]cc2Cl)cc1F ZINC000301551106 1123910884 /nfs/dbraw/zinc/91/08/84/1123910884.db2.gz YGPXVXJSBWKXEO-UHFFFAOYSA-N 1 1 279.746 3.552 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000794654505 1123925482 /nfs/dbraw/zinc/92/54/82/1123925482.db2.gz CSDUHSSWUPNHKO-DGCLKSJQSA-N 1 1 287.325 3.782 20 10 CHCDMO CC[C@@H]([NH2+]CCCN1CCCCC1)c1ccc(C)cc1O ZINC000794794188 1123951830 /nfs/dbraw/zinc/95/18/30/1123951830.db2.gz QFXOCGMKZGNBQG-QGZVFWFLSA-N 1 1 290.451 3.617 20 10 CHCDMO CC[C@@H]([NH2+]CC[C@H]1CCSC1)c1ccc(F)cc1O ZINC000866405184 1124063853 /nfs/dbraw/zinc/06/38/53/1124063853.db2.gz YODSXFDJFHWYIH-SMDDNHRTSA-N 1 1 283.412 3.715 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@H](C)c2cc(F)cc(F)c2O)s1 ZINC000866455491 1124067920 /nfs/dbraw/zinc/06/79/20/1124067920.db2.gz MEGZFQVWVJUKTN-SFYZADRCSA-N 1 1 298.358 3.847 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCc3sccc3C2)c1 ZINC000122538393 1124507585 /nfs/dbraw/zinc/50/75/85/1124507585.db2.gz KGAUUEPOEKDNHA-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(N)cc2)C1 ZINC001120370607 1131274680 /nfs/dbraw/zinc/27/46/80/1131274680.db2.gz BXTNPSPYLJKGRN-MRXNPFEDSA-N 1 1 266.388 3.567 20 10 CHCDMO C/C(Cl)=C/C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000528419751 1124658324 /nfs/dbraw/zinc/65/83/24/1124658324.db2.gz PGNBAEAHRIIZQO-ODDCISTRSA-N 1 1 295.810 3.516 20 10 CHCDMO CN(c1ccc(C[NH2+]Cc2ccon2)cc1)C1CCCCC1 ZINC000873029384 1124734663 /nfs/dbraw/zinc/73/46/63/1124734663.db2.gz FXWWXWLMPXIYLA-UHFFFAOYSA-N 1 1 299.418 3.733 20 10 CHCDMO CCCOc1ccc(C[NH2+]Cc2cnc(CC)o2)cc1C ZINC000873129046 1124739457 /nfs/dbraw/zinc/73/94/57/1124739457.db2.gz GBQZLWSCRJWVMI-UHFFFAOYSA-N 1 1 288.391 3.624 20 10 CHCDMO C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc2ccccc2c1[O-] ZINC000873240193 1124755135 /nfs/dbraw/zinc/75/51/35/1124755135.db2.gz LIZCUYONHJAFNR-DZKIICNBSA-N 1 1 298.430 3.714 20 10 CHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1[O-] ZINC000873238693 1124755221 /nfs/dbraw/zinc/75/52/21/1124755221.db2.gz FEAFNIMWGCLFON-YRGRVCCFSA-N 1 1 296.842 3.522 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000876636255 1124966581 /nfs/dbraw/zinc/96/65/81/1124966581.db2.gz DAEBJCJHBUGGNC-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO Cc1ccc(C[N@H+](CCc2nccs2)C(C)C)c(O)c1 ZINC000876778206 1124976856 /nfs/dbraw/zinc/97/68/56/1124976856.db2.gz YRLNWJBLLITOSX-UHFFFAOYSA-N 1 1 290.432 3.610 20 10 CHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(C)cc2O)cs1 ZINC000877408717 1125027342 /nfs/dbraw/zinc/02/73/42/1125027342.db2.gz RMFSKCFYSSYTQX-OAHLLOKOSA-N 1 1 288.416 3.803 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C2 ZINC000877702922 1125066579 /nfs/dbraw/zinc/06/65/79/1125066579.db2.gz JZXKFAAQDQFZOF-JKSUJKDBSA-N 1 1 265.356 3.512 20 10 CHCDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC000878242902 1125133535 /nfs/dbraw/zinc/13/35/35/1125133535.db2.gz WSHAYIXOLUHZTA-PKOBYXMFSA-N 1 1 297.398 3.744 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1O ZINC000879649386 1125222428 /nfs/dbraw/zinc/22/24/28/1125222428.db2.gz POACVQVLWBMASB-LLVKDONJSA-N 1 1 274.364 3.529 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)C[C@@H](C)CC)c1O ZINC000211699745 1125321580 /nfs/dbraw/zinc/32/15/80/1125321580.db2.gz ORVSWKKKBWRQAH-ZDUSSCGKSA-N 1 1 265.397 3.659 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccncc1)C1CCCC1 ZINC000130611405 1125364575 /nfs/dbraw/zinc/36/45/75/1125364575.db2.gz BAKIDFOLKBXMCH-UHFFFAOYSA-N 1 1 282.387 3.732 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)[C@H]1CCCOC1 ZINC000883353288 1125400407 /nfs/dbraw/zinc/40/04/07/1125400407.db2.gz ROCJJEFFUDVLAS-XUJVJEKNSA-N 1 1 297.826 3.901 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N)cc2)c1 ZINC001204849090 1125428889 /nfs/dbraw/zinc/42/88/89/1125428889.db2.gz XVBHUSWSXDHJBZ-GOSISDBHSA-N 1 1 266.388 3.914 20 10 CHCDMO Cc1cc(C[N@H+]2CCCC[C@@](C)(F)C2)ccc1N(C)C ZINC001139669740 1131355696 /nfs/dbraw/zinc/35/56/96/1131355696.db2.gz KGWCVRPFWBYCGT-QGZVFWFLSA-N 1 1 278.415 3.775 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)ccc1N(C)C ZINC001139670021 1131358212 /nfs/dbraw/zinc/35/82/12/1131358212.db2.gz VPYBMQNBMVLNFJ-CALCHBBNSA-N 1 1 272.436 3.683 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCCC4(CC4)C3)c2c1 ZINC000184872149 1129260370 /nfs/dbraw/zinc/26/03/70/1129260370.db2.gz STIACSSQWWRMKG-UHFFFAOYSA-N 1 1 297.398 3.930 20 10 CHCDMO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1ccccc1O ZINC000091974480 1129375867 /nfs/dbraw/zinc/37/58/67/1129375867.db2.gz RQHNJRRRPVVDAT-SNAWJCMRSA-N 1 1 271.335 3.677 20 10 CHCDMO C[N@@H+](Cc1coc2ccccc12)Cc1ccccc1O ZINC000091956614 1129375999 /nfs/dbraw/zinc/37/59/99/1129375999.db2.gz OPQWGNQNDFIVEB-UHFFFAOYSA-N 1 1 267.328 3.770 20 10 CHCDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000091974432 1129376100 /nfs/dbraw/zinc/37/61/00/1129376100.db2.gz QFRVYBNEOQMGLH-WFASDCNBSA-N 1 1 271.360 3.741 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093275600 1129420414 /nfs/dbraw/zinc/42/04/14/1129420414.db2.gz INPTXEKVHGBAAF-GFCCVEGCSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](CCc2nccs2)C(C)C)c1 ZINC000093764306 1129427997 /nfs/dbraw/zinc/42/79/97/1129427997.db2.gz UCUWHMNYOBVETA-UHFFFAOYSA-N 1 1 290.432 3.610 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(F)cc1O ZINC000796770904 1129434214 /nfs/dbraw/zinc/43/42/14/1129434214.db2.gz GCNDQJKLPPROOV-HNNXBMFYSA-N 1 1 291.370 3.550 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC(C)(C)C3)c2c1 ZINC000743390909 1129522008 /nfs/dbraw/zinc/52/20/08/1129522008.db2.gz MDMXGBJBOWVGFU-UHFFFAOYSA-N 1 1 285.387 3.786 20 10 CHCDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380216 1129522616 /nfs/dbraw/zinc/52/26/16/1129522616.db2.gz WJAVUZYXYLVFLB-OCCSQVGLSA-N 1 1 291.391 3.522 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc2ncccc12 ZINC001137630522 1131388136 /nfs/dbraw/zinc/38/81/36/1131388136.db2.gz BNKUEZHKCVHSNA-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccc(F)cc1O ZINC000796787586 1129750104 /nfs/dbraw/zinc/75/01/04/1129750104.db2.gz OORDGFCUKNRGHS-FZMZJTMJSA-N 1 1 283.387 3.776 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H](O)CCC(C)C ZINC001169754355 1129754669 /nfs/dbraw/zinc/75/46/69/1129754669.db2.gz LIGMCWXVASDFKG-KRWDZBQOSA-N 1 1 293.451 3.791 20 10 CHCDMO CC[N@@H+](Cc1occc1C)Cc1ccc(N(C)C)cc1 ZINC000768132694 1129834695 /nfs/dbraw/zinc/83/46/95/1129834695.db2.gz ILTYKSFOCZKBKQ-UHFFFAOYSA-N 1 1 272.392 3.676 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H]2CC)c(O)c1 ZINC000768138524 1129836000 /nfs/dbraw/zinc/83/60/00/1129836000.db2.gz NRUPOFBQFSLZQR-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000768169577 1129838306 /nfs/dbraw/zinc/83/83/06/1129838306.db2.gz GVKKWHJQJWOOBM-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCc2sccc2[C@@H]1C ZINC000768208049 1129840343 /nfs/dbraw/zinc/84/03/43/1129840343.db2.gz MDJHGTBKTXLPOG-NSHDSACASA-N 1 1 289.400 3.582 20 10 CHCDMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC000768249427 1129847765 /nfs/dbraw/zinc/84/77/65/1129847765.db2.gz FWEQGCKBQATBEV-UHFFFAOYSA-N 1 1 272.392 3.756 20 10 CHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCSC1 ZINC000768262092 1129849122 /nfs/dbraw/zinc/84/91/22/1129849122.db2.gz GJECRCDWCKRRQL-KRWDZBQOSA-N 1 1 299.439 3.997 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)C1CCCC1 ZINC000768334259 1129851362 /nfs/dbraw/zinc/85/13/62/1129851362.db2.gz CNTZZSPKNFHNMK-UHFFFAOYSA-N 1 1 264.388 3.656 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cccc(OC)c1O ZINC000768334413 1129851383 /nfs/dbraw/zinc/85/13/83/1129851383.db2.gz IRCCGHBSPXXBTP-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000768360663 1129853003 /nfs/dbraw/zinc/85/30/03/1129853003.db2.gz NYOVTVUVJYHAQY-GOSISDBHSA-N 1 1 280.415 3.742 20 10 CHCDMO CC[N@@H+](Cc1cc(OC)c(C)cc1O)[C@H](C)C(C)C ZINC000768439022 1129855996 /nfs/dbraw/zinc/85/59/96/1129855996.db2.gz DGQFLWNFHMAEHF-CYBMUJFWSA-N 1 1 265.397 3.576 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000768417314 1129857702 /nfs/dbraw/zinc/85/77/02/1129857702.db2.gz MWBHRLACPRAUDI-LLVKDONJSA-N 1 1 277.389 3.655 20 10 CHCDMO CC[C@H](C)C[N@@H+](CC)Cc1cc(OC)c(C)cc1O ZINC000768463784 1129859429 /nfs/dbraw/zinc/85/94/29/1129859429.db2.gz MEVIZCVRIMRJFH-LBPRGKRZSA-N 1 1 265.397 3.577 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000768840600 1129877240 /nfs/dbraw/zinc/87/72/40/1129877240.db2.gz AWONTLXUOPKYRL-UHFFFAOYSA-N 1 1 297.398 3.670 20 10 CHCDMO CC1(C)COCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769007632 1129888126 /nfs/dbraw/zinc/88/81/26/1129888126.db2.gz VYFOEGQADBLXFM-UHFFFAOYSA-N 1 1 297.398 3.670 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c(O)c1 ZINC000769102524 1129889057 /nfs/dbraw/zinc/88/90/57/1129889057.db2.gz OLAOKXHOLFKVDL-CJNGLKHVSA-N 1 1 275.392 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000769101751 1129890255 /nfs/dbraw/zinc/89/02/55/1129890255.db2.gz GDGFQFJFZKAEAN-DOTOQJQBSA-N 1 1 258.409 3.517 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCc3ccccc3C2)c(O)c1 ZINC000769334256 1129903110 /nfs/dbraw/zinc/90/31/10/1129903110.db2.gz ZSDXKMAQUWAMMP-UHFFFAOYSA-N 1 1 297.398 3.739 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000769389692 1129906177 /nfs/dbraw/zinc/90/61/77/1129906177.db2.gz NGIRKFWJDGUECV-LLVKDONJSA-N 1 1 277.751 3.628 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769397151 1129909360 /nfs/dbraw/zinc/90/93/60/1129909360.db2.gz AZENXEVFZXSWCZ-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO CC1=CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769446268 1129910375 /nfs/dbraw/zinc/91/03/75/1129910375.db2.gz LQNOBUXXOVVAHD-UHFFFAOYSA-N 1 1 270.420 3.829 20 10 CHCDMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769470967 1129912604 /nfs/dbraw/zinc/91/26/04/1129912604.db2.gz PJASNOMUHAWEBT-HOTGVXAUSA-N 1 1 272.436 3.907 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000769502827 1129914202 /nfs/dbraw/zinc/91/42/02/1129914202.db2.gz ALNNGHYZUMBUGU-IBGZPJMESA-N 1 1 297.398 3.564 20 10 CHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550334 1129916913 /nfs/dbraw/zinc/91/69/13/1129916913.db2.gz RBZKDZDHJWWRNA-IAGOWNOFSA-N 1 1 292.492 3.859 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H](SC)C2)c(O)c1 ZINC000770351675 1129945901 /nfs/dbraw/zinc/94/59/01/1129945901.db2.gz UDOVJFVDOLEOQC-OAHLLOKOSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC3(CC3)C2)c1O ZINC000770674774 1129955087 /nfs/dbraw/zinc/95/50/87/1129955087.db2.gz MHEWUKIZBZNBNS-UHFFFAOYSA-N 1 1 265.784 3.730 20 10 CHCDMO C[C@@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cc1O ZINC000802308805 1129991435 /nfs/dbraw/zinc/99/14/35/1129991435.db2.gz IZIKKYARGBAHAY-JHJVBQTASA-N 1 1 295.398 3.776 20 10 CHCDMO CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000785978262 1130070611 /nfs/dbraw/zinc/07/06/11/1130070611.db2.gz SNTRQCPGVUVARL-ZBFHGGJFSA-N 1 1 259.393 3.816 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)c1 ZINC000785988885 1130073179 /nfs/dbraw/zinc/07/31/79/1130073179.db2.gz QKYXZUDSLDYPNV-UHFFFAOYSA-N 1 1 289.419 3.624 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC[C@@H]2CCCO2)cc1 ZINC000786577871 1130106763 /nfs/dbraw/zinc/10/67/63/1130106763.db2.gz RHJMBKCROBUCGN-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(C)cc2O)C1 ZINC001461933516 1130116577 /nfs/dbraw/zinc/11/65/77/1130116577.db2.gz FLXJLURMWDQBRB-HUUCEWRRSA-N 1 1 279.449 3.807 20 10 CHCDMO Cc1cscc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000786925500 1130122835 /nfs/dbraw/zinc/12/28/35/1130122835.db2.gz IELGCJXSXAKXRN-VIFPVBQESA-N 1 1 283.343 3.891 20 10 CHCDMO 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C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)c1ccc(F)cc1O ZINC000840788472 1132287838 /nfs/dbraw/zinc/28/78/38/1132287838.db2.gz OERVQQFEPPPWOI-FUEDEBDSSA-N 1 1 289.325 3.877 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840911984 1132307708 /nfs/dbraw/zinc/30/77/08/1132307708.db2.gz WQAZUSVIKZJCLE-UHFFFAOYSA-N 1 1 272.392 3.594 20 10 CHCDMO CC[N@@H+](Cc1ccncc1)Cc1c(O)cc(C)cc1Cl ZINC000840946888 1132311972 /nfs/dbraw/zinc/31/19/72/1132311972.db2.gz XGLQBRGLMKBINP-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2c(O)cc(C)cc2Cl)CC1(C)C ZINC000840950728 1132312121 /nfs/dbraw/zinc/31/21/21/1132312121.db2.gz NKXNNASLUYCHRH-HNNXBMFYSA-N 1 1 297.826 3.601 20 10 CHCDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840950630 1132312328 /nfs/dbraw/zinc/31/23/28/1132312328.db2.gz PPSUIORROIFJJA-OAHLLOKOSA-N 1 1 292.492 3.636 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)CC[C@@]1(C)O ZINC001231587454 1132317462 /nfs/dbraw/zinc/31/74/62/1132317462.db2.gz 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251.757 3.805 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCC[C@]1(C)O ZINC001231879575 1132391592 /nfs/dbraw/zinc/39/15/92/1132391592.db2.gz IZCXNJXCKWVHOW-KUHUBIRLSA-N 1 1 299.414 3.528 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(Cl)cc1O ZINC000841761578 1132395556 /nfs/dbraw/zinc/39/55/56/1132395556.db2.gz YNZZWDBLYBOWNS-KOLCDFICSA-N 1 1 271.813 3.592 20 10 CHCDMO C[C@H]([NH2+]CC1CCSCC1)c1ccc(Cl)cc1O ZINC000841763657 1132395573 /nfs/dbraw/zinc/39/55/73/1132395573.db2.gz OFSNZLORYXOSOZ-JTQLQIEISA-N 1 1 285.840 3.839 20 10 CHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232262980 1132445153 /nfs/dbraw/zinc/44/51/53/1132445153.db2.gz YVZQMVUPAJWXFL-NSHDSACASA-N 1 1 269.772 3.516 20 10 CHCDMO Oc1cc(O)c(C[N@H+]2CCC3(C2)CCCCC3)cc1Cl ZINC001232264444 1132444782 /nfs/dbraw/zinc/44/47/82/1132444782.db2.gz HKPVTNMLOYGGRK-UHFFFAOYSA-N 1 1 295.810 3.907 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(O)cc2O)C[C@@H]1C ZINC001232258634 1132444974 /nfs/dbraw/zinc/44/49/74/1132444974.db2.gz BNRWHEIZFDZROZ-MNOVXSKESA-N 1 1 283.799 3.619 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1cc(Cl)c(OC)cc1[O-] ZINC001232269102 1132447224 /nfs/dbraw/zinc/44/72/24/1132447224.db2.gz QPTMCOARTJKRRU-UHFFFAOYSA-N 1 1 271.788 3.675 20 10 CHCDMO CCC(CC)[N@H+](C)Cc1cc(Cl)c(OC)cc1O ZINC001232269102 1132447226 /nfs/dbraw/zinc/44/72/26/1132447226.db2.gz QPTMCOARTJKRRU-UHFFFAOYSA-N 1 1 271.788 3.675 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1cc(Cl)c(OC)cc1O ZINC001232269102 1132447229 /nfs/dbraw/zinc/44/72/29/1132447229.db2.gz QPTMCOARTJKRRU-UHFFFAOYSA-N 1 1 271.788 3.675 20 10 CHCDMO COc1cc(O)c(C[NH+](C(C)C)C(C)C)cc1Cl ZINC001232264581 1132447344 /nfs/dbraw/zinc/44/73/44/1132447344.db2.gz JHJLZDDIXDAILV-UHFFFAOYSA-N 1 1 271.788 3.673 20 10 CHCDMO CC[N@@H+](Cc1nc2ccccc2o1)Cc1ccccc1O ZINC001232558392 1132487928 /nfs/dbraw/zinc/48/79/28/1132487928.db2.gz KJEOTRPGHHFRAZ-UHFFFAOYSA-N 1 1 282.343 3.556 20 10 CHCDMO CCO[C@H]1CCC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110411 1132503545 /nfs/dbraw/zinc/50/35/45/1132503545.db2.gz FMBSCLTUWRSNDU-HNNXBMFYSA-N 1 1 291.435 3.691 20 10 CHCDMO C[N@H+](Cc1cccc(C(C)(C)C)c1O)C[C@@H]1CCCCO1 ZINC001143110511 1132503847 /nfs/dbraw/zinc/50/38/47/1132503847.db2.gz HNJKQACTDZLQHA-HNNXBMFYSA-N 1 1 291.435 3.691 20 10 CHCDMO CCCO[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110598 1132504966 /nfs/dbraw/zinc/50/49/66/1132504966.db2.gz KTQVCCBKXBRFEZ-OAHLLOKOSA-N 1 1 291.435 3.691 20 10 CHCDMO CC[C@@H]([NH2+]CCCCCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000843340761 1132520609 /nfs/dbraw/zinc/52/06/09/1132520609.db2.gz DVHBXYRGIDMFQD-CQSZACIVSA-N 1 1 284.831 3.605 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232838184 1132529264 /nfs/dbraw/zinc/52/92/64/1132529264.db2.gz BDEPODQEZZOFOF-OAHLLOKOSA-N 1 1 276.424 3.613 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCCC[C@@H]2C2CCC2)c1 ZINC000843437338 1132534231 /nfs/dbraw/zinc/53/42/31/1132534231.db2.gz CIINJVYYTJEMEI-MRXNPFEDSA-N 1 1 275.392 3.555 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+]2CCCC23CC3)c1O ZINC001233106859 1132571315 /nfs/dbraw/zinc/57/13/15/1132571315.db2.gz RMXRPVYWOPEKTQ-UHFFFAOYSA-N 1 1 296.208 3.592 20 10 CHCDMO C[N@@H+](CCc1cccnc1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286105 1132594967 /nfs/dbraw/zinc/59/49/67/1132594967.db2.gz FTMYTUSXFPFFID-UHFFFAOYSA-N 1 1 298.430 3.759 20 10 CHCDMO C[N@H+](Cc1cc(C(C)(C)C)ccc1O)CC1CCC1 ZINC001233286547 1132595224 /nfs/dbraw/zinc/59/52/24/1132595224.db2.gz YIRXKKBLCRRNTH-UHFFFAOYSA-N 1 1 261.409 3.922 20 10 CHCDMO C[C@]1(CF)CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233415938 1132619529 /nfs/dbraw/zinc/61/95/29/1132619529.db2.gz PCBVQWCUYDNDDS-CYBMUJFWSA-N 1 1 291.288 3.593 20 10 CHCDMO C[C@]1(CF)CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233415938 1132619533 /nfs/dbraw/zinc/61/95/33/1132619533.db2.gz PCBVQWCUYDNDDS-CYBMUJFWSA-N 1 1 291.288 3.593 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233452014 1132625996 /nfs/dbraw/zinc/62/59/96/1132625996.db2.gz HQAPXPXBCWSYIC-UHFFFAOYSA-N 1 1 273.298 3.785 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233726499 1132670669 /nfs/dbraw/zinc/67/06/69/1132670669.db2.gz FBHHCFZJVBQDNE-JTQLQIEISA-N 1 1 289.297 3.523 20 10 CHCDMO COc1ccc2c[nH+]c(NCc3cccc(C)c3O)cc2c1 ZINC001160769856 1132980597 /nfs/dbraw/zinc/98/05/97/1132980597.db2.gz LRMPPHAMDYBVKH-UHFFFAOYSA-N 1 1 294.354 3.870 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cccc(OC)c1O ZINC001203596508 1133344085 /nfs/dbraw/zinc/34/40/85/1133344085.db2.gz FPNBTCJWWGTBDA-MRXNPFEDSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1ccc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)c(O)c1 ZINC001203629331 1133345850 /nfs/dbraw/zinc/34/58/50/1133345850.db2.gz WOQDGARIUNGGFF-OAHLLOKOSA-N 1 1 289.419 3.803 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)cc1 ZINC001203939951 1133386139 /nfs/dbraw/zinc/38/61/39/1133386139.db2.gz GUSXOEQCQBWSMQ-DLBZAZTESA-N 1 1 296.405 3.805 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)cc1 ZINC001203939951 1133386144 /nfs/dbraw/zinc/38/61/44/1133386144.db2.gz GUSXOEQCQBWSMQ-DLBZAZTESA-N 1 1 296.405 3.805 20 10 CHCDMO C[C@H]1CC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233139 1133422835 /nfs/dbraw/zinc/42/28/35/1133422835.db2.gz ODUYHVPWNMDPMB-ZDUSSCGKSA-N 1 1 254.377 3.500 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1)Cc1ccc(O)cc1O ZINC001204274904 1133426529 /nfs/dbraw/zinc/42/65/29/1133426529.db2.gz JFSWTPKAMZADFA-UHFFFAOYSA-N 1 1 285.387 3.900 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(O)c1 ZINC001204275532 1133426958 /nfs/dbraw/zinc/42/69/58/1133426958.db2.gz VPVAALDJOQZIJO-INIZCTEOSA-N 1 1 287.334 3.574 20 10 CHCDMO FC(F)[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204323044 1133437096 /nfs/dbraw/zinc/43/70/96/1133437096.db2.gz ZPTYACMHSGTLRB-OAHLLOKOSA-N 1 1 294.389 3.764 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204326486 1133438174 /nfs/dbraw/zinc/43/81/74/1133438174.db2.gz IPFZRRJRYXJFJA-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)CC(C)(C)C)c(Cl)c1 ZINC001204374257 1133441737 /nfs/dbraw/zinc/44/17/37/1133441737.db2.gz HAXRIAKOKNHEKQ-UHFFFAOYSA-N 1 1 255.789 3.832 20 10 CHCDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cc(OC)ccc1O ZINC001204690691 1133476730 /nfs/dbraw/zinc/47/67/30/1133476730.db2.gz XKLNVBRAKLMMFC-BBRMVZONSA-N 1 1 277.408 3.801 20 10 CHCDMO CCc1cccc(C[N@H+]2CCOc3ccccc3[C@H]2C)c1O ZINC001204721433 1133478241 /nfs/dbraw/zinc/47/82/41/1133478241.db2.gz MBKYQZJVUFOBFI-CQSZACIVSA-N 1 1 297.398 3.910 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC001204841245 1133491098 /nfs/dbraw/zinc/49/10/98/1133491098.db2.gz RVFOBKSJXUXTME-HNNXBMFYSA-N 1 1 299.418 3.618 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)c1 ZINC001204880676 1133494746 /nfs/dbraw/zinc/49/47/46/1133494746.db2.gz FGRXADFAOURPCU-IAOVAPTHSA-N 1 1 289.419 3.801 20 10 CHCDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001205162412 1133539342 /nfs/dbraw/zinc/53/93/42/1133539342.db2.gz NZHLVHLHKCPICL-OAHLLOKOSA-N 1 1 290.794 3.721 20 10 CHCDMO Nc1ccc(C[N@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC001205171684 1133541097 /nfs/dbraw/zinc/54/10/97/1133541097.db2.gz VSKWNOAEBIZKIY-SFHVURJKSA-N 1 1 266.388 3.996 20 10 CHCDMO CC[N@@H+](Cc1occc1C)Cc1ccc(N(C)C)cc1C ZINC001206321185 1133689099 /nfs/dbraw/zinc/68/90/99/1133689099.db2.gz QCFBETONBPLSIB-UHFFFAOYSA-N 1 1 286.419 3.985 20 10 CHCDMO CCc1ccc(NCc2cc(Cl)cc(OC)c2O)[nH+]c1 ZINC001207281496 1133787412 /nfs/dbraw/zinc/78/74/12/1133787412.db2.gz BFQNZUCGLAMOJV-UHFFFAOYSA-N 1 1 292.766 3.624 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCc1cccc(Cl)c1)CC2 ZINC001207426406 1133801349 /nfs/dbraw/zinc/80/13/49/1133801349.db2.gz WWLMBOHVUHBUQJ-UHFFFAOYSA-N 1 1 287.790 3.646 20 10 CHCDMO CC[N@@H+](CCCc1ccc(OC)cc1)Cc1ccccc1O ZINC001207585113 1133822141 /nfs/dbraw/zinc/82/21/41/1133822141.db2.gz NLHZFVOUTWNIOO-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001207623976 1133832889 /nfs/dbraw/zinc/83/28/89/1133832889.db2.gz ZDSKZOBGWLHRFO-OAHLLOKOSA-N 1 1 285.362 3.569 20 10 CHCDMO C[C@H](CCCC(C)(C)O)CC[N@@H+](C)Cc1ccccc1O ZINC001207677924 1133837708 /nfs/dbraw/zinc/83/77/08/1133837708.db2.gz ADRMTFQDWNLJJL-OAHLLOKOSA-N 1 1 293.451 3.791 20 10 CHCDMO CC1=C[C@@H](C)[C@@H](C[N@@H+](C)Cc2ccccc2O)CC1 ZINC001208179760 1133898788 /nfs/dbraw/zinc/89/87/88/1133898788.db2.gz BZTRLSXBPHQPQB-HUUCEWRRSA-N 1 1 259.393 3.816 20 10 CHCDMO COC(C)(C)CC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001209407638 1134013616 /nfs/dbraw/zinc/01/36/16/1134013616.db2.gz NNNMKZGTLULQDC-UHFFFAOYSA-N 1 1 290.451 3.534 20 10 CHCDMO COC[C@@H]1CCC[N@H+]1Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209516443 1134031881 /nfs/dbraw/zinc/03/18/81/1134031881.db2.gz GSWFOQRMFIGOAW-IBGZPJMESA-N 1 1 298.430 3.705 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001209516118 1134032128 /nfs/dbraw/zinc/03/21/28/1134032128.db2.gz ALABGJOXJXAKKX-INIZCTEOSA-N 1 1 296.414 3.648 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001209516118 1134032133 /nfs/dbraw/zinc/03/21/33/1134032133.db2.gz ALABGJOXJXAKKX-INIZCTEOSA-N 1 1 296.414 3.648 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)[C@@H](C)CO1 ZINC000403825823 1134877455 /nfs/dbraw/zinc/87/74/55/1134877455.db2.gz MLRPVNSDAAPNMU-ZFWWWQNUSA-N 1 1 285.387 3.545 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3ccccc3[C@@H](C)C2)c1O ZINC000404870085 1134949875 /nfs/dbraw/zinc/94/98/75/1134949875.db2.gz XNPXRMZIPKYSSR-AWEZNQCLSA-N 1 1 297.398 3.563 20 10 CHCDMO CCCC[C@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217727792 1134992103 /nfs/dbraw/zinc/99/21/03/1134992103.db2.gz SCKWGDCYDFUGBC-HNNXBMFYSA-N 1 1 296.374 3.717 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000312932538 1135135324 /nfs/dbraw/zinc/13/53/24/1135135324.db2.gz LBIBIQVWQNEZMJ-WCQYABFASA-N 1 1 293.382 3.744 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000312932538 1135135327 /nfs/dbraw/zinc/13/53/27/1135135327.db2.gz LBIBIQVWQNEZMJ-WCQYABFASA-N 1 1 293.382 3.744 20 10 CHCDMO Cc1n[nH]cc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000156785502 261132091 /nfs/dbraw/zinc/13/20/91/261132091.db2.gz DGJFZUQEVMODIK-UHFFFAOYSA-N 1 1 299.418 3.759 20 10 CHCDMO COCc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000184941875 262035109 /nfs/dbraw/zinc/03/51/09/262035109.db2.gz PKGKLHVIOXWYRG-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO C[C@@H]([NH2+]CCCOC1CCCC1)c1ccc(F)cc1O ZINC000185240564 262047864 /nfs/dbraw/zinc/04/78/64/262047864.db2.gz GNSPYVOXYUHSBW-GFCCVEGCSA-N 1 1 281.371 3.531 20 10 CHCDMO C[C@@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(F)cc1O ZINC000185669311 262064663 /nfs/dbraw/zinc/06/46/63/262064663.db2.gz MSKCUZQLBKAWRN-CYBMUJFWSA-N 1 1 295.398 3.515 20 10 CHCDMO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000186561847 262098973 /nfs/dbraw/zinc/09/89/73/262098973.db2.gz KFJHPMDAKGYFKS-GXSJLCMTSA-N 1 1 294.395 3.751 20 10 CHCDMO CCC[N@@H+](Cc1cnc(Cl)s1)Cc1ccccc1O ZINC000079334312 521691599 /nfs/dbraw/zinc/69/15/99/521691599.db2.gz UKCWAHUYVKZLAX-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO CCCCN1CCC([NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000037150531 520578128 /nfs/dbraw/zinc/57/81/28/520578128.db2.gz HVTMTOSDLPAVAR-HNNXBMFYSA-N 1 1 290.451 3.616 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+]Cc2csc(C)n2)cc1 ZINC000040443756 520907907 /nfs/dbraw/zinc/90/79/07/520907907.db2.gz KNPYMGFVVNAUEN-UHFFFAOYSA-N 1 1 289.448 3.588 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000290293420 522964774 /nfs/dbraw/zinc/96/47/74/522964774.db2.gz APQIASJZCRWSBE-OAHLLOKOSA-N 1 1 274.339 3.509 20 10 CHCDMO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062744977 524725402 /nfs/dbraw/zinc/72/54/02/524725402.db2.gz GIWGALUMECGIER-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(F)cc1O ZINC000281109010 525410810 /nfs/dbraw/zinc/41/08/10/525410810.db2.gz LRCVRDUGFOYXHH-UWVGGRQHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1nccs1 ZINC000070942453 525526018 /nfs/dbraw/zinc/52/60/18/525526018.db2.gz WLLZWONKALZTRY-CYBMUJFWSA-N 1 1 287.432 3.594 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCSC1)c1cc(Cl)c(Cl)cc1O ZINC000278631673 525649104 /nfs/dbraw/zinc/64/91/04/525649104.db2.gz HAAVQWVGNYHIBF-HTQZYQBOSA-N 1 1 292.231 3.855 20 10 CHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000290343623 526523676 /nfs/dbraw/zinc/52/36/76/526523676.db2.gz FPEAINRNZQGIHU-MRXNPFEDSA-N 1 1 299.418 3.686 20 10 CHCDMO CCC1CCC([N@@H+](C)Cc2cc(OC)ccc2O)CC1 ZINC000133532270 1125468343 /nfs/dbraw/zinc/46/83/43/1125468343.db2.gz DDOKGGORDAAKHL-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140922145 1120094544 /nfs/dbraw/zinc/09/45/44/1120094544.db2.gz IBPXZYBCCNWQLA-FZMZJTMJSA-N 1 1 284.806 3.586 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140922145 1120094549 /nfs/dbraw/zinc/09/45/49/1120094549.db2.gz IBPXZYBCCNWQLA-FZMZJTMJSA-N 1 1 284.806 3.586 20 10 CHCDMO CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1cc(Cl)ccc1[O-] ZINC000775489397 1122620703 /nfs/dbraw/zinc/62/07/03/1122620703.db2.gz ZBDBDZAWZGFSFL-OAHLLOKOSA-N 1 1 298.858 3.817 20 10 CHCDMO CC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1cc(Cl)ccc1[O-] ZINC000775489397 1122620706 /nfs/dbraw/zinc/62/07/06/1122620706.db2.gz ZBDBDZAWZGFSFL-OAHLLOKOSA-N 1 1 298.858 3.817 20 10 CHCDMO COCC(C)(C)CC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000872104835 1124683910 /nfs/dbraw/zinc/68/39/10/1124683910.db2.gz RDHFZIGOYZIEJM-LLVKDONJSA-N 1 1 285.815 3.759 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1CCC(F)(F)CC1 ZINC000790979671 1131576472 /nfs/dbraw/zinc/57/64/72/1131576472.db2.gz GCDRKCQLPMACOX-UHFFFAOYSA-N 1 1 293.716 3.852 20 10 CHCDMO COCC1(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000842890732 1132472768 /nfs/dbraw/zinc/47/27/68/1132472768.db2.gz KKGJZRGGQACPLT-LLVKDONJSA-N 1 1 283.799 3.513 20 10 CHCDMO C[C@H]1C[C@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957826 1125570411 /nfs/dbraw/zinc/57/04/11/1125570411.db2.gz UZIDCXPKQQTGEZ-STQMWFEESA-N 1 1 255.361 3.776 20 10 CHCDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957805 1125570778 /nfs/dbraw/zinc/57/07/78/1125570778.db2.gz UZIDCXPKQQTGEZ-OLZOCXBDSA-N 1 1 255.361 3.776 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000216351098 1125593436 /nfs/dbraw/zinc/59/34/36/1125593436.db2.gz HAXUMHMQXFSESB-UHFFFAOYSA-N 1 1 274.433 3.836 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886489517 1125680464 /nfs/dbraw/zinc/68/04/64/1125680464.db2.gz KPLRVXBFPZDWMT-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1F ZINC000886495222 1125680024 /nfs/dbraw/zinc/68/00/24/1125680024.db2.gz NQNBLSUKXDTDBO-NSHDSACASA-N 1 1 277.314 3.830 20 10 CHCDMO CO[C@@H](C[NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886508834 1125681102 /nfs/dbraw/zinc/68/11/02/1125681102.db2.gz OEWPTTQFQHSQTN-WBMJQRKESA-N 1 1 289.350 3.570 20 10 CHCDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886526545 1125684561 /nfs/dbraw/zinc/68/45/61/1125684561.db2.gz NQMPQDODLARULH-RKDXNWHRSA-N 1 1 278.327 3.548 20 10 CHCDMO Cc1cccc(F)c1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886532463 1125685487 /nfs/dbraw/zinc/68/54/87/1125685487.db2.gz JNTFBUJDNBBUSA-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO Cc1cccc(F)c1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886532464 1125685726 /nfs/dbraw/zinc/68/57/26/1125685726.db2.gz JNTFBUJDNBBUSA-NSHDSACASA-N 1 1 277.314 3.830 20 10 CHCDMO COc1cc(F)cc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886559930 1125690742 /nfs/dbraw/zinc/69/07/42/1125690742.db2.gz JICMVHNIWXYQRD-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886589997 1125693677 /nfs/dbraw/zinc/69/36/77/1125693677.db2.gz LIYHFOYGFAFUTQ-IUCAKERBSA-N 1 1 279.277 3.913 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1c(O)cccc1F ZINC000886615397 1125697881 /nfs/dbraw/zinc/69/78/81/1125697881.db2.gz FNPTYCMMLFQBSK-LBPRGKRZSA-N 1 1 288.366 3.555 20 10 CHCDMO CC(C)[C@H]1C[C@H](C[NH2+][C@@H](C)c2c(O)cccc2F)CCO1 ZINC000886618946 1125699232 /nfs/dbraw/zinc/69/92/32/1125699232.db2.gz PDOVTXGDVSGKJN-WOSRLPQWSA-N 1 1 295.398 3.633 20 10 CHCDMO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1c(O)cccc1F ZINC000886623484 1125699540 /nfs/dbraw/zinc/69/95/40/1125699540.db2.gz FGTXGRKNNYXREM-SECBINFHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886619002 1125699687 /nfs/dbraw/zinc/69/96/87/1125699687.db2.gz QGUFZULEAZETFH-OLZOCXBDSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCCO1)c1c(O)cccc1F ZINC000886632928 1125701501 /nfs/dbraw/zinc/70/15/01/1125701501.db2.gz JSCBKMUTQRQZAW-UXEPBGEESA-N 1 1 293.382 3.530 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H](C)c2ccco2)c1O ZINC000175605887 1126784424 /nfs/dbraw/zinc/78/44/24/1126784424.db2.gz ZAUQRKYIGAYHND-SNVBAGLBSA-N 1 1 291.322 3.520 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)c2ccco2)c1O ZINC000175605887 1126784426 /nfs/dbraw/zinc/78/44/26/1126784426.db2.gz ZAUQRKYIGAYHND-SNVBAGLBSA-N 1 1 291.322 3.520 20 10 CHCDMO CC[C@H]([NH2+]CC(C)(C)SC)c1ccc(F)cc1O ZINC000796780381 1130931667 /nfs/dbraw/zinc/93/16/67/1130931667.db2.gz IYRDQQGWAVUYMW-LBPRGKRZSA-N 1 1 271.401 3.714 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)c1cccnc1 ZINC000269334554 1127038236 /nfs/dbraw/zinc/03/82/36/1127038236.db2.gz AZZMWZAJASPKRI-HNNXBMFYSA-N 1 1 283.419 3.731 20 10 CHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)cc1 ZINC000271436423 1127081276 /nfs/dbraw/zinc/08/12/76/1127081276.db2.gz BQFCUQXAGVXDIE-SUMWQHHRSA-N 1 1 298.434 3.594 20 10 CHCDMO CS[C@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000798180895 1131028539 /nfs/dbraw/zinc/02/85/39/1131028539.db2.gz DHABVODKIXJAER-BDAKNGLRSA-N 1 1 293.354 3.813 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284016709 1127169931 /nfs/dbraw/zinc/16/99/31/1127169931.db2.gz HXVXPPMESBQCPZ-MJGOQNOKSA-N 1 1 297.398 3.689 20 10 CHCDMO CC[C@H]([NH2+]Cc1cccc(OC)c1)c1ccc(F)cc1O ZINC000285532787 1127235808 /nfs/dbraw/zinc/23/58/08/1127235808.db2.gz FOZOLTYJTVIHKK-INIZCTEOSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccsc1)c1ccc(F)cc1O ZINC000285557204 1127237556 /nfs/dbraw/zinc/23/75/56/1127237556.db2.gz GZKVLUCEYVKKGS-CYBMUJFWSA-N 1 1 265.353 3.834 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(F)ccc1O ZINC000285773600 1127242330 /nfs/dbraw/zinc/24/23/30/1127242330.db2.gz UFBXYZMTMZTAQH-BDAKNGLRSA-N 1 1 296.292 3.616 20 10 CHCDMO CC[C@@H]([NH2+]CC1(CCOC)CCC1)c1ccc(F)cc1O ZINC000286000034 1127252205 /nfs/dbraw/zinc/25/22/05/1127252205.db2.gz IOEUHZIYEUTJFB-OAHLLOKOSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21)c1ccc(F)cc1O ZINC000286153106 1127260961 /nfs/dbraw/zinc/26/09/61/1127260961.db2.gz PMZHGUGCGDVRTH-MPTYRVRUSA-N 1 1 293.382 3.530 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(F)cc1O ZINC000286218296 1127263524 /nfs/dbraw/zinc/26/35/24/1127263524.db2.gz SFJMTPXMACTJIE-GWCFXTLKSA-N 1 1 294.395 3.832 20 10 CHCDMO CC[C@@H]([NH2+]C1CC[NH+](CC)CC1)c1cccc(Cl)c1[O-] ZINC000286973363 1127278244 /nfs/dbraw/zinc/27/82/44/1127278244.db2.gz NXECZOIRXGPBIC-OAHLLOKOSA-N 1 1 296.842 3.571 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc(F)cc1O ZINC000287065891 1127285951 /nfs/dbraw/zinc/28/59/51/1127285951.db2.gz NVLWJXAUCIYTPN-RISCZKNCSA-N 1 1 283.412 3.715 20 10 CHCDMO Cc1cc(C)cc(C[N@@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001308738701 1127452950 /nfs/dbraw/zinc/45/29/50/1127452950.db2.gz BNMIBQNEUCFFSX-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1cc(C)cc(C[N@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001308738701 1127452953 /nfs/dbraw/zinc/45/29/53/1127452953.db2.gz BNMIBQNEUCFFSX-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO CCCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC000761191104 1127516610 /nfs/dbraw/zinc/51/66/10/1127516610.db2.gz NKWPNIMNVZTKIS-UHFFFAOYSA-N 1 1 283.799 3.819 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C2CC2)C2CCCC2)c1O ZINC000761190596 1127517393 /nfs/dbraw/zinc/51/73/93/1127517393.db2.gz DSROCSLMCDVZIP-UHFFFAOYSA-N 1 1 295.810 3.961 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)cc1Cl ZINC001231868436 1127544550 /nfs/dbraw/zinc/54/45/50/1127544550.db2.gz UTBHXSWHKGMAAS-STQMWFEESA-N 1 1 279.811 3.976 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccccn2)cc1 ZINC000298684800 1127729279 /nfs/dbraw/zinc/72/92/79/1127729279.db2.gz UVHAURPWUNTOCF-UHFFFAOYSA-N 1 1 283.419 3.560 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)c(C)s1 ZINC000171937478 1127736012 /nfs/dbraw/zinc/73/60/12/1127736012.db2.gz WXNLGIXMDZQKTN-UHFFFAOYSA-N 1 1 261.390 3.703 20 10 CHCDMO C[C@H](Cc1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062746781 1127774254 /nfs/dbraw/zinc/77/42/54/1127774254.db2.gz FLSSAROSITXHSS-MNOVXSKESA-N 1 1 279.380 3.875 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ncc(C)cc1C)c1ccc(F)cc1O ZINC000926961680 1128207012 /nfs/dbraw/zinc/20/70/12/1128207012.db2.gz WVYYDKSACXPVRQ-OAHLLOKOSA-N 1 1 288.366 3.784 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCS[C@@H](C)C1)c1ccc(F)cc1O ZINC000927029481 1128209713 /nfs/dbraw/zinc/20/97/13/1128209713.db2.gz PJVLWADXOLOQOL-JKOKRWQUSA-N 1 1 283.412 3.856 20 10 CHCDMO CC(C)C[N@@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000914567073 1128211409 /nfs/dbraw/zinc/21/14/09/1128211409.db2.gz XKFYTXMRIUTQGN-UHFFFAOYSA-N 1 1 259.393 3.501 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1c(O)cccc1F ZINC000927062903 1128213282 /nfs/dbraw/zinc/21/32/82/1128213282.db2.gz PXBGRPXHTXZWPU-SMDDNHRTSA-N 1 1 286.350 3.655 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1c(O)cccc1F ZINC000927100883 1128217596 /nfs/dbraw/zinc/21/75/96/1128217596.db2.gz VEYCDXOPPPEORI-VXGBXAGGSA-N 1 1 295.398 3.776 20 10 CHCDMO COC/C(C)=C/C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000929635277 1128280141 /nfs/dbraw/zinc/28/01/41/1128280141.db2.gz IMUKOYSTXTVPMX-RVDMUPIBSA-N 1 1 289.419 3.730 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c1O ZINC000754726805 1128299437 /nfs/dbraw/zinc/29/94/37/1128299437.db2.gz UBUFENZRIUMOPA-WFASDCNBSA-N 1 1 277.408 3.720 20 10 CHCDMO CCCC[N@@H+](C/C=C(/C)COC)Cc1ccccc1O ZINC000930350654 1128315315 /nfs/dbraw/zinc/31/53/15/1128315315.db2.gz ILJFVXHVRNDVCL-GDNBJRDFSA-N 1 1 277.408 3.587 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC000777970802 1128351512 /nfs/dbraw/zinc/35/15/12/1128351512.db2.gz WGQRSYNCWHOPDA-BLLLJJGKSA-N 1 1 273.351 3.725 20 10 CHCDMO COc1cc(C)cc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC000915838550 1128351617 /nfs/dbraw/zinc/35/16/17/1128351617.db2.gz GJEMMTWYMKCEQK-AWEZNQCLSA-N 1 1 297.398 3.829 20 10 CHCDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccccc1O ZINC000780793298 1128451799 /nfs/dbraw/zinc/45/17/99/1128451799.db2.gz LCBADQPOALYTCU-JQWIXIFHSA-N 1 1 273.298 3.555 20 10 CHCDMO C[N@@H+](CCCc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000917455014 1128501056 /nfs/dbraw/zinc/50/10/56/1128501056.db2.gz DOPVJDLEUMJFSL-UHFFFAOYSA-N 1 1 295.426 3.946 20 10 CHCDMO CCc1cccc(C[N@H+]2CCc3ccc(C)cc3C2)c1O ZINC001206585538 1128522280 /nfs/dbraw/zinc/52/22/80/1128522280.db2.gz UTSFVJINBRIVKX-UHFFFAOYSA-N 1 1 281.399 3.821 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@@H]1CCCO1 ZINC000919945650 1128652448 /nfs/dbraw/zinc/65/24/48/1128652448.db2.gz OMHKYUQEUMVQNH-INIZCTEOSA-N 1 1 291.435 3.825 20 10 CHCDMO CCc1cc(C[N@@H+](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000919938859 1128652932 /nfs/dbraw/zinc/65/29/32/1128652932.db2.gz YBBVSKJDYNCKPX-UHFFFAOYSA-N 1 1 261.409 3.846 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000778995443 1128674684 /nfs/dbraw/zinc/67/46/84/1128674684.db2.gz RSTWTODCVHHRPT-ZDUSSCGKSA-N 1 1 253.345 3.512 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000778996447 1128675338 /nfs/dbraw/zinc/67/53/38/1128675338.db2.gz PDGVWIDVKFHXIC-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccccc2O)[C@@H]1c1ccccc1 ZINC000778998905 1128675351 /nfs/dbraw/zinc/67/53/51/1128675351.db2.gz FEKWABHUIMDREI-QGZVFWFLSA-N 1 1 267.372 3.975 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000920484961 1128684151 /nfs/dbraw/zinc/68/41/51/1128684151.db2.gz LLRYEZKHHWJQIX-INIZCTEOSA-N 1 1 259.393 3.501 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)c(F)c1)Cc1cc(F)ccc1O ZINC000779029500 1128689402 /nfs/dbraw/zinc/68/94/02/1128689402.db2.gz HKIAVMFRYLDRFP-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)OC(C)(C)C2)cc1C(C)C ZINC000920865434 1128693941 /nfs/dbraw/zinc/69/39/41/1128693941.db2.gz CAAMDAAENKGJHB-AWEZNQCLSA-N 1 1 291.435 3.823 20 10 CHCDMO CCc1cc(C[N@@H+](CC)CCOC)c(O)c(C(C)(C)C)c1 ZINC000921047228 1128699301 /nfs/dbraw/zinc/69/93/01/1128699301.db2.gz UIECDEYYEBZRTP-UHFFFAOYSA-N 1 1 293.451 3.720 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1ccccc1C ZINC000160160287 1117747191 /nfs/dbraw/zinc/74/71/91/1117747191.db2.gz OZZQUVVRVFTPPS-IBGZPJMESA-N 1 1 299.414 3.646 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000748081656 1117923419 /nfs/dbraw/zinc/92/34/19/1117923419.db2.gz BICAPOFLWQLOFV-CYBMUJFWSA-N 1 1 259.393 3.503 20 10 CHCDMO CC(C)[C@@H]1OCCC[C@H]1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186093412 1117991228 /nfs/dbraw/zinc/99/12/28/1117991228.db2.gz VAFKWDHZGKSFHD-DCGLDWPTSA-N 1 1 295.398 3.633 20 10 CHCDMO CC[N@H+](Cc1ccccc1O)Cc1c(F)cccc1F ZINC000179567771 1128748917 /nfs/dbraw/zinc/74/89/17/1128748917.db2.gz VVNBIZDGDMWOET-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(F)cccc1F ZINC000179567771 1128748920 /nfs/dbraw/zinc/74/89/20/1128748920.db2.gz VVNBIZDGDMWOET-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179646425 1128751972 /nfs/dbraw/zinc/75/19/72/1128751972.db2.gz MJSQBUXBCPQAHC-MAUKXSAKSA-N 1 1 299.414 3.726 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000769497431 1118106117 /nfs/dbraw/zinc/10/61/17/1118106117.db2.gz DOGRWRZGNSYTNB-UKRRQHHQSA-N 1 1 297.851 3.906 20 10 CHCDMO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098299 1118134950 /nfs/dbraw/zinc/13/49/50/1118134950.db2.gz GITHWOWKYGYYHN-ZIAGYGMSSA-N 1 1 291.435 3.607 20 10 CHCDMO 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Nc1[nH+]cccc1Nc1cccc2c1C(=O)c1ccccc1-2 ZINC001212406316 1120069551 /nfs/dbraw/zinc/06/95/51/1120069551.db2.gz ZGDGJPIWBKALFJ-UHFFFAOYSA-N 1 1 287.322 3.619 20 10 CHCDMO COc1ccc(O)c([C@H](C)Nc2cccc(C3CC3)[nH+]2)c1 ZINC000293512469 1120109160 /nfs/dbraw/zinc/10/91/60/1120109160.db2.gz AFVWCHXCBCAHJM-NSHDSACASA-N 1 1 284.359 3.846 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3sccc3[C@@H]2C)c1O ZINC000271018992 1120226177 /nfs/dbraw/zinc/22/61/77/1120226177.db2.gz AYZAPYHKWGZKDK-NSHDSACASA-N 1 1 289.400 3.582 20 10 CHCDMO CCCC[N@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765954128 1120281391 /nfs/dbraw/zinc/28/13/91/1120281391.db2.gz WGOIZKZYILUYKJ-INIZCTEOSA-N 1 1 291.483 3.525 20 10 CHCDMO CCCC[N@@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765954128 1120281393 /nfs/dbraw/zinc/28/13/93/1120281393.db2.gz WGOIZKZYILUYKJ-INIZCTEOSA-N 1 1 291.483 3.525 20 10 CHCDMO COC[C@H]1CCCC[N@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103382 1120346449 /nfs/dbraw/zinc/34/64/49/1120346449.db2.gz BJKREWIWTWYPDU-OAHLLOKOSA-N 1 1 291.435 3.691 20 10 CHCDMO C[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccc(F)cc1O ZINC000185633711 1120380605 /nfs/dbraw/zinc/38/06/05/1120380605.db2.gz SJXQKBCCMAWVJE-SNVBAGLBSA-N 1 1 295.304 3.703 20 10 CHCDMO C[C@@H]1CSCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000192180412 1120535594 /nfs/dbraw/zinc/53/55/94/1120535594.db2.gz LUKWZUZNSUDZMF-ZDUSSCGKSA-N 1 1 287.428 3.730 20 10 CHCDMO C[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)c1ccc(F)cc1O ZINC000756732481 1120772062 /nfs/dbraw/zinc/77/20/62/1120772062.db2.gz ICYZBOKJEUKVLV-QEORTHHSSA-N 1 1 285.362 3.813 20 10 CHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCOC1 ZINC000093839873 1120887288 /nfs/dbraw/zinc/88/72/88/1120887288.db2.gz WMEBTUYZOWJATP-HNNXBMFYSA-N 1 1 297.398 3.528 20 10 CHCDMO CCCC[N@@H+](Cc1nccs1)Cc1ccccc1O ZINC000282523038 1121201619 /nfs/dbraw/zinc/20/16/19/1121201619.db2.gz UCIMARYUIQEPAU-UHFFFAOYSA-N 1 1 276.405 3.651 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc(F)cc1O ZINC000702548626 1121204626 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CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CC1(C)C ZINC001178978230 1121831012 /nfs/dbraw/zinc/83/10/12/1121831012.db2.gz VJOYCEYETPACBJ-DGCLKSJQSA-N 1 1 269.335 3.585 20 10 CHCDMO CC(C)[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000182942732 1129012765 /nfs/dbraw/zinc/01/27/65/1129012765.db2.gz VVNSKAQWRNGBRT-UHFFFAOYSA-N 1 1 285.387 3.811 20 10 CHCDMO CSC[C@H]1CCC[N@H+]1Cc1c(O)cc(C)cc1Cl ZINC001179854988 1121916880 /nfs/dbraw/zinc/91/68/80/1121916880.db2.gz LXIJXIZAKLBOJG-LLVKDONJSA-N 1 1 285.840 3.681 20 10 CHCDMO CC[C@H]1CCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001179863578 1121920740 /nfs/dbraw/zinc/92/07/40/1121920740.db2.gz PMPSOVFHVQGDGL-WRLNGNIRSA-N 1 1 258.409 3.640 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](CCCO)CC(C)(C)C)cc1Cl ZINC001180006634 1121936393 /nfs/dbraw/zinc/93/63/93/1121936393.db2.gz HKYOSYUIIPHOPY-UHFFFAOYSA-N 1 1 299.842 3.585 20 10 CHCDMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001180030806 1121938713 /nfs/dbraw/zinc/93/87/13/1121938713.db2.gz PXPDJNDDNWTKFV-GMNBZTITSA-N 1 1 272.436 3.888 20 10 CHCDMO Cc1ncc(C[N@H+](C)Cc2cc(C(C)C)ccc2O)s1 ZINC001180042561 1121942615 /nfs/dbraw/zinc/94/26/15/1121942615.db2.gz DMZMPGFYUPEBRF-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO Cc1cc[nH+]c(N[C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000815601289 1121967712 /nfs/dbraw/zinc/96/77/12/1121967712.db2.gz SAKZPNLZIOOXCZ-CYBMUJFWSA-N 1 1 256.349 3.886 20 10 CHCDMO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC001180372358 1121984392 /nfs/dbraw/zinc/98/43/92/1121984392.db2.gz REQUYZSBQWWCQJ-LLVKDONJSA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC001180372358 1121984398 /nfs/dbraw/zinc/98/43/98/1121984398.db2.gz REQUYZSBQWWCQJ-LLVKDONJSA-N 1 1 271.763 3.949 20 10 CHCDMO CCCCOCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613764 1122001446 /nfs/dbraw/zinc/00/14/46/1122001446.db2.gz KSPNADHIWWXPTI-UHFFFAOYSA-N 1 1 291.435 3.954 20 10 CHCDMO COc1ccc([C@@H](C)[N@H+](C)Cc2cccc(F)c2O)cc1 ZINC000272239079 1122195879 /nfs/dbraw/zinc/19/58/79/1122195879.db2.gz GENWMSYOCRPPKR-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cccc(F)c2O)cc1 ZINC000272239079 1122195881 /nfs/dbraw/zinc/19/58/81/1122195881.db2.gz GENWMSYOCRPPKR-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO COCC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000273407494 1122231479 /nfs/dbraw/zinc/23/14/79/1122231479.db2.gz HJXGRWPGWAKHCE-RISCZKNCSA-N 1 1 293.338 3.553 20 10 CHCDMO CCOc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000273422123 1122232385 /nfs/dbraw/zinc/23/23/85/1122232385.db2.gz SMEZBBDFWIHVLE-GFCCVEGCSA-N 1 1 289.350 3.781 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC001183874566 1122243354 /nfs/dbraw/zinc/24/33/54/1122243354.db2.gz AUTZHWLLXYRKKW-OAHLLOKOSA-N 1 1 293.288 3.587 20 10 CHCDMO CCCC[C@@H](C)[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183918659 1122248406 /nfs/dbraw/zinc/24/84/06/1122248406.db2.gz BETWXKUEOLOTSF-NEPJUHHUSA-N 1 1 253.361 3.836 20 10 CHCDMO CC1(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCC1 ZINC000774819881 1122317962 /nfs/dbraw/zinc/31/79/62/1122317962.db2.gz APXHJSVRUCMRMU-INIZCTEOSA-N 1 1 289.419 3.563 20 10 CHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000775169451 1122466797 /nfs/dbraw/zinc/46/67/97/1122466797.db2.gz XHKATVZWLQJOIB-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO CC[C@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1ccccc1O ZINC000775512379 1122634609 /nfs/dbraw/zinc/63/46/09/1122634609.db2.gz KGPGMBUSNYIIPN-AWEZNQCLSA-N 1 1 295.386 3.818 20 10 CHCDMO C[N@@H+](Cc1ccc(F)c(Cl)c1)Cc1cc(F)ccc1O ZINC000763624530 1129070834 /nfs/dbraw/zinc/07/08/34/1129070834.db2.gz XPIOELIVGGVXKA-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1cccc(C)c1O ZINC000775638873 1122845550 /nfs/dbraw/zinc/84/55/50/1122845550.db2.gz OPCYWXVUYFIOFZ-UHFFFAOYSA-N 1 1 255.361 3.723 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000775643125 1122851302 /nfs/dbraw/zinc/85/13/02/1122851302.db2.gz UBTKZLFAPJMSDM-UHFFFAOYSA-N 1 1 285.387 3.595 20 10 CHCDMO COc1ccc(O)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1 ZINC000775645702 1122853026 /nfs/dbraw/zinc/85/30/26/1122853026.db2.gz FSOHEDZHXPRHBV-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3sccc3[C@H]2C)c1O ZINC000775646014 1122856202 /nfs/dbraw/zinc/85/62/02/1122856202.db2.gz FEAHBRNYLAOVHG-GFCCVEGCSA-N 1 1 273.401 3.881 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+](C)[C@H](C)C2CC2)c1O ZINC000775649395 1122863292 /nfs/dbraw/zinc/86/32/92/1122863292.db2.gz KCYZGWFDSHEGKM-SNVBAGLBSA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cccc(C[N@@H+](C)CCCOc2ccccc2)c1O ZINC000775654622 1122868605 /nfs/dbraw/zinc/86/86/05/1122868605.db2.gz MYMQWQDOPCGVNT-UHFFFAOYSA-N 1 1 285.387 3.602 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)CCC2CC2)c1O ZINC000775740335 1122930236 /nfs/dbraw/zinc/93/02/36/1122930236.db2.gz VBIVKDNXOPKPGJ-UHFFFAOYSA-N 1 1 253.773 3.586 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000160202342 1122945365 /nfs/dbraw/zinc/94/53/65/1122945365.db2.gz RVJDREZTZXEXRJ-WFASDCNBSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000160202342 1122945368 /nfs/dbraw/zinc/94/53/68/1122945368.db2.gz RVJDREZTZXEXRJ-WFASDCNBSA-N 1 1 263.356 3.686 20 10 CHCDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccccc1O ZINC000776014049 1123035175 /nfs/dbraw/zinc/03/51/75/1123035175.db2.gz QGVSAHASFPGBQN-CMPLNLGQSA-N 1 1 273.298 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CCCc2ccccc2)cc1 ZINC001201672684 1123133930 /nfs/dbraw/zinc/13/39/30/1123133930.db2.gz VLXPGJPXCNDCNA-UHFFFAOYSA-N 1 1 282.431 3.817 20 10 CHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@H+](CC2CCCC2)C1 ZINC001202167391 1123180455 /nfs/dbraw/zinc/18/04/55/1123180455.db2.gz XIRGMMQFUMVYCG-UHFFFAOYSA-N 1 1 298.430 3.735 20 10 CHCDMO CCN(C)c1ccc(Cn2cc[nH+]c2C(C)C)cc1 ZINC000779777901 1129108390 /nfs/dbraw/zinc/10/83/90/1129108390.db2.gz WAODMBSJKBVGKO-UHFFFAOYSA-N 1 1 257.381 3.511 20 10 CHCDMO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(Cl)cc1O ZINC000850483130 1123274151 /nfs/dbraw/zinc/27/41/51/1123274151.db2.gz ULSRSWJZDWCYCV-NWDGAFQWSA-N 1 1 290.794 3.895 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)ccc1O ZINC000850511995 1123278990 /nfs/dbraw/zinc/27/89/90/1123278990.db2.gz SUAQUMIXMYOSGL-BDAKNGLRSA-N 1 1 282.796 3.914 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(Cl)cc1O ZINC000850571698 1123295220 /nfs/dbraw/zinc/29/52/20/1123295220.db2.gz UBUUVTHZKOGOFD-MNOVXSKESA-N 1 1 283.799 3.511 20 10 CHCDMO COc1ccc(O)c([C@H](C)[NH2+]CC(F)(F)C(C)(C)C)c1 ZINC000850573004 1123295580 /nfs/dbraw/zinc/29/55/80/1123295580.db2.gz SCDQVNFCBIFISO-JTQLQIEISA-N 1 1 287.350 3.733 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H]1CCO[C@H](C)C1 ZINC000852017806 1123392882 /nfs/dbraw/zinc/39/28/82/1123392882.db2.gz GKIATWIRYVNJEF-GDBMZVCRSA-N 1 1 277.408 3.562 20 10 CHCDMO C[N@@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1O ZINC000111234999 1123432484 /nfs/dbraw/zinc/43/24/84/1123432484.db2.gz NWLKRQCGJMVUCJ-UHFFFAOYSA-N 1 1 293.313 3.626 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@H](CCF)C2)c1 ZINC000853564094 1123443939 /nfs/dbraw/zinc/44/39/39/1123443939.db2.gz JNWNAPCDIWICGD-AWEZNQCLSA-N 1 1 265.372 3.581 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCO[C@H](CC)C1 ZINC000780758816 1123544239 /nfs/dbraw/zinc/54/42/39/1123544239.db2.gz WTEZANFHGIOTLU-NVXWUHKLSA-N 1 1 291.435 3.809 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC(C)(C)C2)c1O ZINC000228630645 1123634220 /nfs/dbraw/zinc/63/42/20/1123634220.db2.gz GEPNCHFVFXQWAG-UHFFFAOYSA-N 1 1 283.799 3.676 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc2ccccc2c1O ZINC000194990389 1129140337 /nfs/dbraw/zinc/14/03/37/1129140337.db2.gz JVNWZBGSDUMWSJ-HUUCEWRRSA-N 1 1 298.430 3.538 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC000862210694 1123791838 /nfs/dbraw/zinc/79/18/38/1123791838.db2.gz SYDLVRFCAOJCDE-UHFFFAOYSA-N 1 1 293.414 3.866 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccnc(F)c1C ZINC000862236322 1123794615 /nfs/dbraw/zinc/79/46/15/1123794615.db2.gz AEMCIKBNNWSMTO-UHFFFAOYSA-N 1 1 288.366 3.647 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC3(CCC3)C[C@H]2C)c1O ZINC000763645405 1129149880 /nfs/dbraw/zinc/14/98/80/1129149880.db2.gz FNDXQHQNTCHVNH-CYBMUJFWSA-N 1 1 275.392 3.555 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc2ccncc21)[C@H]1CCC(C)(C)C1 ZINC000794686837 1123927545 /nfs/dbraw/zinc/92/75/45/1123927545.db2.gz RYLLLQPBGPOWLJ-AWEZNQCLSA-N 1 1 284.403 3.951 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1C ZINC000865822497 1124018094 /nfs/dbraw/zinc/01/80/94/1124018094.db2.gz IGPUXHTXBPHWOF-INIZCTEOSA-N 1 1 291.341 3.943 20 10 CHCDMO CC[C@@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(F)cc1O ZINC000866405181 1124063760 /nfs/dbraw/zinc/06/37/60/1124063760.db2.gz YODSXFDJFHWYIH-BXUZGUMPSA-N 1 1 283.412 3.715 20 10 CHCDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc(N)cc1 ZINC001120370823 1131274446 /nfs/dbraw/zinc/27/44/46/1131274446.db2.gz GOGFBAGOKGDEHO-KDOFPFPSSA-N 1 1 266.388 3.647 20 10 CHCDMO C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000124296560 1124732338 /nfs/dbraw/zinc/73/23/38/1124732338.db2.gz HDRIOQCMHDMENF-OAHLLOKOSA-N 1 1 258.409 3.661 20 10 CHCDMO CSC(C)(C)CC[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000820851909 1131307237 /nfs/dbraw/zinc/30/72/37/1131307237.db2.gz VAFDQMXDONNZLO-UHFFFAOYSA-N 1 1 280.481 3.716 20 10 CHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)s1 ZINC000020146154 1124808326 /nfs/dbraw/zinc/80/83/26/1124808326.db2.gz GCPYYEDNMZAPRB-NSHDSACASA-N 1 1 289.448 3.677 20 10 CHCDMO Cc1ccncc1C[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825748501 1124853165 /nfs/dbraw/zinc/85/31/65/1124853165.db2.gz CUDYMMXKDQCZME-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000876684691 1124971185 /nfs/dbraw/zinc/97/11/85/1124971185.db2.gz RDIODIMEKFUUQT-IBGZPJMESA-N 1 1 297.398 3.664 20 10 CHCDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc(O)c2)c(O)c1 ZINC000876721614 1124972678 /nfs/dbraw/zinc/97/26/78/1124972678.db2.gz WFFBULQXLAPAKV-CYBMUJFWSA-N 1 1 271.360 3.599 20 10 CHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(Cl)c(C)cc1O ZINC000825903337 1124979426 /nfs/dbraw/zinc/97/94/26/1124979426.db2.gz DQOGFHJQALJQOX-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO C[N@@H+](CC[C@@H]1CCCC1(F)F)Cc1ccccc1O ZINC000878241046 1125134200 /nfs/dbraw/zinc/13/42/00/1125134200.db2.gz AAEDBQKJNDKFFI-ZDUSSCGKSA-N 1 1 269.335 3.650 20 10 CHCDMO CC(C)Oc1ccccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001137139597 1125190256 /nfs/dbraw/zinc/19/02/56/1125190256.db2.gz KGYQVFVPBULVGA-UHFFFAOYSA-N 1 1 297.398 3.738 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)C2CCC(C)(C)CC2)c1 ZINC000211642877 1125313400 /nfs/dbraw/zinc/31/34/00/1125313400.db2.gz JRMGXFAKRUYIQQ-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1c(O)cccc1Cl ZINC000211658847 1125314999 /nfs/dbraw/zinc/31/49/99/1125314999.db2.gz QNONFJSMKQDRCY-ZDUSSCGKSA-N 1 1 253.773 3.666 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCc2ccccc21 ZINC000882878922 1125359865 /nfs/dbraw/zinc/35/98/65/1125359865.db2.gz YUEUCAJJBGWMSJ-INIZCTEOSA-N 1 1 289.325 3.838 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1cccc(OCC)c1O ZINC000213582932 1125363658 /nfs/dbraw/zinc/36/36/58/1125363658.db2.gz BQLZWGSWSCWTML-HNNXBMFYSA-N 1 1 277.408 3.946 20 10 CHCDMO Cc1cc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)ccc1F ZINC000883031956 1125369161 /nfs/dbraw/zinc/36/91/61/1125369161.db2.gz QWKIWQVUAKITJU-SNVBAGLBSA-N 1 1 295.304 3.969 20 10 CHCDMO CN(C)c1ccc(CNc2cccc3cc[nH+]cc32)cc1 ZINC000131441584 1125392278 /nfs/dbraw/zinc/39/22/78/1125392278.db2.gz MUYOUIFJFINLMG-UHFFFAOYSA-N 1 1 277.371 3.913 20 10 CHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)C1CCCCC1 ZINC000131769170 1125409527 /nfs/dbraw/zinc/40/95/27/1125409527.db2.gz ZRSHIBYOWQIWCM-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000132824637 1125424024 /nfs/dbraw/zinc/42/40/24/1125424024.db2.gz PHYZMHXRTLVOIG-INIZCTEOSA-N 1 1 275.392 3.555 20 10 CHCDMO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2)ccc1N(C)C ZINC001139669947 1131357245 /nfs/dbraw/zinc/35/72/45/1131357245.db2.gz QYRFLKAETWTYAV-UHFFFAOYSA-N 1 1 286.394 3.832 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000245865023 1129230317 /nfs/dbraw/zinc/23/03/17/1129230317.db2.gz PSEQHFQVZRPVKW-DVOMOZLQSA-N 1 1 275.392 3.554 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1F ZINC000184910059 1129261622 /nfs/dbraw/zinc/26/16/22/1129261622.db2.gz DITAKPUTIJXCMS-NSHDSACASA-N 1 1 277.314 3.830 20 10 CHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000091024765 1129341948 /nfs/dbraw/zinc/34/19/48/1129341948.db2.gz CNJPWWXIWILKIW-CQSZACIVSA-N 1 1 267.438 3.582 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1OCC1CC1 ZINC000091974542 1129376159 /nfs/dbraw/zinc/37/61/59/1129376159.db2.gz RHHYURQFVRKYMK-UHFFFAOYSA-N 1 1 297.398 3.813 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)Cc1cccnc1C ZINC000092705055 1129405044 /nfs/dbraw/zinc/40/50/44/1129405044.db2.gz JEIJFMLGKNLYPX-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC=C(c3ccco3)C2)c1 ZINC000795650995 1129406990 /nfs/dbraw/zinc/40/69/90/1129406990.db2.gz PLCYTOZMWPYPKB-UHFFFAOYSA-N 1 1 283.371 3.891 20 10 CHCDMO Cn1cccc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000093319360 1129421329 /nfs/dbraw/zinc/42/13/29/1129421329.db2.gz ALXLBNHOSORZRJ-UHFFFAOYSA-N 1 1 284.403 3.676 20 10 CHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1cccc(OC)c1O ZINC000093530208 1129425631 /nfs/dbraw/zinc/42/56/31/1129425631.db2.gz FLAVMZWKMGAGKA-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc(OC)cc2)cc1 ZINC000741753348 1129451191 /nfs/dbraw/zinc/45/11/91/1129451191.db2.gz VJLIXCZUOLUMOD-UHFFFAOYSA-N 1 1 298.430 3.783 20 10 CHCDMO CC[N@@H+](Cc1cc2c(cc1O)CCC2)[C@@H](C)C(C)C ZINC000742557295 1129487336 /nfs/dbraw/zinc/48/73/36/1129487336.db2.gz UPCQQBLSKSRVCK-ZDUSSCGKSA-N 1 1 261.409 3.747 20 10 CHCDMO Cc1cc(NCc2ccc(N3CCCCC3)cc2)nc(C)[nH+]1 ZINC000742569008 1129489329 /nfs/dbraw/zinc/48/93/29/1129489329.db2.gz HXFOWSJUVZLSPE-UHFFFAOYSA-N 1 1 296.418 3.696 20 10 CHCDMO CCC[N@@H+](Cc1cncn1C(C)C)Cc1ccccc1O ZINC000822443511 1131378597 /nfs/dbraw/zinc/37/85/97/1131378597.db2.gz WEGVTFXEKPKMEV-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO C[N@@H+](CCc1cccs1)Cc1c(O)ccc2ccncc21 ZINC000743384619 1129522354 /nfs/dbraw/zinc/52/23/54/1129522354.db2.gz SJVXIRBVKAPJOL-UHFFFAOYSA-N 1 1 298.411 3.676 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)S1 ZINC000743376952 1129522589 /nfs/dbraw/zinc/52/25/89/1129522589.db2.gz WKDGFBZJVFWRFP-BETUJISGSA-N 1 1 287.428 3.871 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000743839122 1129538864 /nfs/dbraw/zinc/53/88/64/1129538864.db2.gz FIZHZXDBCFCFLL-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)CC1CCC1 ZINC000743839315 1129538909 /nfs/dbraw/zinc/53/89/09/1129538909.db2.gz CSFRNRPGIBESGK-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(Cl)cc1F)CC2 ZINC001137661247 1131382949 /nfs/dbraw/zinc/38/29/49/1131382949.db2.gz KYVNWLDWPKGIBP-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(Cl)cc1F)CC2 ZINC001137661247 1131382957 /nfs/dbraw/zinc/38/29/57/1131382957.db2.gz KYVNWLDWPKGIBP-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc(N(C)C)cc1 ZINC000766606191 1129702536 /nfs/dbraw/zinc/70/25/36/1129702536.db2.gz WAXPHDDYYNBECK-LBPRGKRZSA-N 1 1 290.357 3.882 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1c(F)cncc1F ZINC000796525709 1129772635 /nfs/dbraw/zinc/77/26/35/1129772635.db2.gz FNWNXCVBDGZJJR-MRVPVSSYSA-N 1 1 298.720 3.570 20 10 CHCDMO CC/C=C\CC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000767325817 1129786632 /nfs/dbraw/zinc/78/66/32/1129786632.db2.gz XYCLZMNLCPGVFO-CWIOURORSA-N 1 1 289.419 3.730 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000380743043 1129832577 /nfs/dbraw/zinc/83/25/77/1129832577.db2.gz ULFUALDIZOPRGY-STQMWFEESA-N 1 1 255.361 3.776 20 10 CHCDMO CC(C)[C@H](C)[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768137144 1129835157 /nfs/dbraw/zinc/83/51/57/1129835157.db2.gz GQUWFNUBPORBRV-AWEZNQCLSA-N 1 1 260.425 3.762 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c(O)c1 ZINC000768196497 1129842704 /nfs/dbraw/zinc/84/27/04/1129842704.db2.gz 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CCO[C@@H]1CC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209520048 1134033808 /nfs/dbraw/zinc/03/38/08/1134033808.db2.gz MAMNEKYCMWUNLF-LJQANCHMSA-N 1 1 298.430 3.705 20 10 CHCDMO CC[C@H](C)[C@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217695258 1134988366 /nfs/dbraw/zinc/98/83/66/1134988366.db2.gz QNRMUKQUNQZXRQ-WFASDCNBSA-N 1 1 296.374 3.573 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@H](C)C(C)C)c1O ZINC000037328777 173129854 /nfs/dbraw/zinc/12/98/54/173129854.db2.gz FRCWCTLFZFMMQM-SNVBAGLBSA-N 1 1 283.799 3.725 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@H](C)C(C)C)c1O ZINC000037328777 173129855 /nfs/dbraw/zinc/12/98/55/173129855.db2.gz FRCWCTLFZFMMQM-SNVBAGLBSA-N 1 1 283.799 3.725 20 10 CHCDMO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186157571 262083045 /nfs/dbraw/zinc/08/30/45/262083045.db2.gz YJLOKVHBYATIMS-ZJUUUORDSA-N 1 1 292.354 3.590 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC000289886294 263112831 /nfs/dbraw/zinc/11/28/31/263112831.db2.gz 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/nfs/dbraw/zinc/33/66/20/521336620.db2.gz ZYHLAVHMXWZAQZ-MRXNPFEDSA-N 1 1 298.386 3.523 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2ccncc2)c1O ZINC000289982850 521340491 /nfs/dbraw/zinc/34/04/91/521340491.db2.gz ZYHLAVHMXWZAQZ-INIZCTEOSA-N 1 1 298.386 3.523 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000278392074 522182502 /nfs/dbraw/zinc/18/25/02/522182502.db2.gz MXLZRJLDPPCMEX-CYBMUJFWSA-N 1 1 286.341 3.527 20 10 CHCDMO CC[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000285899785 522830964 /nfs/dbraw/zinc/83/09/64/522830964.db2.gz BHCVFBZYYQBWLO-GDBMZVCRSA-N 1 1 295.398 3.921 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000366545598 525339708 /nfs/dbraw/zinc/33/97/08/525339708.db2.gz QQMLQBRAFCULIQ-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(F)cc1O ZINC000273462324 525650890 /nfs/dbraw/zinc/65/08/90/525650890.db2.gz CZPWHMVYGDVTQG-MEBBXXQBSA-N 1 1 287.334 3.575 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC2(CCC2)CC1 ZINC001181610054 1122066247 /nfs/dbraw/zinc/06/62/47/1122066247.db2.gz DYBWELGDLVGRPC-UHFFFAOYSA-N 1 1 283.774 3.951 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000272249111 1122195997 /nfs/dbraw/zinc/19/59/97/1122195997.db2.gz HWMKTRGLSYPKHE-CQSZACIVSA-N 1 1 259.374 3.791 20 10 CHCDMO C[N@@H+](CCc1cccs1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775724234 1122925233 /nfs/dbraw/zinc/92/52/33/1122925233.db2.gz KRLBZURGBDFMSP-UHFFFAOYSA-N 1 1 299.798 3.921 20 10 CHCDMO C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000896953251 1123792177 /nfs/dbraw/zinc/79/21/77/1123792177.db2.gz WPVAJXQCFYQCHA-WPRPVWTQSA-N 1 1 289.803 3.558 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CCCS1)c1cc(F)cc(F)c1O ZINC000866479949 1124070974 /nfs/dbraw/zinc/07/09/74/1124070974.db2.gz BCVZVCTXHDEXPG-MWLCHTKSSA-N 1 1 287.375 3.607 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825214933 1131501838 /nfs/dbraw/zinc/50/18/38/1131501838.db2.gz BFBPCGLVCMWBSN-OAHLLOKOSA-N 1 1 297.851 3.765 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846108785 1131686920 /nfs/dbraw/zinc/68/69/20/1131686920.db2.gz QFDLWPDAFZWOMA-CYBMUJFWSA-N 1 1 287.737 3.667 20 10 CHCDMO CC[C@@H]([NH2+]C1CC2(CCC2)C1)c1ccc(F)cc1O ZINC000846215104 1131699980 /nfs/dbraw/zinc/69/99/80/1131699980.db2.gz XMOLGERNRJDVQK-CQSZACIVSA-N 1 1 263.356 3.905 20 10 CHCDMO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(F)cc1O ZINC000834909235 1131730355 /nfs/dbraw/zinc/73/03/55/1131730355.db2.gz PRKAUAOPZOWRSA-VIFPVBQESA-N 1 1 273.298 3.617 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCCC3(CCC3)C2)c(O)c1 ZINC001231850892 1132378555 /nfs/dbraw/zinc/37/85/55/1132378555.db2.gz VZTNXHQOIKEUGH-UHFFFAOYSA-N 1 1 259.393 3.775 20 10 CHCDMO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(Cl)cc1O ZINC000841758331 1132394555 /nfs/dbraw/zinc/39/45/55/1132394555.db2.gz LDBHMYCGPAPWDQ-YGRLFVJLSA-N 1 1 285.840 3.982 20 10 CHCDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1O)C(C)(C)C ZINC001233454524 1132624403 /nfs/dbraw/zinc/62/44/03/1132624403.db2.gz XUSRSXCKMGNYQS-UHFFFAOYSA-N 1 1 261.287 3.641 20 10 CHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000282917400 1125556548 /nfs/dbraw/zinc/55/65/48/1125556548.db2.gz DVNJSGASJPVSSG-CQSZACIVSA-N 1 1 299.336 3.947 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(Cl)cc1O ZINC000841758080 1125598389 /nfs/dbraw/zinc/59/83/89/1125598389.db2.gz KKOXPUUMSHHISB-NWDGAFQWSA-N 1 1 290.794 3.722 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(Cl)ccc1O ZINC000136819737 1125647875 /nfs/dbraw/zinc/64/78/75/1125647875.db2.gz ANPCJPKVEYGTCG-GXFFZTMASA-N 1 1 253.773 3.809 20 10 CHCDMO Cc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccc1F ZINC000886495162 1125680186 /nfs/dbraw/zinc/68/01/86/1125680186.db2.gz KPHJTAJGDQTPEX-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886507683 1125681594 /nfs/dbraw/zinc/68/15/94/1125681594.db2.gz VDCIQRXAMHRSAW-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO COCc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886505082 1125681732 /nfs/dbraw/zinc/68/17/32/1125681732.db2.gz JIGVUESOETUWFX-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886519379 1125682421 /nfs/dbraw/zinc/68/24/21/1125682421.db2.gz UHBKCAAUWDXFQB-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO CC(C)OC1CCC([NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886555027 1125690049 /nfs/dbraw/zinc/69/00/49/1125690049.db2.gz JBHSQKWSHHKEIT-IYXRBSQSSA-N 1 1 295.398 3.918 20 10 CHCDMO CCOCCC1(C[NH2+][C@@H](C)c2c(O)cccc2F)CCC1 ZINC000886551281 1125690106 /nfs/dbraw/zinc/69/01/06/1125690106.db2.gz FTUHDHLTRSYWAY-ZDUSSCGKSA-N 1 1 295.398 3.779 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1c(O)cccc1F ZINC000886590094 1125694545 /nfs/dbraw/zinc/69/45/45/1125694545.db2.gz NTPONJUCHPPKBD-CHWSQXEVSA-N 1 1 281.371 3.531 20 10 CHCDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886594326 1125695177 /nfs/dbraw/zinc/69/51/77/1125695177.db2.gz JZUGCMWWXDJEKS-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1c(O)cccc1F ZINC000886590095 1125695796 /nfs/dbraw/zinc/69/57/96/1125695796.db2.gz NTPONJUCHPPKBD-OLZOCXBDSA-N 1 1 281.371 3.531 20 10 CHCDMO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)c2c(O)cccc2F)CCO1 ZINC000886618947 1125699488 /nfs/dbraw/zinc/69/94/88/1125699488.db2.gz PDOVTXGDVSGKJN-XEZPLFJOSA-N 1 1 295.398 3.633 20 10 CHCDMO C[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCCO1)c1c(O)cccc1F ZINC000886632926 1125700740 /nfs/dbraw/zinc/70/07/40/1125700740.db2.gz JSCBKMUTQRQZAW-CXMBCZLWSA-N 1 1 293.382 3.530 20 10 CHCDMO C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1c(O)cccc1F ZINC000886638125 1125701315 /nfs/dbraw/zinc/70/13/15/1125701315.db2.gz MMNAIRZLBIBAMI-ZANVPECISA-N 1 1 273.298 3.617 20 10 CHCDMO COCCCC[N@@H+](Cc1ccccc1)Cc1ccccc1O ZINC000179563633 1126829726 /nfs/dbraw/zinc/82/97/26/1126829726.db2.gz UDYOBWSBOYXJPD-UHFFFAOYSA-N 1 1 299.414 3.821 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccncc1 ZINC000185540983 1126900723 /nfs/dbraw/zinc/90/07/23/1126900723.db2.gz 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GIGPMQYDGODALJ-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO COc1cccc(C[N@@H+](C)CC2(c3ccccc3)CC2)c1O ZINC000188716955 1120462699 /nfs/dbraw/zinc/46/26/99/1120462699.db2.gz AHKKUSVETKALGL-UHFFFAOYSA-N 1 1 297.398 3.564 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccc(F)cc1O ZINC000857082337 1120628705 /nfs/dbraw/zinc/62/87/05/1120628705.db2.gz MUBCFYKZHMIDPT-BDAKNGLRSA-N 1 1 292.181 3.766 20 10 CHCDMO Cc1cc(C[NH2+][C@@H](C)c2ncc[nH]2)c(C)n1-c1ccccc1 ZINC000317427160 1121010382 /nfs/dbraw/zinc/01/03/82/1121010382.db2.gz JVLHYMFDAGPCAB-AWEZNQCLSA-N 1 1 294.402 3.668 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001137832766 1121198396 /nfs/dbraw/zinc/19/83/96/1121198396.db2.gz HAKXBRQANNJBNQ-UHFFFAOYSA-N 1 1 285.309 3.543 20 10 CHCDMO [O-]c1cccc(F)c1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001137838539 1121417194 /nfs/dbraw/zinc/41/71/94/1121417194.db2.gz CLHWRBXNUYQWMZ-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001137838539 1121417196 /nfs/dbraw/zinc/41/71/96/1121417196.db2.gz CLHWRBXNUYQWMZ-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001137838539 1121417198 /nfs/dbraw/zinc/41/71/98/1121417198.db2.gz CLHWRBXNUYQWMZ-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO CCC[N@@H+](CCc1ccc(OC)cc1)Cc1ccccc1O ZINC000727831358 1121749751 /nfs/dbraw/zinc/74/97/51/1121749751.db2.gz XMOWLWCANHIBSY-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232706 1121828684 /nfs/dbraw/zinc/82/86/84/1121828684.db2.gz IVIMJUAQMROBND-HIFRSBDPSA-N 1 1 286.394 3.838 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)c2ccncc2)cc1 ZINC000773805692 1121859181 /nfs/dbraw/zinc/85/91/81/1121859181.db2.gz FVXGYWIJLGUSEX-HNNXBMFYSA-N 1 1 283.419 3.731 20 10 CHCDMO CCCC[N@@H+](CCOC)Cc1c(O)ccc2ccccc21 ZINC000731661237 1121877724 /nfs/dbraw/zinc/87/77/24/1121877724.db2.gz UVYGKVBEGNPRAC-UHFFFAOYSA-N 1 1 287.403 3.794 20 10 CHCDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000732183403 1121911083 /nfs/dbraw/zinc/91/10/83/1121911083.db2.gz PBKWQDMWWGGIDE-GFCCVEGCSA-N 1 1 279.424 3.873 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)C[C@H]2C)c(Cl)c1 ZINC001179898777 1121918718 /nfs/dbraw/zinc/91/87/18/1121918718.db2.gz UIQUZOGPDXCUSL-WDEREUQCSA-N 1 1 253.773 3.584 20 10 CHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001180108869 1121952848 /nfs/dbraw/zinc/95/28/48/1121952848.db2.gz ZFFRYYZBDDHBAN-YPDHSMTDSA-N 1 1 258.409 3.639 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC001180317492 1121973882 /nfs/dbraw/zinc/97/38/82/1121973882.db2.gz GZHLBNIXTDVKPR-MRXNPFEDSA-N 1 1 274.452 3.929 20 10 CHCDMO CC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC001180372359 1121985483 /nfs/dbraw/zinc/98/54/83/1121985483.db2.gz REQUYZSBQWWCQJ-NSHDSACASA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC001180372359 1121985489 /nfs/dbraw/zinc/98/54/89/1121985489.db2.gz REQUYZSBQWWCQJ-NSHDSACASA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180372569 1121985818 /nfs/dbraw/zinc/98/58/18/1121985818.db2.gz VCGBPWKIDGIYSU-ZDUSSCGKSA-N 1 1 282.378 3.795 20 10 CHCDMO CCCC[N@H+](CC)Cc1c(O)ccc(Cl)c1F ZINC001180438462 1121986528 /nfs/dbraw/zinc/98/65/28/1121986528.db2.gz ZYILOPUFPLLADG-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO CCCC[N@@H+](CC)Cc1c(O)ccc(Cl)c1F ZINC001180438462 1121986534 /nfs/dbraw/zinc/98/65/34/1121986534.db2.gz ZYILOPUFPLLADG-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(N)cc2)s1 ZINC001120263182 1122005346 /nfs/dbraw/zinc/00/53/46/1122005346.db2.gz LMCVIQYCFDRSCH-NSHDSACASA-N 1 1 275.421 3.535 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(Cl)cc1O ZINC001181543955 1122061964 /nfs/dbraw/zinc/06/19/64/1122061964.db2.gz IYRNOBWGQURMGT-ZWNOBZJWSA-N 1 1 253.773 3.809 20 10 CHCDMO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1O ZINC001182874925 1122192224 /nfs/dbraw/zinc/19/22/24/1122192224.db2.gz VOWAEUKUELEYNE-JTQLQIEISA-N 1 1 255.789 3.960 20 10 CHCDMO COCC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000273407493 1122231255 /nfs/dbraw/zinc/23/12/55/1122231255.db2.gz HJXGRWPGWAKHCE-FZMZJTMJSA-N 1 1 293.338 3.553 20 10 CHCDMO COCC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000273407495 1122231752 /nfs/dbraw/zinc/23/17/52/1122231752.db2.gz HJXGRWPGWAKHCE-SMDDNHRTSA-N 1 1 293.338 3.553 20 10 CHCDMO Cc1cc(Cl)ccc1C[NH2+]Cc1c(O)cccc1F ZINC001183919749 1122248099 /nfs/dbraw/zinc/24/80/99/1122248099.db2.gz ORVVMJYKUURUMB-UHFFFAOYSA-N 1 1 279.742 3.783 20 10 CHCDMO C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc2ccccc2c1[O-] ZINC000192925437 1129047478 /nfs/dbraw/zinc/04/74/78/1129047478.db2.gz DDYARYXWQDJSPB-HNNXBMFYSA-N 1 1 298.430 3.682 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775134034 1122435239 /nfs/dbraw/zinc/43/52/39/1122435239.db2.gz ANWDCQTWCIPZCN-VIFPVBQESA-N 1 1 293.716 3.820 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775134033 1122435259 /nfs/dbraw/zinc/43/52/59/1122435259.db2.gz ANWDCQTWCIPZCN-SECBINFHSA-N 1 1 293.716 3.820 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)Cc2ccccc2C)c1 ZINC000775203716 1122478407 /nfs/dbraw/zinc/47/84/07/1122478407.db2.gz HISZMSHDAKRCFY-HNNXBMFYSA-N 1 1 299.414 3.772 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@@H](CC(C)C)C2)ccc1N(C)C ZINC001191344728 1122592261 /nfs/dbraw/zinc/59/22/61/1122592261.db2.gz ZYGPTYIMNLCNNF-KRWDZBQOSA-N 1 1 274.452 3.929 20 10 CHCDMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000080271804 1129080032 /nfs/dbraw/zinc/08/00/32/1129080032.db2.gz GUZGBVKJYWZCGU-ZJUUUORDSA-N 1 1 280.368 3.708 20 10 CHCDMO Cc1cccc(OCC[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000775645769 1122853150 /nfs/dbraw/zinc/85/31/50/1122853150.db2.gz ABOGBIKXYZYWLU-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](Cc2cccs2)C(C)C)c1 ZINC000775650927 1122865882 /nfs/dbraw/zinc/86/58/82/1122865882.db2.gz IHUIMJLNUKVSNO-UHFFFAOYSA-N 1 1 291.416 3.873 20 10 CHCDMO CC[N@@H+](CCc1cccs1)Cc1cccc(C)c1O ZINC000775656488 1122871431 /nfs/dbraw/zinc/87/14/31/1122871431.db2.gz HMXYEDOIVRMAAA-UHFFFAOYSA-N 1 1 275.417 3.827 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1O ZINC000775680823 1122902149 /nfs/dbraw/zinc/90/21/49/1122902149.db2.gz JRYYJTWXHIDZEH-HNNXBMFYSA-N 1 1 285.362 3.829 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3c(Cl)cccc3C2)c1O ZINC000775689340 1122909164 /nfs/dbraw/zinc/90/91/64/1122909164.db2.gz GZZKFRHCBVRNSU-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO Cc1cc(Br)cc(C[N@@H+]2CC=C(C)CC2)c1O ZINC000775701186 1122912362 /nfs/dbraw/zinc/91/23/62/1122912362.db2.gz DHMWNHGLWLCGAH-UHFFFAOYSA-N 1 1 296.208 3.615 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000775698159 1122912412 /nfs/dbraw/zinc/91/24/12/1122912412.db2.gz KGVBQQCOKPGHFN-GOSISDBHSA-N 1 1 287.403 3.723 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)c1O ZINC000775728879 1122927723 /nfs/dbraw/zinc/92/77/23/1122927723.db2.gz YQNSFZCGPCCJOR-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3c(F)ccc(F)c3C2)c1O ZINC000775728879 1122927725 /nfs/dbraw/zinc/92/77/25/1122927725.db2.gz YQNSFZCGPCCJOR-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000775741601 1122933330 /nfs/dbraw/zinc/93/33/30/1122933330.db2.gz TVWKODAQLJFZRM-RDTXWAMCSA-N 1 1 297.398 3.525 20 10 CHCDMO CCC1(C)CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000160232355 1122947424 /nfs/dbraw/zinc/94/74/24/1122947424.db2.gz HIGZESORWUVLCQ-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccc(N(C)C)cc1 ZINC000775830481 1122984625 /nfs/dbraw/zinc/98/46/25/1122984625.db2.gz KAONJBUKQIHSOM-BKLZJWBFSA-N 1 1 273.207 3.722 20 10 CHCDMO CC[C@@H](C)C[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001201511336 1123113994 /nfs/dbraw/zinc/11/39/94/1123113994.db2.gz JIELUBMRVDDWHH-CYBMUJFWSA-N 1 1 286.419 3.591 20 10 CHCDMO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cscn1 ZINC000850359701 1123256649 /nfs/dbraw/zinc/25/66/49/1123256649.db2.gz OMBCRTUUIRENEU-MUBLQREKSA-N 1 1 287.432 3.573 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1C=CCC1)c1cccc(C(F)(F)F)c1O ZINC000850510695 1123278141 /nfs/dbraw/zinc/27/81/41/1123278141.db2.gz WNLRUCNEZAEXAC-NXEZZACHSA-N 1 1 271.282 3.780 20 10 CHCDMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000109770424 1123326806 /nfs/dbraw/zinc/32/68/06/1123326806.db2.gz CBBUJYCIIPVJLA-INIZCTEOSA-N 1 1 255.361 3.975 20 10 CHCDMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(O)ccc2ccncc21 ZINC000853605921 1123444262 /nfs/dbraw/zinc/44/42/62/1123444262.db2.gz PKLMANGTQIVFNM-LQDVMPOASA-N 1 1 282.387 3.703 20 10 CHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC000840098893 1123460181 /nfs/dbraw/zinc/46/01/81/1123460181.db2.gz FJHANOXPUDDIBA-QGZVFWFLSA-N 1 1 295.398 3.719 20 10 CHCDMO Cc1cccc(N[C@@H](C)c2ccc(N(C)C)cc2)[nH+]1 ZINC000776794768 1123506952 /nfs/dbraw/zinc/50/69/52/1123506952.db2.gz IWUCRMHMFUPQEK-ZDUSSCGKSA-N 1 1 255.365 3.629 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1ccns1 ZINC000858575531 1123663517 /nfs/dbraw/zinc/66/35/17/1123663517.db2.gz AETKFYDQVOSCMV-JGVFFNPUSA-N 1 1 284.331 3.539 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)cc1C(C)C ZINC000863306659 1123859451 /nfs/dbraw/zinc/85/94/51/1123859451.db2.gz OBBIGZPRPXZTPB-FUHWJXTLSA-N 1 1 289.419 3.577 20 10 CHCDMO CCN(CC)c1ccc(CNc2ccc(C)c[nH+]2)cc1 ZINC000083515131 1129150218 /nfs/dbraw/zinc/15/02/18/1129150218.db2.gz CWZDMWQHVVERHO-UHFFFAOYSA-N 1 1 269.392 3.848 20 10 CHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccccn1 ZINC000119482873 1123872969 /nfs/dbraw/zinc/87/29/69/1123872969.db2.gz YNNVPNHQLWVADZ-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccccn1 ZINC000119482873 1123872971 /nfs/dbraw/zinc/87/29/71/1123872971.db2.gz YNNVPNHQLWVADZ-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@H]21 ZINC000783592151 1123995459 /nfs/dbraw/zinc/99/54/59/1123995459.db2.gz DGEMNQLAZUNGGF-BYCMXARLSA-N 1 1 263.356 3.542 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1O ZINC000783593271 1123998070 /nfs/dbraw/zinc/99/80/70/1123998070.db2.gz OVPWXOLRKLXXNO-IMJJTQAJSA-N 1 1 259.393 3.711 20 10 CHCDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000120893496 1124032293 /nfs/dbraw/zinc/03/22/93/1124032293.db2.gz CXQVWGVAMIFEPC-MRXNPFEDSA-N 1 1 299.414 3.792 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CCCS1)c1cc(F)cc(F)c1O ZINC000866479947 1124071158 /nfs/dbraw/zinc/07/11/58/1124071158.db2.gz BCVZVCTXHDEXPG-GXSJLCMTSA-N 1 1 287.375 3.607 20 10 CHCDMO C[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCCO1)c1ccc(F)cc1O ZINC000866491201 1124072771 /nfs/dbraw/zinc/07/27/71/1124072771.db2.gz NKJLSIULAKYXNE-JECHBYEQSA-N 1 1 293.382 3.530 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000872721388 1124726789 /nfs/dbraw/zinc/72/67/89/1124726789.db2.gz FOYCPQFUFMWBLJ-LSDHHAIUSA-N 1 1 299.439 3.730 20 10 CHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)s1 ZINC000020146153 1124808261 /nfs/dbraw/zinc/80/82/61/1124808261.db2.gz GCPYYEDNMZAPRB-LLVKDONJSA-N 1 1 289.448 3.677 20 10 CHCDMO CSCCC[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825768179 1124880009 /nfs/dbraw/zinc/88/00/09/1124880009.db2.gz CMDPVSXUEMQGTC-UHFFFAOYSA-N 1 1 273.829 3.539 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cc(Cl)ccc1O ZINC000125731641 1124921444 /nfs/dbraw/zinc/92/14/44/1124921444.db2.gz PDVJGXSSWCGHPC-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000125830027 1124929929 /nfs/dbraw/zinc/92/99/29/1124929929.db2.gz WIZNVFVNOCZKMX-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC000876683446 1124971069 /nfs/dbraw/zinc/97/10/69/1124971069.db2.gz BSQIVOXCULHBSH-LJQANCHMSA-N 1 1 297.398 3.664 20 10 CHCDMO CC[C@@H]([NH2+]Cc1csc(C)n1)c1ccc(N(C)C)cc1 ZINC000126585989 1125044923 /nfs/dbraw/zinc/04/49/23/1125044923.db2.gz MWPYSIQPIARJJB-MRXNPFEDSA-N 1 1 289.448 3.758 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2cccn2C)cc1C(C)C ZINC000128303707 1125260167 /nfs/dbraw/zinc/26/01/67/1125260167.db2.gz UNJQASXQYSFGJL-UHFFFAOYSA-N 1 1 286.419 3.795 20 10 CHCDMO C[N@H+](Cc1cccc(Br)c1[O-])CC1CCCC1 ZINC000211438268 1125305956 /nfs/dbraw/zinc/30/59/56/1125305956.db2.gz DYBOOSYJDQZDNE-UHFFFAOYSA-N 1 1 298.224 3.777 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)CC1CCCC1 ZINC000211517532 1125307705 /nfs/dbraw/zinc/30/77/05/1125307705.db2.gz PZKCYLRRBXMLAJ-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO C[C@H]1CCCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000211522675 1125309136 /nfs/dbraw/zinc/30/91/36/1125309136.db2.gz UZNANUFAHAQZLK-NSHDSACASA-N 1 1 298.224 3.919 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1cccc(Br)c1O ZINC000211522675 1125309140 /nfs/dbraw/zinc/30/91/40/1125309140.db2.gz UZNANUFAHAQZLK-NSHDSACASA-N 1 1 298.224 3.919 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)C[C@H](C)CC)c1O ZINC000211699655 1125321871 /nfs/dbraw/zinc/32/18/71/1125321871.db2.gz ORVSWKKKBWRQAH-CYBMUJFWSA-N 1 1 265.397 3.659 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCSC1 ZINC000130497877 1125362597 /nfs/dbraw/zinc/36/25/97/1125362597.db2.gz OPEAPTLKVNFOOU-QGZVFWFLSA-N 1 1 290.476 3.614 20 10 CHCDMO CCC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccn1 ZINC000882979039 1125365485 /nfs/dbraw/zinc/36/54/85/1125365485.db2.gz LMFBBQPBCXUKIJ-AWEZNQCLSA-N 1 1 292.329 3.696 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+]C2(c3ncccn3)CCC2)c(O)c1C ZINC000883312274 1125393470 /nfs/dbraw/zinc/39/34/70/1125393470.db2.gz YRHXWELURJTBJU-CQSZACIVSA-N 1 1 297.402 3.529 20 10 CHCDMO CC[C@@H]([NH2+]C1CCC2(COC2)CC1)c1ccc(F)cc1O ZINC000883383410 1125407815 /nfs/dbraw/zinc/40/78/15/1125407815.db2.gz YBMLUUACBNDHRH-OAHLLOKOSA-N 1 1 293.382 3.531 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)C2CCCCCC2)c1 ZINC000132356289 1125417812 /nfs/dbraw/zinc/41/78/12/1125417812.db2.gz CYBORROMLAEFRG-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)ccc1N(C)C ZINC001139669863 1131356783 /nfs/dbraw/zinc/35/67/83/1131356783.db2.gz QKLXFEOAUOYKOV-CQSZACIVSA-N 1 1 296.405 3.928 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001237934134 1129219517 /nfs/dbraw/zinc/21/95/17/1129219517.db2.gz HSRQAJZWSPUGHD-MNOVXSKESA-N 1 1 283.774 3.807 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001237934134 1129219523 /nfs/dbraw/zinc/21/95/23/1129219523.db2.gz HSRQAJZWSPUGHD-MNOVXSKESA-N 1 1 283.774 3.807 20 10 CHCDMO C[C@@H]([NH2+]CCCC(C)(F)F)c1ccc(F)cc1O ZINC000297236154 1129224916 /nfs/dbraw/zinc/22/49/16/1129224916.db2.gz ICRIKVXFSZUPQI-SECBINFHSA-N 1 1 261.287 3.617 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1 ZINC000245839685 1129227902 /nfs/dbraw/zinc/22/79/02/1129227902.db2.gz JLWOCYYTUWMFIG-FZKQIMNGSA-N 1 1 283.371 3.594 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1c(C)noc1C)c1ccc(F)cc1O ZINC000796764993 1129330702 /nfs/dbraw/zinc/33/07/02/1129330702.db2.gz WWPNKIIYGXUHEI-XPTSAGLGSA-N 1 1 292.354 3.938 20 10 CHCDMO COCCCC[N@H+](CC(C)C)c1ccc(OC)cc1 ZINC000735490080 1129348066 /nfs/dbraw/zinc/34/80/66/1129348066.db2.gz CLVQJPQAHHSZRC-UHFFFAOYSA-N 1 1 265.397 3.584 20 10 CHCDMO COCCCC[N@@H+](CC(C)C)c1ccc(OC)cc1 ZINC000735490080 1129348070 /nfs/dbraw/zinc/34/80/70/1129348070.db2.gz CLVQJPQAHHSZRC-UHFFFAOYSA-N 1 1 265.397 3.584 20 10 CHCDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056772 1129389547 /nfs/dbraw/zinc/38/95/47/1129389547.db2.gz QCDCZOYKQCPWRK-TZMCWYRMSA-N 1 1 291.391 3.522 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCSC[C@H]2C)cc1C(C)C ZINC000738284018 1129392322 /nfs/dbraw/zinc/39/23/22/1129392322.db2.gz IMKKLVQPILPYGC-CYBMUJFWSA-N 1 1 279.449 3.761 20 10 CHCDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132210 1129417861 /nfs/dbraw/zinc/41/78/61/1129417861.db2.gz DDCVSRMFIRZMLL-QWHCGFSZSA-N 1 1 277.408 3.800 20 10 CHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)CC1 ZINC000093317054 1129421373 /nfs/dbraw/zinc/42/13/73/1129421373.db2.gz NYMKFXDBXHUROR-QGZVFWFLSA-N 1 1 291.435 3.790 20 10 CHCDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)n1 ZINC000093444902 1129423457 /nfs/dbraw/zinc/42/34/57/1129423457.db2.gz VUHCAJOUOMSILH-IBGZPJMESA-N 1 1 295.430 3.793 20 10 CHCDMO CCSCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000741785546 1129452996 /nfs/dbraw/zinc/45/29/96/1129452996.db2.gz RJUCOBPZVHXVMY-UHFFFAOYSA-N 1 1 279.449 3.890 20 10 CHCDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000742154177 1129468445 /nfs/dbraw/zinc/46/84/45/1129468445.db2.gz FBUNGRJJXAUDBA-UONOGXRCSA-N 1 1 284.403 3.951 20 10 CHCDMO COc1ccc([N@H+](CC(C)C)CC2CCC(=O)CC2)cc1 ZINC000828206062 1131379116 /nfs/dbraw/zinc/37/91/16/1131379116.db2.gz OUCSAKHSGAKBCD-UHFFFAOYSA-N 1 1 289.419 3.917 20 10 CHCDMO COc1ccc([N@@H+](CC(C)C)CC2CCC(=O)CC2)cc1 ZINC000828206062 1131379123 /nfs/dbraw/zinc/37/91/23/1131379123.db2.gz OUCSAKHSGAKBCD-UHFFFAOYSA-N 1 1 289.419 3.917 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000743396699 1129521727 /nfs/dbraw/zinc/52/17/27/1129521727.db2.gz BSKVFQFTCWYBHO-CQSZACIVSA-N 1 1 287.428 3.873 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCSC)cc1 ZINC000743839316 1129538794 /nfs/dbraw/zinc/53/87/94/1129538794.db2.gz CUFSKRARBUYYQJ-UHFFFAOYSA-N 1 1 280.481 3.718 20 10 CHCDMO CCC[N@@H+](Cc1cccc(N(C)C)c1)Cc1ccccc1O ZINC000743870297 1129542148 /nfs/dbraw/zinc/54/21/48/1129542148.db2.gz PADPOCBTNSCQRL-UHFFFAOYSA-N 1 1 298.430 3.870 20 10 CHCDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444602 1129577487 /nfs/dbraw/zinc/57/74/87/1129577487.db2.gz XQCDMCCTQKBEOF-BLLLJJGKSA-N 1 1 259.393 3.501 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)c1O ZINC000252841181 1129598984 /nfs/dbraw/zinc/59/89/84/1129598984.db2.gz DBHQOHCKZFQTJF-WDEREUQCSA-N 1 1 283.799 3.675 20 10 CHCDMO C[C@H]([NH2+]Cc1ccon1)c1ccc(N2CCCCCC2)cc1 ZINC000766418692 1129664551 /nfs/dbraw/zinc/66/45/51/1129664551.db2.gz JIXVFFPVGBKTQG-HNNXBMFYSA-N 1 1 299.418 3.906 20 10 CHCDMO Cc1ccncc1C[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000746449883 1129665351 /nfs/dbraw/zinc/66/53/51/1129665351.db2.gz JNTIEPKXKJXNKG-UHFFFAOYSA-N 1 1 297.446 3.867 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000796490070 1129754698 /nfs/dbraw/zinc/75/46/98/1129754698.db2.gz NQBVGKDMMBIHHI-UHFFFAOYSA-N 1 1 297.679 3.617 20 10 CHCDMO CC/C=C/CC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000767325851 1129786478 /nfs/dbraw/zinc/78/64/78/1129786478.db2.gz XYCLZMNLCPGVFO-REMYHPOOSA-N 1 1 289.419 3.730 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H]2CCCc3ccccc32)c1O ZINC000768193330 1129842260 /nfs/dbraw/zinc/84/22/60/1129842260.db2.gz KOUYEPAHYVFSQL-QGZVFWFLSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000768192861 1129842810 /nfs/dbraw/zinc/84/28/10/1129842810.db2.gz GBYFGFWHZLNCDH-KRWDZBQOSA-N 1 1 297.398 3.910 20 10 CHCDMO Cc1ncccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768258873 1129846709 /nfs/dbraw/zinc/84/67/09/1129846709.db2.gz XYOXURMCIQIZHG-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CCOc1ccc(C[N@@H+](C2CC2)C2CCCC2)c(O)c1 ZINC000768253067 1129846725 /nfs/dbraw/zinc/84/67/25/1129846725.db2.gz YFFLOAOPOREOMK-UHFFFAOYSA-N 1 1 275.392 3.698 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccoc2)C2CC2)cc1 ZINC000768258871 1129846766 /nfs/dbraw/zinc/84/67/66/1129846766.db2.gz XXAIBUWHWZEZPB-UHFFFAOYSA-N 1 1 270.376 3.510 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000768247538 1129846896 /nfs/dbraw/zinc/84/68/96/1129846896.db2.gz BMDKWBCIJKERLH-KRWDZBQOSA-N 1 1 299.439 3.991 20 10 CHCDMO CCC1CCC([N@@H+](C)Cc2c(O)cccc2OC)CC1 ZINC000768263486 1129849279 /nfs/dbraw/zinc/84/92/79/1129849279.db2.gz RWPTVDLKOCRSHG-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC000768353930 1129853891 /nfs/dbraw/zinc/85/38/91/1129853891.db2.gz CKGDMHJSKWMCHR-QGZVFWFLSA-N 1 1 298.386 3.523 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000768364653 1129854509 /nfs/dbraw/zinc/85/45/09/1129854509.db2.gz LWWFOIZRKGQWPU-QGZVFWFLSA-N 1 1 281.399 3.765 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C1CCCC1 ZINC000768425973 1129855865 /nfs/dbraw/zinc/85/58/65/1129855865.db2.gz XOGISUSWKWMILJ-UHFFFAOYSA-N 1 1 260.425 3.906 20 10 CHCDMO COc1cc(C[N@@H+](C)Cc2ccccc2C)c(O)cc1C ZINC000768438345 1129856670 /nfs/dbraw/zinc/85/66/70/1129856670.db2.gz RKXOOOBBSLDSTI-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c(O)cc1C ZINC000768442721 1129857936 /nfs/dbraw/zinc/85/79/36/1129857936.db2.gz ZJYVLOKHWMICPL-SWLSCSKDSA-N 1 1 277.408 3.720 20 10 CHCDMO CC(C)C[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000768532505 1129860730 /nfs/dbraw/zinc/86/07/30/1129860730.db2.gz MAAGROHFMUZBJM-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1Cc1ccccc1O ZINC000768534616 1129861095 /nfs/dbraw/zinc/86/10/95/1129861095.db2.gz GWVMHQPBYSMHBU-LJQANCHMSA-N 1 1 281.399 3.989 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000768848469 1129878379 /nfs/dbraw/zinc/87/83/79/1129878379.db2.gz CDKSJYFAYYXNLN-NUEKZKHPSA-N 1 1 289.419 3.801 20 10 CHCDMO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000768930788 1129882558 /nfs/dbraw/zinc/88/25/58/1129882558.db2.gz PKDYKUPFTBTIKI-OAHLLOKOSA-N 1 1 296.414 3.708 20 10 CHCDMO CCCC1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137837469 1131421417 /nfs/dbraw/zinc/42/14/17/1131421417.db2.gz IANZXLHDXOVYHS-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO COc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2ccccc2)c1O ZINC000769085595 1129890752 /nfs/dbraw/zinc/89/07/52/1129890752.db2.gz KPHJHUZPIPNBNV-GOSISDBHSA-N 1 1 297.398 3.984 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000769234906 1129897265 /nfs/dbraw/zinc/89/72/65/1129897265.db2.gz YSBXMZNBCFHIEU-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(O)c1 ZINC000769349706 1129903428 /nfs/dbraw/zinc/90/34/28/1129903428.db2.gz DIAISQYTJXGGGL-AWEZNQCLSA-N 1 1 297.398 3.910 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000769341200 1129903908 /nfs/dbraw/zinc/90/39/08/1129903908.db2.gz ZQLIKAGXWRPYGN-QGZVFWFLSA-N 1 1 298.405 3.881 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000769353882 1129904379 /nfs/dbraw/zinc/90/43/79/1129904379.db2.gz VZBBOHDHIFZTFV-AWEZNQCLSA-N 1 1 297.398 3.910 20 10 CHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2c(O)cccc2OC)C1 ZINC000769403202 1129905932 /nfs/dbraw/zinc/90/59/32/1129905932.db2.gz GLVDMUUSJUVJIJ-CYBMUJFWSA-N 1 1 295.448 3.508 20 10 CHCDMO CCOc1ccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c(O)c1 ZINC000769403306 1129906760 /nfs/dbraw/zinc/90/67/60/1129906760.db2.gz BUHGTQJVKLJULG-JKIFEVAISA-N 1 1 289.419 3.944 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC000769431559 1129908241 /nfs/dbraw/zinc/90/82/41/1129908241.db2.gz BPSSNUPOTQQBEH-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCc2cccc(F)c2C1 ZINC000769431559 1129908242 /nfs/dbraw/zinc/90/82/42/1129908242.db2.gz BPSSNUPOTQQBEH-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H]2Cc2ccccc2)c1 ZINC000769505692 1129914689 /nfs/dbraw/zinc/91/46/89/1129914689.db2.gz HMZIWMPEPWRLOW-QGZVFWFLSA-N 1 1 297.398 3.608 20 10 CHCDMO CCCC[N@@H+](Cc1cccc(C)n1)Cc1ccccc1O ZINC000801596763 1129931702 /nfs/dbraw/zinc/93/17/02/1129931702.db2.gz NSUVWKPHFMTSIE-UHFFFAOYSA-N 1 1 284.403 3.898 20 10 CHCDMO C[C@@H]([N@@H+](C)Cc1ccc(N(C)C)c(F)c1)C1(C)CC1 ZINC000770288238 1129943409 /nfs/dbraw/zinc/94/34/09/1129943409.db2.gz ICIWAIMEELLQOH-GFCCVEGCSA-N 1 1 264.388 3.512 20 10 CHCDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccccc2O)C1 ZINC000770511071 1129948907 /nfs/dbraw/zinc/94/89/07/1129948907.db2.gz YNEAYWPJKHTKAJ-HNNXBMFYSA-N 1 1 267.372 3.690 20 10 CHCDMO CCOc1ccc(O)c(CNc2cccc3cc[nH+]cc32)c1 ZINC000770571568 1129951202 /nfs/dbraw/zinc/95/12/02/1129951202.db2.gz QBZWVHXPWJKZPV-UHFFFAOYSA-N 1 1 294.354 3.951 20 10 CHCDMO C[C@H](CC(F)(F)F)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886591714 1129973850 /nfs/dbraw/zinc/97/38/50/1129973850.db2.gz ABWWWRCCVCAPCX-HTQZYQBOSA-N 1 1 265.250 3.523 20 10 CHCDMO 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/nfs/dbraw/zinc/16/46/71/1131164671.db2.gz NSYJLQIHBFLGFJ-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1cccc2c1C[N@@H+](Cc1cc(F)cc(C)c1O)C2 ZINC001238058414 1131165394 /nfs/dbraw/zinc/16/53/94/1131165394.db2.gz RTIMNIDCQPHNEY-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCc3c(F)cccc3C2)c1O ZINC001238065764 1131166424 /nfs/dbraw/zinc/16/64/24/1131166424.db2.gz AOOXBSDJJBNJQK-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1cc(F)cc(C)c1O ZINC001238066702 1131167158 /nfs/dbraw/zinc/16/71/58/1131167158.db2.gz JDPJYLHXZQXVSZ-UHFFFAOYSA-N 1 1 279.380 3.923 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1O ZINC001238062394 1131167207 /nfs/dbraw/zinc/16/72/07/1131167207.db2.gz PNONNUMUZBVPTL-CJNGLKHVSA-N 1 1 277.383 3.994 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CC[C@H]2c2ccccc2)c1O ZINC001238071029 1131168055 /nfs/dbraw/zinc/16/80/55/1131168055.db2.gz QYYNJUWFHATRGQ-INIZCTEOSA-N 1 1 271.335 3.787 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cc(Cl)ccc1[O-] ZINC000817959601 1131191545 /nfs/dbraw/zinc/19/15/45/1131191545.db2.gz HOAKMWDMDXAMDH-UGFHNGPFSA-N 1 1 296.842 3.604 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817975768 1131194338 /nfs/dbraw/zinc/19/43/38/1131194338.db2.gz BFEQIFBHISNTGM-RISCZKNCSA-N 1 1 284.831 3.604 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817981491 1131195635 /nfs/dbraw/zinc/19/56/35/1131195635.db2.gz SCWIJEHWQUVKJJ-ZBFHGGJFSA-N 1 1 298.430 3.728 20 10 CHCDMO CCCCC1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137832940 1131420299 /nfs/dbraw/zinc/42/02/99/1131420299.db2.gz MVPHRDBZMFOJHY-UHFFFAOYSA-N 1 1 265.372 3.934 20 10 CHCDMO C[N@H+](CCc1cccc(Cl)c1)Cc1c(O)cccc1F ZINC001137839036 1131421657 /nfs/dbraw/zinc/42/16/57/1131421657.db2.gz OVNRYFPTGHWUMS-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO C[N@@H+](CCc1cccc(Cl)c1)Cc1c(O)cccc1F ZINC001137839036 1131421660 /nfs/dbraw/zinc/42/16/60/1131421660.db2.gz OVNRYFPTGHWUMS-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO Cc1cccc(CC[N@@H+](C)Cc2c(O)cccc2F)c1 ZINC001137839237 1131421738 /nfs/dbraw/zinc/42/17/38/1131421738.db2.gz XUHXXZAGMCZQIB-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO Cc1cccc(CC[N@H+](C)Cc2c(O)cccc2F)c1 ZINC001137839237 1131421739 /nfs/dbraw/zinc/42/17/39/1131421739.db2.gz XUHXXZAGMCZQIB-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO COC[C@H]1CC[N@@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854419 1131424223 /nfs/dbraw/zinc/42/42/23/1131424223.db2.gz VNOKKPSVIVPMQO-KRWDZBQOSA-N 1 1 298.430 3.562 20 10 CHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)s1 ZINC000772877247 1131444497 /nfs/dbraw/zinc/44/44/97/1131444497.db2.gz XKQSSAIBUNTXFF-JTQLQIEISA-N 1 1 288.416 3.546 20 10 CHCDMO FC[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219528 1131478679 /nfs/dbraw/zinc/47/86/79/1131478679.db2.gz FSJZHPXIRRBIDM-QGZVFWFLSA-N 1 1 290.426 3.858 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1O ZINC000824714726 1131481081 /nfs/dbraw/zinc/48/10/81/1131481081.db2.gz FGGQWGCJNZODJY-DGCLKSJQSA-N 1 1 287.325 3.863 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCCC[C@@](C)(F)C3)ccc21 ZINC001138354671 1131493622 /nfs/dbraw/zinc/49/36/22/1131493622.db2.gz POFCKUFIKLUOQS-GOSISDBHSA-N 1 1 290.426 3.783 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCC[C@@H]4CCC[C@H]43)ccc21 ZINC001138355738 1131494222 /nfs/dbraw/zinc/49/42/22/1131494222.db2.gz BDCPTXRWNAKFBF-QFBILLFUSA-N 1 1 284.447 3.834 20 10 CHCDMO CCc1cccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001144326540 1131618221 /nfs/dbraw/zinc/61/82/21/1131618221.db2.gz FARNUCSEFZGBQR-UHFFFAOYSA-N 1 1 282.431 3.947 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@H]3CCC[C@@H]3C2)ccc1N(C)C ZINC001139671507 1131626608 /nfs/dbraw/zinc/62/66/08/1131626608.db2.gz XDKOWSAJNPVEBH-IAGOWNOFSA-N 1 1 272.436 3.683 20 10 CHCDMO COc1ccc2c(c1)CC[N@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140178370 1131673250 /nfs/dbraw/zinc/67/32/50/1131673250.db2.gz JTSUFICBFIGEPO-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1O ZINC001140181657 1131673272 /nfs/dbraw/zinc/67/32/72/1131673272.db2.gz DVILAVAMDADMRB-SFHVURJKSA-N 1 1 297.398 3.583 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CC[C@H]2c2ccccc2)c1O ZINC001140182703 1131674581 /nfs/dbraw/zinc/67/45/81/1131674581.db2.gz XRRJAXYUNGMBDX-KRWDZBQOSA-N 1 1 267.372 3.956 20 10 CHCDMO CC[C@H]([NH2+]C1CC2(CCC2)C1)c1ccc(F)cc1O ZINC000846215103 1131699488 /nfs/dbraw/zinc/69/94/88/1131699488.db2.gz XMOLGERNRJDVQK-AWEZNQCLSA-N 1 1 263.356 3.905 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1OC)c1ccc(F)cc1O ZINC000846199009 1131699500 /nfs/dbraw/zinc/69/95/00/1131699500.db2.gz APRHHMPPMKWNNP-IIAWOOMASA-N 1 1 281.371 3.530 20 10 CHCDMO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)CCO1 ZINC000834884831 1131717666 /nfs/dbraw/zinc/71/76/66/1131717666.db2.gz DAKWALGPNPEMOD-DCGLDWPTSA-N 1 1 295.398 3.633 20 10 CHCDMO CC[C@@H]([NH2+]CCc1ccc(C)cn1)c1ccc(F)cc1O ZINC000834908173 1131730589 /nfs/dbraw/zinc/73/05/89/1131730589.db2.gz CJALMBJHUCZDHM-MRXNPFEDSA-N 1 1 288.366 3.518 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001140462205 1131748772 /nfs/dbraw/zinc/74/87/72/1131748772.db2.gz AKDOIHLNVAPKHL-NEPJUHHUSA-N 1 1 265.784 3.668 20 10 CHCDMO C[N@H+](Cc1ccc(Cl)cc1O)Cc1cccc(F)c1F ZINC001140464395 1131751160 /nfs/dbraw/zinc/75/11/60/1131751160.db2.gz OADBITHPTLEDPB-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)cc1O)Cc1cccc(F)c1F ZINC001140464395 1131751167 /nfs/dbraw/zinc/75/11/67/1131751167.db2.gz OADBITHPTLEDPB-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000835024730 1131759886 /nfs/dbraw/zinc/75/98/86/1131759886.db2.gz BVEZSCZGUONWTB-VOTSOKGWSA-N 1 1 296.414 3.603 20 10 CHCDMO C[C@@H](c1ccncc1)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835046970 1131764042 /nfs/dbraw/zinc/76/40/42/1131764042.db2.gz AZQDGUXOEXAWBV-KJPDOMRESA-N 1 1 295.430 3.854 20 10 CHCDMO Cc1ccc(F)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001140592471 1131814908 /nfs/dbraw/zinc/81/49/08/1131814908.db2.gz NCXKNVVQQWBNNH-UHFFFAOYSA-N 1 1 286.394 3.832 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001140617284 1131829443 /nfs/dbraw/zinc/82/94/43/1131829443.db2.gz KKWMGCXRJNIFEU-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3ccc(C)cc3C2)c1 ZINC001140617452 1131829973 /nfs/dbraw/zinc/82/99/73/1131829973.db2.gz ONBWEZMHXPIDPQ-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(C)ccc1O ZINC001140623334 1131833175 /nfs/dbraw/zinc/83/31/75/1131833175.db2.gz NVLIPNVSFDGUTP-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+]2Cc3cccc(Cl)c3C2)c1O ZINC001140748168 1131906288 /nfs/dbraw/zinc/90/62/88/1131906288.db2.gz SXTWNGUXQQATSN-UHFFFAOYSA-N 1 1 289.762 3.575 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2Cc3cccc(Cl)c3C2)c1O ZINC001140748168 1131906294 /nfs/dbraw/zinc/90/62/94/1131906294.db2.gz SXTWNGUXQQATSN-UHFFFAOYSA-N 1 1 289.762 3.575 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1C)Cc1ccccc1O ZINC001140780515 1131914683 /nfs/dbraw/zinc/91/46/83/1131914683.db2.gz DBIQSFPKNKLENQ-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCCC2)c(O)c1 ZINC001140855154 1131947948 /nfs/dbraw/zinc/94/79/48/1131947948.db2.gz PACFJGNLQWZCTO-UHFFFAOYSA-N 1 1 276.424 3.613 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c(Cl)c1 ZINC001140922255 1131964328 /nfs/dbraw/zinc/96/43/28/1131964328.db2.gz LWPQBZGCZCNSSH-HNNXBMFYSA-N 1 1 284.806 3.730 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@](C)(F)C2)c(Cl)c1 ZINC001140922255 1131964335 /nfs/dbraw/zinc/96/43/35/1131964335.db2.gz LWPQBZGCZCNSSH-HNNXBMFYSA-N 1 1 284.806 3.730 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3C)C2)c(O)c1 ZINC001140949819 1131969340 /nfs/dbraw/zinc/96/93/40/1131969340.db2.gz MIMLCPGBCAPLGH-KRWDZBQOSA-N 1 1 297.398 3.662 20 10 CHCDMO Oc1cc2ccccc2cc1CNc1cccn2cc[nH+]c12 ZINC001171404517 1131970386 /nfs/dbraw/zinc/97/03/86/1131970386.db2.gz DTNQXYGGQRWBKC-UHFFFAOYSA-N 1 1 289.338 3.805 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(O)c1 ZINC001140950923 1131971297 /nfs/dbraw/zinc/97/12/97/1131971297.db2.gz PDVVVGONJHUACG-MRXNPFEDSA-N 1 1 253.345 3.648 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001140951122 1131971314 /nfs/dbraw/zinc/97/13/14/1131971314.db2.gz ZOSNWXPCVLPRJK-ZBFHGGJFSA-N 1 1 259.393 3.855 20 10 CHCDMO Cc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c(O)c1 ZINC001140954032 1131971440 /nfs/dbraw/zinc/97/14/40/1131971440.db2.gz JQIPQLIDCWBFRB-MAUKXSAKSA-N 1 1 297.398 3.663 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2C)c1O ZINC000037322574 1132028983 /nfs/dbraw/zinc/02/89/83/1132028983.db2.gz VJVQQHMAHDJXAC-JTQLQIEISA-N 1 1 281.783 3.623 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)c1 ZINC001141159331 1132031393 /nfs/dbraw/zinc/03/13/93/1132031393.db2.gz FDBLPQSCKXJMKL-MRXNPFEDSA-N 1 1 287.334 3.574 20 10 CHCDMO CCc1ccccc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001141228787 1132050318 /nfs/dbraw/zinc/05/03/18/1132050318.db2.gz HRVFIPUYWOHFFM-UHFFFAOYSA-N 1 1 297.398 3.609 20 10 CHCDMO CCc1ccccc1C[N@@H+](CC)Cc1ccccc1O ZINC001141227802 1132050933 /nfs/dbraw/zinc/05/09/33/1132050933.db2.gz KATGUZKZINUKKY-UHFFFAOYSA-N 1 1 269.388 3.977 20 10 CHCDMO CC[C@@H](C)OCC[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349565 1132181322 /nfs/dbraw/zinc/18/13/22/1132181322.db2.gz VKCSJVVPXLNKQT-HZPDHXFCSA-N 1 1 292.467 3.778 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H]1C ZINC000840127119 1132247751 /nfs/dbraw/zinc/24/77/51/1132247751.db2.gz RLPJDUTWEWZWHZ-RDTXWAMCSA-N 1 1 291.435 3.681 20 10 CHCDMO CC[C@H]([NH2+]C1CCC(COC)CC1)c1ccc(F)cc1O ZINC000840875870 1132301081 /nfs/dbraw/zinc/30/10/81/1132301081.db2.gz JZOQVLIOIRBBAT-PXCJXSSVSA-N 1 1 295.398 3.777 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)Cc2ccco2)c(Cl)c1 ZINC000840909287 1132308515 /nfs/dbraw/zinc/30/85/15/1132308515.db2.gz GHXUSCGUQGKVLX-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccco2)c(Cl)c1 ZINC000840909287 1132308522 /nfs/dbraw/zinc/30/85/22/1132308522.db2.gz GHXUSCGUQGKVLX-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1cc(N(C)C)ccc1CNc1ccc2c(c1)[nH+]cn2C ZINC000840937997 1132309493 /nfs/dbraw/zinc/30/94/93/1132309493.db2.gz YUHTVPOJRBXXDW-UHFFFAOYSA-N 1 1 294.402 3.560 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000840936893 1132309510 /nfs/dbraw/zinc/30/95/10/1132309510.db2.gz NNWZHLYSSVZJNS-OAHLLOKOSA-N 1 1 283.419 3.649 20 10 CHCDMO COCC[C@H]1CCCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC001231588120 1132317809 /nfs/dbraw/zinc/31/78/09/1132317809.db2.gz IQJCLAKTGSTGEW-MRXNPFEDSA-N 1 1 299.414 3.936 20 10 CHCDMO C[N@@H+](Cc1ccccn1)Cc1c(O)ccc2ccccc21 ZINC001231588010 1132318585 /nfs/dbraw/zinc/31/85/85/1132318585.db2.gz LIVZCFMRGNRSAS-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC2(CC2)C1 ZINC001231587294 1132319345 /nfs/dbraw/zinc/31/93/45/1132319345.db2.gz TWBGELYLSCYBSP-UHFFFAOYSA-N 1 1 253.345 3.531 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C2(CC2)C1 ZINC001231591251 1132320781 /nfs/dbraw/zinc/32/07/81/1132320781.db2.gz ZOXNHLOJIUJGHI-ZDUSSCGKSA-N 1 1 267.372 3.920 20 10 CHCDMO COc1ccc(C[C@@H](C)C[NH2+]c2ccc(N)cc2)cc1F ZINC000841040163 1132323618 /nfs/dbraw/zinc/32/36/18/1132323618.db2.gz KVJRNNLHGBCLFT-GFCCVEGCSA-N 1 1 288.366 3.707 20 10 CHCDMO C[N@@H+](Cc1ccccc1)CC(C)(C)CNc1ccc(N)cc1 ZINC000841040346 1132323685 /nfs/dbraw/zinc/32/36/85/1132323685.db2.gz PKWBASCSGGVGPN-UHFFFAOYSA-N 1 1 297.446 3.839 20 10 CHCDMO CC[N@H+](Cc1ccccc1O)Cc1ccc(C)nc1Cl ZINC001142143868 1132332444 /nfs/dbraw/zinc/33/24/44/1132332444.db2.gz IUTCXVDVVRJNSI-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccc(C)nc1Cl ZINC001142143868 1132332454 /nfs/dbraw/zinc/33/24/54/1132332454.db2.gz IUTCXVDVVRJNSI-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO CSc1ccccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001231785845 1132361932 /nfs/dbraw/zinc/36/19/32/1132361932.db2.gz JNIJYYIZHPQVGK-UHFFFAOYSA-N 1 1 285.412 3.672 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)c(O)c1 ZINC001231843359 1132375711 /nfs/dbraw/zinc/37/57/11/1132375711.db2.gz WTBVHAVZCHMFMN-AWEZNQCLSA-N 1 1 287.325 3.578 20 10 CHCDMO Cc1cc(C)c(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)c(O)c1 ZINC001231842457 1132376856 /nfs/dbraw/zinc/37/68/56/1132376856.db2.gz MKDSJJPWFXFLNU-ZFWWWQNUSA-N 1 1 261.409 3.877 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001231847348 1132379056 /nfs/dbraw/zinc/37/90/56/1132379056.db2.gz XPZHCDGTSIZMBF-QGZVFWFLSA-N 1 1 296.414 3.611 20 10 CHCDMO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870934 1132383046 /nfs/dbraw/zinc/38/30/46/1132383046.db2.gz WOBUVZUACIRTFA-HNNXBMFYSA-N 1 1 297.826 3.743 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc1Cl ZINC001231867957 1132383290 /nfs/dbraw/zinc/38/32/90/1132383290.db2.gz OKVIBLVHKMLYTP-CABZTGNLSA-N 1 1 271.763 3.534 20 10 CHCDMO COC1CCC(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841749069 1132390329 /nfs/dbraw/zinc/39/03/29/1132390329.db2.gz 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C[N@@H+](Cc1cccc(F)c1)Cc1cc(Cl)c(O)cc1O ZINC001232260429 1132445287 /nfs/dbraw/zinc/44/52/87/1132445287.db2.gz QBBDUSAVZNTRIV-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1ccc(Cl)cc1O ZINC000842930025 1132477448 /nfs/dbraw/zinc/47/74/48/1132477448.db2.gz RONWXWMBIGYYSU-HOTUBEGUSA-N 1 1 271.813 3.590 20 10 CHCDMO CCCCOC1C[NH+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110784 1132503484 /nfs/dbraw/zinc/50/34/84/1132503484.db2.gz OVYSDZSEKCAZDX-UHFFFAOYSA-N 1 1 291.435 3.691 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1O ZINC001143110386 1132503869 /nfs/dbraw/zinc/50/38/69/1132503869.db2.gz FFZXVQRXZIJDIT-KCQAQPDRSA-N 1 1 277.383 3.622 20 10 CHCDMO CC(C)O[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143111386 1132504566 /nfs/dbraw/zinc/50/45/66/1132504566.db2.gz BMEBYMIMDIGOEE-HNNXBMFYSA-N 1 1 291.435 3.689 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2O)Cc2ccccc21 ZINC001232833628 1132528588 /nfs/dbraw/zinc/52/85/88/1132528588.db2.gz 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ZINC001233454401 1132626235 /nfs/dbraw/zinc/62/62/35/1132626235.db2.gz TZAQAICPRZBJIT-UHFFFAOYSA-N 1 1 273.298 3.785 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2C[C@H]2c2ccccc2)cc1 ZINC001204146074 1132952746 /nfs/dbraw/zinc/95/27/46/1132952746.db2.gz RRUOZWZVGDKTRE-QUCCMNQESA-N 1 1 294.442 3.988 20 10 CHCDMO COc1cc2cc[nH+]c(NCc3ccc(N)cc3)c2cc1F ZINC001162789163 1133112214 /nfs/dbraw/zinc/11/22/14/1133112214.db2.gz BEXQBTIWAXCGMJ-UHFFFAOYSA-N 1 1 297.333 3.577 20 10 CHCDMO CC[N@@H+](Cc1cccc(F)c1)Cc1ccccc1O ZINC001203558328 1133340443 /nfs/dbraw/zinc/34/04/43/1133340443.db2.gz FIXYVGNJRROYBV-UHFFFAOYSA-N 1 1 259.324 3.553 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001203558722 1133340770 /nfs/dbraw/zinc/34/07/70/1133340770.db2.gz YKPMCUUIKAJGED-GOSISDBHSA-N 1 1 297.398 3.573 20 10 CHCDMO CCC[N@@H+](Cc1cccc(OCC)c1O)[C@H](C)CC ZINC001203602141 1133343648 /nfs/dbraw/zinc/34/36/48/1133343648.db2.gz DHCNELQVDBIOTL-CYBMUJFWSA-N 1 1 265.397 3.801 20 10 CHCDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(OC)cc1O ZINC001203628996 1133345776 /nfs/dbraw/zinc/34/57/76/1133345776.db2.gz NANWTROLILLUOX-GOSISDBHSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001203630379 1133346775 /nfs/dbraw/zinc/34/67/75/1133346775.db2.gz RFKVANYZUFUVKU-MRXNPFEDSA-N 1 1 297.398 3.780 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001203648338 1133347887 /nfs/dbraw/zinc/34/78/87/1133347887.db2.gz JTYPXPCSKZDDKL-LBPRGKRZSA-N 1 1 293.716 3.615 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001203648335 1133348404 /nfs/dbraw/zinc/34/84/04/1133348404.db2.gz JTYPXPCSKZDDKL-GFCCVEGCSA-N 1 1 293.716 3.615 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1O ZINC001203875558 1133377996 /nfs/dbraw/zinc/37/79/96/1133377996.db2.gz PVTUVOSCZUGPRM-OAHLLOKOSA-N 1 1 287.334 3.574 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(N(CC)CC)cc1 ZINC001203939813 1133386348 /nfs/dbraw/zinc/38/63/48/1133386348.db2.gz VZJOSTLQYSALHZ-MRXNPFEDSA-N 1 1 260.425 3.907 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H](F)C2)cc1 ZINC001203936274 1133386784 /nfs/dbraw/zinc/38/67/84/1133386784.db2.gz LJECGTOZEBJCRJ-INIZCTEOSA-N 1 1 278.415 3.857 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)cc1 ZINC001203943912 1133387075 /nfs/dbraw/zinc/38/70/75/1133387075.db2.gz INLQUTHQQSLJNO-DOTOQJQBSA-N 1 1 258.409 3.517 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](OC(C)C)C2)cc1 ZINC001203941595 1133388905 /nfs/dbraw/zinc/38/89/05/1133388905.db2.gz CLQARDGRHHCTEI-SFHVURJKSA-N 1 1 290.451 3.532 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c2ccccc21 ZINC001204240573 1133424070 /nfs/dbraw/zinc/42/40/70/1133424070.db2.gz YYLYFGNHHDDLEX-KUHUBIRLSA-N 1 1 280.415 3.890 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](F)C2)c2ccccc21 ZINC001204240697 1133424093 /nfs/dbraw/zinc/42/40/93/1133424093.db2.gz BLIKQGIKILTOHC-OAHLLOKOSA-N 1 1 286.394 3.840 20 10 CHCDMO C[N@@H+](Cc1ccc(O)cc1O)Cc1cccc2ccccc21 ZINC001204275600 1133426758 /nfs/dbraw/zinc/42/67/58/1133426758.db2.gz WWNINLBMZWSRLR-UHFFFAOYSA-N 1 1 293.366 3.883 20 10 CHCDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cc(OC)ccc1O ZINC001204690693 1133476403 /nfs/dbraw/zinc/47/64/03/1133476403.db2.gz XKLNVBRAKLMMFC-CZUORRHYSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@H](c1ccccc1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC001205155866 1133538524 /nfs/dbraw/zinc/53/85/24/1133538524.db2.gz GFWTYIBCNFVFFQ-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC001205155866 1133538528 /nfs/dbraw/zinc/53/85/28/1133538528.db2.gz GFWTYIBCNFVFFQ-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO Nc1ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2)cc1 ZINC001205171682 1133540265 /nfs/dbraw/zinc/54/02/65/1133540265.db2.gz VSKWNOAEBIZKIY-GOSISDBHSA-N 1 1 266.388 3.996 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(F)c(F)cc2O)c1C ZINC001205974815 1133637401 /nfs/dbraw/zinc/63/74/01/1133637401.db2.gz SUXFKDZLBLECNZ-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)c(F)cc2O)c1C ZINC001205974815 1133637403 /nfs/dbraw/zinc/63/74/03/1133637403.db2.gz SUXFKDZLBLECNZ-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO C[C@]1(CC[NH2+]Cc2ccc(Cl)cc2O)C[C@@]1(F)Cl ZINC001206516834 1133712908 /nfs/dbraw/zinc/71/29/08/1133712908.db2.gz GAOFKKAJXAZPOZ-STQMWFEESA-N 1 1 292.181 3.840 20 10 CHCDMO CC[N@@H+](CCCc1cccc(OC)c1)Cc1ccccc1O ZINC001207573043 1133820281 /nfs/dbraw/zinc/82/02/81/1133820281.db2.gz QVXFGQWHQFKUQP-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc2ccoc21 ZINC001207621233 1133833273 /nfs/dbraw/zinc/83/32/73/1133833273.db2.gz CHCYYMDUOANWQD-UHFFFAOYSA-N 1 1 271.291 3.567 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CC1CCC=CCC1 ZINC001207638225 1133835371 /nfs/dbraw/zinc/83/53/71/1133835371.db2.gz BLGYFMHPDJTSDS-UHFFFAOYSA-N 1 1 265.784 3.882 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001207707944 1133841086 /nfs/dbraw/zinc/84/10/86/1133841086.db2.gz JVUMRPIFZSBCHT-MRXNPFEDSA-N 1 1 285.362 3.569 20 10 CHCDMO C[C@@H](C[N@H+]1CCCc2cc(O)c(O)cc2C1)c1ccccc1 ZINC001207911503 1133860534 /nfs/dbraw/zinc/86/05/34/1133860534.db2.gz CBDHQOZKJMTQCC-AWEZNQCLSA-N 1 1 297.398 3.650 20 10 CHCDMO Cc1ccc([C@@H](C)CC[N@@H+](C)Cc2ccccc2O)o1 ZINC001208169756 1133894390 /nfs/dbraw/zinc/89/43/90/1133894390.db2.gz VDSUCJRIKIEFQH-ZDUSSCGKSA-N 1 1 273.376 3.919 20 10 CHCDMO C[N@@H+]1CC=C(N(c2ccccc2)c2ccc(N)cc2)CC1 ZINC001208858904 1133953876 /nfs/dbraw/zinc/95/38/76/1133953876.db2.gz SBTZWEPSOYXSMV-UHFFFAOYSA-N 1 1 279.387 3.626 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](C)C(F)(F)F ZINC001208902357 1133960171 /nfs/dbraw/zinc/96/01/71/1133960171.db2.gz RDKOEBBICHVWDB-GFCCVEGCSA-N 1 1 288.357 3.773 20 10 CHCDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000179555284 1134549252 /nfs/dbraw/zinc/54/92/52/1134549252.db2.gz ZLVHYTJMEOQIIC-KRWDZBQOSA-N 1 1 283.371 3.738 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC000180306393 1134568287 /nfs/dbraw/zinc/56/82/87/1134568287.db2.gz JOULYICOAYOROI-CZUORRHYSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1ccc(O)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC000183503163 1134660674 /nfs/dbraw/zinc/66/06/74/1134660674.db2.gz YHXDHQXQVDMKAS-UHFFFAOYSA-N 1 1 295.382 3.690 20 10 CHCDMO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc(F)cc1O ZINC000403489465 1134787987 /nfs/dbraw/zinc/78/79/87/1134787987.db2.gz ANMKSQRQYGYSEF-NSNUZPRRSA-N 1 1 281.396 3.609 20 10 CHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000404593850 1134948125 /nfs/dbraw/zinc/94/81/25/1134948125.db2.gz ZHOCXHRHMXBAQA-MRXNPFEDSA-N 1 1 299.414 3.935 20 10 CHCDMO CC[C@H](C)[C@@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217723321 1134992605 /nfs/dbraw/zinc/99/26/05/1134992605.db2.gz QNRMUKQUNQZXRQ-SWLSCSKDSA-N 1 1 296.374 3.573 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1ccc(N)cc1 ZINC001217967699 1135032527 /nfs/dbraw/zinc/03/25/27/1135032527.db2.gz UAGDOVWEJLHWBR-HNAYVOBHSA-N 1 1 296.414 3.558 20 10 CHCDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000186034458 262076057 /nfs/dbraw/zinc/07/60/57/262076057.db2.gz HYJCWCFVHQXHNA-BLLLJJGKSA-N 1 1 289.350 3.570 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1O ZINC000186129190 262081211 /nfs/dbraw/zinc/08/12/11/262081211.db2.gz UUHSBRYFKFDLMN-OCCSQVGLSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1O ZINC000285496595 263093497 /nfs/dbraw/zinc/09/34/97/263093497.db2.gz APSYXSOZKBCRIE-JLJPHGGASA-N 1 1 293.382 3.530 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1O ZINC000291532405 328264787 /nfs/dbraw/zinc/26/47/87/328264787.db2.gz KJJKKWYCYXRZPQ-KRWDZBQOSA-N 1 1 287.403 3.555 20 10 CHCDMO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000090339802 327094337 /nfs/dbraw/zinc/09/43/37/327094337.db2.gz ALMSMCNPZWZULZ-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO CC(C)c1csc(C[NH2+]Cc2c(O)cccc2Cl)n1 ZINC000125624576 519854590 /nfs/dbraw/zinc/85/45/90/519854590.db2.gz HXFMKVIOHKRCFR-UHFFFAOYSA-N 1 1 296.823 3.915 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21)c1ccc(F)cc1O ZINC000286153098 522713960 /nfs/dbraw/zinc/71/39/60/522713960.db2.gz PMZHGUGCGDVRTH-DLTWYDFYSA-N 1 1 293.382 3.530 20 10 CHCDMO C[C@H]([NH2+]CCC1CCCC1)c1ccc(F)cc1O ZINC000062747676 525330224 /nfs/dbraw/zinc/33/02/24/525330224.db2.gz PNPQMVMRPJPPDL-NSHDSACASA-N 1 1 251.345 3.762 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000131021658 526144303 /nfs/dbraw/zinc/14/43/03/526144303.db2.gz HMKBFDVYAXKGPK-CYBMUJFWSA-N 1 1 258.365 3.539 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1c(O)cccc1Cl ZINC000211443540 1118047830 /nfs/dbraw/zinc/04/78/30/1118047830.db2.gz UBYWENFTWGWBIV-NSHDSACASA-N 1 1 253.773 3.810 20 10 CHCDMO CN(C)c1cc(F)c(C[N@@H+](C)CC(C)(C)C)cc1F ZINC001179966494 1121937858 /nfs/dbraw/zinc/93/78/58/1121937858.db2.gz NCPUSBHUOOFKKX-UHFFFAOYSA-N 1 1 270.367 3.509 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001203650913 1122415201 /nfs/dbraw/zinc/41/52/01/1122415201.db2.gz GEFWCXJNLALZRC-VXGBXAGGSA-N 1 1 265.784 3.668 20 10 CHCDMO CCOCCC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841750851 1132390715 /nfs/dbraw/zinc/39/07/15/1132390715.db2.gz JSCVEAOLQHCIOB-LBPRGKRZSA-N 1 1 297.826 3.903 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)cc1O ZINC000841751143 1132391019 /nfs/dbraw/zinc/39/10/19/1132391019.db2.gz LNSIOTOUAHSABV-LSCVPOLPSA-N 1 1 283.799 3.652 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841759172 1132394528 /nfs/dbraw/zinc/39/45/28/1132394528.db2.gz OGMAIMQFNKQKDY-GRYCIOLGSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(Cl)cc1O ZINC000841758328 1132394998 /nfs/dbraw/zinc/39/49/98/1132394998.db2.gz LDBHMYCGPAPWDQ-QMTHXVAHSA-N 1 1 285.840 3.982 20 10 CHCDMO C[C@]1(CF)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452115 1132624385 /nfs/dbraw/zinc/62/43/85/1132624385.db2.gz LHAYMWZNSIWSLC-CYBMUJFWSA-N 1 1 291.288 3.593 20 10 CHCDMO C[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841755026 1125593702 /nfs/dbraw/zinc/59/37/02/1125593702.db2.gz FUUAJEIRJDTLRK-WCABBAIRSA-N 1 1 271.813 3.590 20 10 CHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(OC)ccc1O ZINC000135749518 1125596625 /nfs/dbraw/zinc/59/66/25/1125596625.db2.gz ZHYNOVLRPHTAEQ-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841765311 1125601675 /nfs/dbraw/zinc/60/16/75/1125601675.db2.gz XUOZTUVDNJKVLJ-LBPRGKRZSA-N 1 1 290.794 3.642 20 10 CHCDMO COC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886547473 1125688993 /nfs/dbraw/zinc/68/89/93/1125688993.db2.gz LYQJWJPEUIVLCE-SWLSCSKDSA-N 1 1 289.350 3.570 20 10 CHCDMO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886561797 1125691880 /nfs/dbraw/zinc/69/18/80/1125691880.db2.gz JKODCZZBYJHLKW-NEPJUHHUSA-N 1 1 288.366 3.901 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1c(O)cccc1F ZINC000886607370 1125696573 /nfs/dbraw/zinc/69/65/73/1125696573.db2.gz QLCDOXIKXVRLRJ-IUODEOHRSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1c(O)cccc1F ZINC000886607549 1125696851 /nfs/dbraw/zinc/69/68/51/1125696851.db2.gz UIYBLGOWIBWZBY-JHJVBQTASA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCCO1)c1c(O)cccc1F ZINC000886646591 1125702285 /nfs/dbraw/zinc/70/22/85/1125702285.db2.gz NHUOMJUOWFNWKR-KCTSRDHCSA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCSC[C@@H]2C)cc1C(C)C ZINC000738284019 1129391965 /nfs/dbraw/zinc/39/19/65/1129391965.db2.gz IMKKLVQPILPYGC-ZDUSSCGKSA-N 1 1 279.449 3.761 20 10 CHCDMO CC1=C(C)C[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000796016697 1129463802 /nfs/dbraw/zinc/46/38/02/1129463802.db2.gz BIPFGPJENJPAEG-UHFFFAOYSA-N 1 1 269.747 3.727 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000796016697 1129463805 /nfs/dbraw/zinc/46/38/05/1129463805.db2.gz BIPFGPJENJPAEG-UHFFFAOYSA-N 1 1 269.747 3.727 20 10 CHCDMO CC[N@H+](Cc1cc2c(cc1O)CCCC2)CC1CC1 ZINC000768444398 1129857682 /nfs/dbraw/zinc/85/76/82/1129857682.db2.gz ATWZVBWPTRQNFM-UHFFFAOYSA-N 1 1 259.393 3.503 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c(Cl)c1 ZINC001461992417 1130164895 /nfs/dbraw/zinc/16/48/95/1130164895.db2.gz FKVAOUOJLNZHIK-ZWNOBZJWSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(Cl)c1 ZINC001461992417 1130164900 /nfs/dbraw/zinc/16/49/00/1130164900.db2.gz FKVAOUOJLNZHIK-ZWNOBZJWSA-N 1 1 271.763 3.534 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000158760624 1126756185 /nfs/dbraw/zinc/75/61/85/1126756185.db2.gz FKDYGNVNXBMQPE-CYBMUJFWSA-N 1 1 277.364 3.760 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccncc2)cc1C ZINC000183705524 1126890883 /nfs/dbraw/zinc/89/08/83/1126890883.db2.gz NIDKJNXLXNNGLX-AWEZNQCLSA-N 1 1 270.376 3.597 20 10 CHCDMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cs1 ZINC000185425333 1126900001 /nfs/dbraw/zinc/90/00/01/1126900001.db2.gz RSRSFUPJOHGERH-NXEZZACHSA-N 1 1 294.395 3.962 20 10 CHCDMO COCCC1(C[NH2+][C@H](C)c2ccc(F)cc2O)CCCC1 ZINC000185747494 1126902416 /nfs/dbraw/zinc/90/24/16/1126902416.db2.gz ZYMPOPBGOGNGBA-CYBMUJFWSA-N 1 1 295.398 3.779 20 10 CHCDMO C[C@@H](CCCO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192949816 1126965053 /nfs/dbraw/zinc/96/50/53/1126965053.db2.gz CDZDJEMBHRJCLQ-IUCAKERBSA-N 1 1 292.206 3.511 20 10 CHCDMO C[N@H+](Cc1cc2c(cc1O)CCC2)CC1CCCCC1 ZINC000912787320 1127112872 /nfs/dbraw/zinc/11/28/72/1127112872.db2.gz GAAOOBYDSZMRBO-UHFFFAOYSA-N 1 1 273.420 3.893 20 10 CHCDMO c1csc(S[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000283109458 1127122587 /nfs/dbraw/zinc/12/25/87/1127122587.db2.gz RTULAASIFJEUJK-ZDUSSCGKSA-N 1 1 276.430 3.510 20 10 CHCDMO CC[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C(C)C ZINC001237134843 1131056998 /nfs/dbraw/zinc/05/69/98/1131056998.db2.gz DHYZCGQVUKBMNZ-UHFFFAOYSA-N 1 1 261.287 3.641 20 10 CHCDMO C[C@@H]1CCSCC[N@H+]1Cc1cc(Cl)c(F)cc1[O-] ZINC000816591428 1131108065 /nfs/dbraw/zinc/10/80/65/1131108065.db2.gz DUMVEBXPVNMFTR-SECBINFHSA-N 1 1 289.803 3.512 20 10 CHCDMO C[C@@H]1CCSCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816591428 1131108069 /nfs/dbraw/zinc/10/80/69/1131108069.db2.gz DUMVEBXPVNMFTR-SECBINFHSA-N 1 1 289.803 3.512 20 10 CHCDMO C[C@@H]1CCSCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816591428 1131108073 /nfs/dbraw/zinc/10/80/73/1131108073.db2.gz DUMVEBXPVNMFTR-SECBINFHSA-N 1 1 289.803 3.512 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H]1C ZINC000816648270 1131119122 /nfs/dbraw/zinc/11/91/22/1131119122.db2.gz HZDLMLRHTGBFIL-GJZGRUSLSA-N 1 1 297.398 3.811 20 10 CHCDMO CC[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000285899795 1127246354 /nfs/dbraw/zinc/24/63/54/1127246354.db2.gz BHCVFBZYYQBWLO-HOCLYGCPSA-N 1 1 295.398 3.921 20 10 CHCDMO CCC[NH+](CCC)Cc1cc(F)c(Cl)cc1O ZINC001237946912 1131155769 /nfs/dbraw/zinc/15/57/69/1131155769.db2.gz OUFVLURDYPVVIE-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000760908509 1127325768 /nfs/dbraw/zinc/32/57/68/1127325768.db2.gz VZRBDKQVUINIRJ-WCBMZHEXSA-N 1 1 279.277 3.913 20 10 CHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000760908506 1127326245 /nfs/dbraw/zinc/32/62/45/1127326245.db2.gz VZRBDKQVUINIRJ-SCZZXKLOSA-N 1 1 279.277 3.913 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCOc2ccccc2)cc1C ZINC000058592863 1127362444 /nfs/dbraw/zinc/36/24/44/1127362444.db2.gz FSHICZHVFISOBT-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(F)ccc1O ZINC000226565440 1127411507 /nfs/dbraw/zinc/41/15/07/1127411507.db2.gz JHVBRHNUDHHQGY-AWEZNQCLSA-N 1 1 251.345 3.686 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](C)C2)c1O ZINC000169084356 1127482797 /nfs/dbraw/zinc/48/27/97/1127482797.db2.gz KUUJYUUAPIHUAC-QWRGUYRKSA-N 1 1 283.799 3.532 20 10 CHCDMO CC[C@H]([NH2+]Cc1occc1C)c1ccc(F)cc1O ZINC000293637075 1127509767 /nfs/dbraw/zinc/50/97/67/1127509767.db2.gz KNLGWYYDASUURT-ZDUSSCGKSA-N 1 1 263.312 3.674 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000228561328 1127567723 /nfs/dbraw/zinc/56/77/23/1127567723.db2.gz FKUFGNCZJQGVPD-PHIMTYICSA-N 1 1 283.799 3.532 20 10 CHCDMO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccccc1O ZINC000171925916 1127734306 /nfs/dbraw/zinc/73/43/06/1127734306.db2.gz TXTRAZXVELBMKQ-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1ccc(F)cc1O ZINC000230407938 1127751960 /nfs/dbraw/zinc/75/19/60/1127751960.db2.gz IXDZFOJUWGSKKR-UTUOFQBUSA-N 1 1 251.345 3.618 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000374260488 1127882007 /nfs/dbraw/zinc/88/20/07/1127882007.db2.gz WGKCUTYBZHCLFV-KRWDZBQOSA-N 1 1 285.412 3.682 20 10 CHCDMO Cc1cc(F)c(C[NH2+][C@H](C)c2ccc(F)cc2O)c(F)c1 ZINC000927095309 1128216296 /nfs/dbraw/zinc/21/62/96/1128216296.db2.gz ZSRWKOHQTVYPKG-SNVBAGLBSA-N 1 1 295.304 3.969 20 10 CHCDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccccc1O ZINC000777824872 1128288410 /nfs/dbraw/zinc/28/84/10/1128288410.db2.gz JMIXBSZHKDOZAM-ZDUSSCGKSA-N 1 1 273.351 3.594 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000778995543 1128674781 /nfs/dbraw/zinc/67/47/81/1128674781.db2.gz BIVYPFZXWZREFX-OAHLLOKOSA-N 1 1 285.362 3.596 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC000920258685 1128674990 /nfs/dbraw/zinc/67/49/90/1128674990.db2.gz VRMCTBUSPGCPMP-IBGZPJMESA-N 1 1 280.415 3.872 20 10 CHCDMO CC(C)CC[N@@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778996059 1128675490 /nfs/dbraw/zinc/67/54/90/1128675490.db2.gz LGUUEZKAGKXUOU-UHFFFAOYSA-N 1 1 251.345 3.542 20 10 CHCDMO CC[N@@H+](Cc1ccccc1C)Cc1cc(F)ccc1O ZINC000778996364 1128675541 /nfs/dbraw/zinc/67/55/41/1128675541.db2.gz MLERKTQCCRBLAR-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC000779010361 1128676887 /nfs/dbraw/zinc/67/68/87/1128676887.db2.gz ULETZOWZSBQRCV-CQSZACIVSA-N 1 1 251.345 3.542 20 10 CHCDMO C[C@H](C[N@@H+](C)Cc1cc(F)ccc1O)c1ccccc1 ZINC000779009926 1128677136 /nfs/dbraw/zinc/67/71/36/1128677136.db2.gz QSWZWOCNPONDEY-CYBMUJFWSA-N 1 1 273.351 3.767 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000779017804 1128680448 /nfs/dbraw/zinc/68/04/48/1128680448.db2.gz XRPZIUQFVIMCCS-LBPRGKRZSA-N 1 1 289.325 3.660 20 10 CHCDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1ccccc1O ZINC000779023635 1128685788 /nfs/dbraw/zinc/68/57/88/1128685788.db2.gz VBNDPCGKZVPGRG-NVXWUHKLSA-N 1 1 281.399 3.845 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCCC12CCCCC2 ZINC000779023449 1128686339 /nfs/dbraw/zinc/68/63/39/1128686339.db2.gz SEUSURGVYURNKL-UHFFFAOYSA-N 1 1 263.356 3.830 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2ncc(C)s2)cc1C ZINC000134905646 1128712705 /nfs/dbraw/zinc/71/27/05/1128712705.db2.gz UGHBJNFDDFCKFA-GFCCVEGCSA-N 1 1 276.405 3.619 20 10 CHCDMO CCCC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@H](C)CC ZINC000159820981 1128730265 /nfs/dbraw/zinc/73/02/65/1128730265.db2.gz FBTIIMHIHHNMLJ-CYBMUJFWSA-N 1 1 295.423 3.810 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)c1 ZINC000179630848 1128750585 /nfs/dbraw/zinc/75/05/85/1128750585.db2.gz XPJOLFOGAWLFEE-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO C[C@H]1CSCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000179661659 1128753586 /nfs/dbraw/zinc/75/35/86/1128753586.db2.gz MPKIKNMGENUVIZ-HNNXBMFYSA-N 1 1 290.476 3.614 20 10 CHCDMO COc1cc(C[N@@H+](C)Cc2ccc(C)s2)c(O)cc1C ZINC000160124654 1128754555 /nfs/dbraw/zinc/75/45/55/1128754555.db2.gz BVCLNYOBTLRNQO-UHFFFAOYSA-N 1 1 291.416 3.711 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1ccc(F)cc1O ZINC000842892328 1118159398 /nfs/dbraw/zinc/15/93/98/1118159398.db2.gz AYRJCWUZAQCUCA-JOYOIKCWSA-N 1 1 275.314 3.863 20 10 CHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(C)ccc(C)c2O)no1 ZINC001140178201 1118241491 /nfs/dbraw/zinc/24/14/91/1118241491.db2.gz CFTQQQGVAHFQBP-INIZCTEOSA-N 1 1 286.375 3.643 20 10 CHCDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cc(F)ccc1O ZINC000179923900 1128767611 /nfs/dbraw/zinc/76/76/11/1128767611.db2.gz PMDIKLARWABSRG-NSHDSACASA-N 1 1 277.314 3.863 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000076074015 1128768771 /nfs/dbraw/zinc/76/87/71/1128768771.db2.gz CGQCRPWOUJZLOZ-LJQANCHMSA-N 1 1 299.414 3.646 20 10 CHCDMO CC[C@@H](N[C@H](C)C[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000765770359 1118322568 /nfs/dbraw/zinc/32/25/68/1118322568.db2.gz WRPBHXRJVVSCTO-CRAIPNDOSA-N 1 1 291.483 3.524 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccccc2F)c1 ZINC000160730841 1118532961 /nfs/dbraw/zinc/53/29/61/1118532961.db2.gz NTWQYYHLQHIBCJ-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO C[C@@H]1[C@H](C)C[N@@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707138836 1118642793 /nfs/dbraw/zinc/64/27/93/1118642793.db2.gz IDDACCIGBWYJTL-MXWKQRLJSA-N 1 1 298.224 3.631 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000754727440 1118646504 /nfs/dbraw/zinc/64/65/04/1118646504.db2.gz VTEOQAGEYZIZLC-MRXNPFEDSA-N 1 1 259.393 3.774 20 10 CHCDMO CC(C)[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000780495423 1118712448 /nfs/dbraw/zinc/71/24/48/1118712448.db2.gz DTYNOFBEWKQLBQ-HNNXBMFYSA-N 1 1 284.403 3.808 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2O)c1 ZINC001140461388 1118719738 /nfs/dbraw/zinc/71/97/38/1118719738.db2.gz KLFAMZDTSUWOCR-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)C[C@H](C)C(C)(C)C)c1 ZINC000399577599 1118950044 /nfs/dbraw/zinc/95/00/44/1118950044.db2.gz BTCKGTFBLOCSGH-LBPRGKRZSA-N 1 1 265.397 3.515 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])[C@@H](C)C1 ZINC000224468530 1119003672 /nfs/dbraw/zinc/00/36/72/1119003672.db2.gz DYEPTGJAWCQUAM-QWRGUYRKSA-N 1 1 253.773 3.666 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC000092119351 1119088195 /nfs/dbraw/zinc/08/81/95/1119088195.db2.gz BJIPQTNATWAZBH-FUHWJXTLSA-N 1 1 270.420 3.661 20 10 CHCDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708401469 1119437468 /nfs/dbraw/zinc/43/74/68/1119437468.db2.gz TWFVUBLVWHQVNF-LLVKDONJSA-N 1 1 269.335 3.538 20 10 CHCDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708401469 1119437469 /nfs/dbraw/zinc/43/74/69/1119437469.db2.gz TWFVUBLVWHQVNF-LLVKDONJSA-N 1 1 269.335 3.538 20 10 CHCDMO CC[C@H](C)C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708445610 1119467026 /nfs/dbraw/zinc/46/70/26/1119467026.db2.gz VGKSUFSGOKCUEZ-UWVGGRQHSA-N 1 1 257.324 3.585 20 10 CHCDMO CC[C@@H](C)C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708445615 1119467209 /nfs/dbraw/zinc/46/72/09/1119467209.db2.gz VGKSUFSGOKCUEZ-ZJUUUORDSA-N 1 1 257.324 3.585 20 10 CHCDMO CCCCOCCC[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796663785 1119675851 /nfs/dbraw/zinc/67/58/51/1119675851.db2.gz QCRQEODTJBAHPF-OAHLLOKOSA-N 1 1 283.387 3.779 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2)c1O ZINC000179701877 1119758046 /nfs/dbraw/zinc/75/80/46/1119758046.db2.gz NFENIQKITYFOOZ-CYBMUJFWSA-N 1 1 271.360 3.594 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC000708767198 1119808327 /nfs/dbraw/zinc/80/83/27/1119808327.db2.gz SGTSXNAEVPBVGR-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(N2CCCCCC2)cc1 ZINC000177956608 1119890511 /nfs/dbraw/zinc/89/05/11/1119890511.db2.gz QSMPDMFPGAEKKM-OAHLLOKOSA-N 1 1 298.434 3.641 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCC2(C)C)c(Cl)c1 ZINC001140921821 1120095001 /nfs/dbraw/zinc/09/50/01/1120095001.db2.gz RCOBLXRTPLYGRA-UHFFFAOYSA-N 1 1 266.816 3.780 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792148 1128891167 /nfs/dbraw/zinc/89/11/67/1128891167.db2.gz CHDJGYXIHZQHGK-VIFPVBQESA-N 1 1 274.191 3.931 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792148 1128891172 /nfs/dbraw/zinc/89/11/72/1128891172.db2.gz CHDJGYXIHZQHGK-VIFPVBQESA-N 1 1 274.191 3.931 20 10 CHCDMO Cc1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC001140955094 1120146904 /nfs/dbraw/zinc/14/69/04/1120146904.db2.gz QUHSCIOKWYQLKN-QGZVFWFLSA-N 1 1 267.372 3.820 20 10 CHCDMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC000921817534 1120226128 /nfs/dbraw/zinc/22/61/28/1120226128.db2.gz XXZVAYHUONVCJH-GFCCVEGCSA-N 1 1 288.416 3.627 20 10 CHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccccc1O)CCC2 ZINC000179574693 1120250919 /nfs/dbraw/zinc/25/09/19/1120250919.db2.gz WRSRCOMWIWJMIS-AWEZNQCLSA-N 1 1 288.416 3.667 20 10 CHCDMO Cc1ccc([C@@H](C)NCC[NH+](C(C)C)C(C)C)c(O)c1C ZINC000756374125 1120275942 /nfs/dbraw/zinc/27/59/42/1120275942.db2.gz XXPSMGQDHDQHGD-MRXNPFEDSA-N 1 1 292.467 3.778 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1O ZINC000781928993 1120580736 /nfs/dbraw/zinc/58/07/36/1120580736.db2.gz OLUABMXWDQCXJK-CXAGYDPISA-N 1 1 259.393 3.713 20 10 CHCDMO C[C@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000922836365 1120607592 /nfs/dbraw/zinc/60/75/92/1120607592.db2.gz JFPBDWLJZQFEIA-DTWKUNHWSA-N 1 1 289.803 3.558 20 10 CHCDMO CO[C@H](C)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000248410935 1120706919 /nfs/dbraw/zinc/70/69/19/1120706919.db2.gz DLCOCQXCHGSMHW-HZPDHXFCSA-N 1 1 299.414 3.990 20 10 CHCDMO CC[C@H]([NH2+]C1CCC(O)(CC)CC1)c1ccc(F)cc1O ZINC000796796226 1120735885 /nfs/dbraw/zinc/73/58/85/1120735885.db2.gz CGAHWINHOZTPAT-GULBITTBSA-N 1 1 295.398 3.656 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC3(C2)CCCCC3)c1O ZINC000314620344 1120968406 /nfs/dbraw/zinc/96/84/06/1120968406.db2.gz UHZNIXOLDYETTJ-UHFFFAOYSA-N 1 1 289.419 3.947 20 10 CHCDMO Cc1ccccc1CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000094183083 1120979914 /nfs/dbraw/zinc/97/99/14/1120979914.db2.gz ZEHSJEIVRAUNAU-ZDUSSCGKSA-N 1 1 273.351 3.733 20 10 CHCDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000317455760 1121011511 /nfs/dbraw/zinc/01/15/11/1121011511.db2.gz WXKABYFSNNYJAE-OAHLLOKOSA-N 1 1 299.414 3.772 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1c([O-])cccc1F ZINC001137838533 1121417613 /nfs/dbraw/zinc/41/76/13/1121417613.db2.gz CBYYONGEMRKXAL-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[N@H+](Cc1ccc(F)cc1)Cc1c(O)cccc1F ZINC001137838533 1121417616 /nfs/dbraw/zinc/41/76/16/1121417616.db2.gz CBYYONGEMRKXAL-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706225414 1121421570 /nfs/dbraw/zinc/42/15/70/1121421570.db2.gz IWFINHNGSNCMRB-VXGBXAGGSA-N 1 1 263.356 3.762 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1Br)C1CCCC1 ZINC000707134825 1121450597 /nfs/dbraw/zinc/45/05/97/1121450597.db2.gz KPZUFJHDBLVMOX-UHFFFAOYSA-N 1 1 284.197 3.529 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000773746622 1121790617 /nfs/dbraw/zinc/79/06/17/1121790617.db2.gz NBMDDLYBJOLQKP-AWEZNQCLSA-N 1 1 272.392 3.929 20 10 CHCDMO C[C@@H]1CC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001178624223 1121799621 /nfs/dbraw/zinc/79/96/21/1121799621.db2.gz KFDSAQFZNAHIBH-NXEZZACHSA-N 1 1 271.763 3.711 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](c3ccco3)C2)cc1 ZINC000773757263 1121799956 /nfs/dbraw/zinc/79/99/56/1121799956.db2.gz NVTMZDUTBSWYFA-INIZCTEOSA-N 1 1 284.403 3.725 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000773770035 1121815822 /nfs/dbraw/zinc/81/58/22/1121815822.db2.gz BYIWNYIRDIWBHJ-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@H](C)O1 ZINC001204233572 1121831113 /nfs/dbraw/zinc/83/11/13/1121831113.db2.gz RPVVQDIGGITWEL-GASCZTMLSA-N 1 1 298.430 3.515 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000773815188 1121882106 /nfs/dbraw/zinc/88/21/06/1121882106.db2.gz YLRIRSPKVPMPOQ-IBGZPJMESA-N 1 1 295.430 3.875 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H](C)O1 ZINC000732184551 1121910894 /nfs/dbraw/zinc/91/08/94/1121910894.db2.gz CLZUIKMRSMHBPQ-HOCLYGCPSA-N 1 1 291.435 3.823 20 10 CHCDMO C[N@@H+](CCc1c(F)cccc1Cl)Cc1ccccc1O ZINC000732203182 1121911816 /nfs/dbraw/zinc/91/18/16/1121911816.db2.gz OBLUKUJYLQKEJV-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(Cl)cc1O ZINC001180064337 1121945955 /nfs/dbraw/zinc/94/59/55/1121945955.db2.gz DZYPDDOANJFPFE-UHFFFAOYSA-N 1 1 281.705 3.820 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC001180203732 1121963590 /nfs/dbraw/zinc/96/35/90/1121963590.db2.gz YJCBLTKYXIITKB-YJBOKZPZSA-N 1 1 289.419 3.517 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](OC)[C@@H](C)CC ZINC001180194737 1121965723 /nfs/dbraw/zinc/96/57/23/1121965723.db2.gz MAEQHOWKZHSHKO-YOEHRIQHSA-N 1 1 279.424 3.665 20 10 CHCDMO C[C@H]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC001181399438 1122053739 /nfs/dbraw/zinc/05/37/39/1122053739.db2.gz IPYVNCWOWUEHSM-VHSXEESVSA-N 1 1 271.763 3.711 20 10 CHCDMO Oc1cc(F)c(F)cc1CNc1cccc(C2CC2)[nH+]1 ZINC001181932023 1122098286 /nfs/dbraw/zinc/09/82/86/1122098286.db2.gz APDHXDCDFNLRDS-UHFFFAOYSA-N 1 1 276.286 3.555 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCC3)[C@@H]2C(C)C)c1O ZINC001182087041 1122107853 /nfs/dbraw/zinc/10/78/53/1122107853.db2.gz OTHWEOFHYLNVPO-KRWDZBQOSA-N 1 1 289.419 3.720 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)C[C@H](C)O)c1cc(Cl)c(Cl)cc1O ZINC000774355521 1122160492 /nfs/dbraw/zinc/16/04/92/1122160492.db2.gz TYZWQLPWYBDPQQ-XHNCKOQMSA-N 1 1 292.206 3.509 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c(Cl)c1 ZINC001182453752 1122162889 /nfs/dbraw/zinc/16/28/89/1122162889.db2.gz VREIVDASYNLTSK-TUAOUCFPSA-N 1 1 267.800 3.830 20 10 CHCDMO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(F)cc1O ZINC000273527183 1122238076 /nfs/dbraw/zinc/23/80/76/1122238076.db2.gz VORDSUMCVOJNIF-LBPRGKRZSA-N 1 1 271.335 3.871 20 10 CHCDMO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1c(O)cccc1F ZINC001183920009 1122248591 /nfs/dbraw/zinc/24/85/91/1122248591.db2.gz SKOPYHSGBAIYLS-VXGBXAGGSA-N 1 1 253.361 3.836 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]C/C=C/c1ccc(F)cc1F ZINC001183920029 1122248702 /nfs/dbraw/zinc/24/87/02/1122248702.db2.gz SUSHULIAHGAMRU-NSCUHMNNSA-N 1 1 293.288 3.613 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)cc1 ZINC001190674159 1122551794 /nfs/dbraw/zinc/55/17/94/1122551794.db2.gz PVOZYLXAUZUVFE-AWEZNQCLSA-N 1 1 272.436 3.906 20 10 CHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775641747 1122850026 /nfs/dbraw/zinc/85/00/26/1122850026.db2.gz DMJQFOLPKBBLKG-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000775649075 1122863266 /nfs/dbraw/zinc/86/32/66/1122863266.db2.gz ZREYGZZCTQOPBT-GOSISDBHSA-N 1 1 281.399 3.908 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1O ZINC000775651857 1122866691 /nfs/dbraw/zinc/86/66/91/1122866691.db2.gz RCLNXTIVMKMFSV-KRWDZBQOSA-N 1 1 281.399 3.765 20 10 CHCDMO Cc1cccc(C[N@H+]2CCOc3ccccc3[C@H]2C)c1O ZINC000775657549 1122871394 /nfs/dbraw/zinc/87/13/94/1122871394.db2.gz CVAVDQRQQDIJQQ-CQSZACIVSA-N 1 1 283.371 3.656 20 10 CHCDMO COCC[N@@H+](Cc1cc(Cl)cc(C)c1O)C1CCCC1 ZINC000775656928 1122871791 /nfs/dbraw/zinc/87/17/91/1122871791.db2.gz QCXATMZUNUPSEK-UHFFFAOYSA-N 1 1 297.826 3.745 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3C)C2)c1 ZINC000775670890 1122888162 /nfs/dbraw/zinc/88/81/62/1122888162.db2.gz SKKWMBYEJDXAFE-OAHLLOKOSA-N 1 1 297.398 3.699 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000894783027 1122906270 /nfs/dbraw/zinc/90/62/70/1122906270.db2.gz PHDXFLNEOGOGBY-HNNXBMFYSA-N 1 1 292.329 3.649 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000894783027 1122906275 /nfs/dbraw/zinc/90/62/75/1122906275.db2.gz PHDXFLNEOGOGBY-HNNXBMFYSA-N 1 1 292.329 3.649 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(Cl)cc(F)c2[O-])n1 ZINC000775716037 1122921686 /nfs/dbraw/zinc/92/16/86/1122921686.db2.gz POKGYCMCRYHIKW-UHFFFAOYSA-N 1 1 294.757 3.520 20 10 CHCDMO Cc1cccc(CN(C)Cc2cc(Cl)cc(F)c2[O-])n1 ZINC000775716037 1122921688 /nfs/dbraw/zinc/92/16/88/1122921688.db2.gz POKGYCMCRYHIKW-UHFFFAOYSA-N 1 1 294.757 3.520 20 10 CHCDMO COc1ccc(O)c(C[N@@H+]2CC=C(C(C)(C)C)CC2)c1 ZINC000775745415 1122935172 /nfs/dbraw/zinc/93/51/72/1122935172.db2.gz UVNGKPNZEUAFAT-UHFFFAOYSA-N 1 1 275.392 3.579 20 10 CHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H]2C(C)C)c1O ZINC000775763093 1122948406 /nfs/dbraw/zinc/94/84/06/1122948406.db2.gz DITVITDCIOMIGG-CYBMUJFWSA-N 1 1 298.224 3.693 20 10 CHCDMO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203936570 1123032739 /nfs/dbraw/zinc/03/27/39/1123032739.db2.gz GJNLREZXQOVYBY-OAHLLOKOSA-N 1 1 298.430 3.954 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776013694 1123036447 /nfs/dbraw/zinc/03/64/47/1123036447.db2.gz NLMAAOJOKCYSSO-WCQYABFASA-N 1 1 287.325 3.863 20 10 CHCDMO CC[N@@H+](CCCc1ccccc1)Cc1ccccc1O ZINC001201671915 1123133371 /nfs/dbraw/zinc/13/33/71/1123133371.db2.gz OPTFNNYVPWHFLL-UHFFFAOYSA-N 1 1 269.388 3.847 20 10 CHCDMO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccccc1O ZINC000895133304 1123246361 /nfs/dbraw/zinc/24/63/61/1123246361.db2.gz IJWLRGSKCXCZOH-ZDUSSCGKSA-N 1 1 288.391 3.919 20 10 CHCDMO C[C@@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)CC1(F)F ZINC000850380453 1123260179 /nfs/dbraw/zinc/26/01/79/1123260179.db2.gz GFZWAJXHHODXKH-GFCCVEGCSA-N 1 1 293.716 3.710 20 10 CHCDMO CC1(C)[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1(F)F ZINC000850394275 1123261973 /nfs/dbraw/zinc/26/19/73/1123261973.db2.gz OMMBCTMGEWESRY-JTQLQIEISA-N 1 1 293.716 3.566 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(F)cc1O ZINC000850482271 1123273123 /nfs/dbraw/zinc/27/31/23/1123273123.db2.gz NDGYAKIBBMJZKX-WFASDCNBSA-N 1 1 288.366 3.771 20 10 CHCDMO CSCC1(CC[NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000850506100 1123275931 /nfs/dbraw/zinc/27/59/31/1123275931.db2.gz FOOFDYNZIRYZJQ-LLVKDONJSA-N 1 1 283.412 3.715 20 10 CHCDMO C[C@H]([NH2+]CCc1ccoc1)c1ccc(Cl)cc1O ZINC000850531035 1123285034 /nfs/dbraw/zinc/28/50/34/1123285034.db2.gz GMHNLVKSMIVDAS-JTQLQIEISA-N 1 1 265.740 3.532 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(Cl)cc1O ZINC000850571697 1123295162 /nfs/dbraw/zinc/29/51/62/1123295162.db2.gz UBUUVTHZKOGOFD-GHMZBOCLSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccccc1O ZINC000109772104 1123326857 /nfs/dbraw/zinc/32/68/57/1123326857.db2.gz CLNACDFSSWGOHW-NSHDSACASA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccccc1O ZINC000109772104 1123326860 /nfs/dbraw/zinc/32/68/60/1123326860.db2.gz CLNACDFSSWGOHW-NSHDSACASA-N 1 1 277.314 3.863 20 10 CHCDMO CCCC[N@@H+](Cc1nc(C)oc1C)Cc1ccccc1O ZINC000852018597 1123393068 /nfs/dbraw/zinc/39/30/68/1123393068.db2.gz NUXQZZHMEZHTRS-UHFFFAOYSA-N 1 1 288.391 3.799 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCCc2ccccc21 ZINC000111235617 1123432153 /nfs/dbraw/zinc/43/21/53/1123432153.db2.gz PAPFUWNUIVRQLZ-QGZVFWFLSA-N 1 1 267.372 3.902 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]3C[C@H]3C2)cc1C(C)C ZINC000853581074 1123444146 /nfs/dbraw/zinc/44/41/46/1123444146.db2.gz RRGYBTXSDXGJGR-KBPBESRZSA-N 1 1 259.393 3.666 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccccc2O)ccc1Cl ZINC000780757859 1123511670 /nfs/dbraw/zinc/51/16/70/1123511670.db2.gz ILDGCGJZRQFJPH-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1cccnc1)C1CCCC1 ZINC000113506148 1123529631 /nfs/dbraw/zinc/52/96/31/1123529631.db2.gz SWGRJYOHEIPNME-UHFFFAOYSA-N 1 1 282.387 3.732 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c1O ZINC001237687803 1129128736 /nfs/dbraw/zinc/12/87/36/1129128736.db2.gz VHTMLUWJEUIEBP-PWSUYJOCSA-N 1 1 267.800 3.974 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)[C@H](C)[C@H](C)O1 ZINC000783544140 1123642536 /nfs/dbraw/zinc/64/25/36/1123642536.db2.gz PJXUCEUYVZDABD-MCIONIFRSA-N 1 1 285.387 3.543 20 10 CHCDMO CCC(F)(F)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000858508785 1123659595 /nfs/dbraw/zinc/65/95/95/1123659595.db2.gz ZNBQVTPKRGVGKP-LLVKDONJSA-N 1 1 257.324 3.705 20 10 CHCDMO C/C=C\C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000858536949 1123660900 /nfs/dbraw/zinc/66/09/00/1123660900.db2.gz LGSJCHDQVJEBDS-TYRPZCRBSA-N 1 1 259.271 3.638 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc2ccccc2c1O ZINC000194990361 1129140405 /nfs/dbraw/zinc/14/04/05/1129140405.db2.gz JVNWZBGSDUMWSJ-CABCVRRESA-N 1 1 298.430 3.538 20 10 CHCDMO Cc1cc(C)c2c(c1)C[N@H+](Cc1ccccc1O)CC2 ZINC000777220168 1123785828 /nfs/dbraw/zinc/78/58/28/1123785828.db2.gz PBZUYOMWDMWKIH-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO c1[nH+]c2c(n1Cc1ccc(N3CCCCC3)cc1)CCCC2 ZINC000862431703 1123809086 /nfs/dbraw/zinc/80/90/86/1123809086.db2.gz QMWMSEGQIPGCEO-UHFFFAOYSA-N 1 1 295.430 3.801 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC(F)(F)CC2)c1O ZINC000862467425 1123812852 /nfs/dbraw/zinc/81/28/52/1123812852.db2.gz UQCDCGRHFWXPDH-UHFFFAOYSA-N 1 1 289.753 3.975 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCCC(F)(F)CC2)cc1Cl ZINC000862467100 1123813285 /nfs/dbraw/zinc/81/32/85/1123813285.db2.gz PGKMQKIIXZNXRS-UHFFFAOYSA-N 1 1 289.753 3.975 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCC3(CC3)CC2)c1O ZINC000862538486 1123816323 /nfs/dbraw/zinc/81/63/23/1123816323.db2.gz ACMJDVXVWJDGHA-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)C2CC2)cc1 ZINC000195667694 1129148646 /nfs/dbraw/zinc/14/86/46/1129148646.db2.gz XINIFQWIKPDZGI-UHFFFAOYSA-N 1 1 280.415 3.917 20 10 CHCDMO CC(=O)[C@@H]1CC[N@@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859022 1123855738 /nfs/dbraw/zinc/85/57/38/1123855738.db2.gz FLBIGBFEHBMDSW-QGZVFWFLSA-N 1 1 296.414 3.505 20 10 CHCDMO C[C@@H]([NH2+]CCCc1ccccc1F)c1ccc(F)cc1O ZINC000794838738 1123988324 /nfs/dbraw/zinc/98/83/24/1123988324.db2.gz ABVBYJOZBGLLFJ-GFCCVEGCSA-N 1 1 291.341 3.954 20 10 CHCDMO CC(C)CO[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000120893641 1124032386 /nfs/dbraw/zinc/03/23/86/1124032386.db2.gz CXQVWGVAMIFEPC-INIZCTEOSA-N 1 1 299.414 3.792 20 10 CHCDMO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)s1 ZINC000866455391 1124067967 /nfs/dbraw/zinc/06/79/67/1124067967.db2.gz LDLCEKRXFWNIDB-RKDXNWHRSA-N 1 1 280.368 3.708 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ccc(F)cc1O ZINC000866498997 1124073816 /nfs/dbraw/zinc/07/38/16/1124073816.db2.gz CGIKBFOHROIGTJ-GMTAPVOTSA-N 1 1 277.261 3.523 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000021964434 1124107043 /nfs/dbraw/zinc/10/70/43/1124107043.db2.gz ZZWXJNQDJUFUGA-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000876550870 1124959288 /nfs/dbraw/zinc/95/92/88/1124959288.db2.gz FDODVEVPIOFNJC-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(C)cc2O)s1 ZINC000876716324 1124973547 /nfs/dbraw/zinc/97/35/47/1124973547.db2.gz YLYJFSSNHUWSCJ-GFCCVEGCSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000877547072 1125043505 /nfs/dbraw/zinc/04/35/05/1125043505.db2.gz WLLAHJZTQNJWPJ-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879650065 1125222059 /nfs/dbraw/zinc/22/20/59/1125222059.db2.gz ZJBURHNUOVDKLC-VXGBXAGGSA-N 1 1 289.379 3.530 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000882986760 1125365620 /nfs/dbraw/zinc/36/56/20/1125365620.db2.gz IMFQQLMQFAJPFX-UHFFFAOYSA-N 1 1 293.288 3.588 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000131066359 1125372734 /nfs/dbraw/zinc/37/27/34/1125372734.db2.gz XPIHOVLKKGRNRC-GFCCVEGCSA-N 1 1 276.355 3.678 20 10 CHCDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1F ZINC000883126937 1125373103 /nfs/dbraw/zinc/37/31/03/1125373103.db2.gz GFGWCNFDSANMTG-UHFFFAOYSA-N 1 1 295.304 3.834 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000131988123 1125412314 /nfs/dbraw/zinc/41/23/14/1125412314.db2.gz BBSGVKYFBIKIFC-QGZVFWFLSA-N 1 1 267.372 3.820 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000131988332 1125412552 /nfs/dbraw/zinc/41/25/52/1125412552.db2.gz BBSGVKYFBIKIFC-KRWDZBQOSA-N 1 1 267.372 3.820 20 10 CHCDMO CC1CCC([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001168221724 1125418314 /nfs/dbraw/zinc/41/83/14/1125418314.db2.gz NDECIFWMWLDQFQ-UHFFFAOYSA-N 1 1 260.425 3.763 20 10 CHCDMO CCC[N@H+](Cc1ccc(N(C)C)c(C)c1)CC1CC1 ZINC001139669696 1131353876 /nfs/dbraw/zinc/35/38/76/1131353876.db2.gz HVCLLCIFOSZUHA-UHFFFAOYSA-N 1 1 260.425 3.683 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)c1 ZINC000245555009 1129211603 /nfs/dbraw/zinc/21/16/03/1129211603.db2.gz HVCFHJHLHWILHV-HNAYVOBHSA-N 1 1 297.398 3.663 20 10 CHCDMO C[C@H]1CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934217 1129221772 /nfs/dbraw/zinc/22/17/72/1129221772.db2.gz JBJVKPNBHXDHCY-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934217 1129221776 /nfs/dbraw/zinc/22/17/76/1129221776.db2.gz JBJVKPNBHXDHCY-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO CC(C)C[C@H]1COCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000733790085 1129270538 /nfs/dbraw/zinc/27/05/38/1129270538.db2.gz FLRLAJUAPONNCW-INIZCTEOSA-N 1 1 299.414 3.792 20 10 CHCDMO COCCCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000735493936 1129349214 /nfs/dbraw/zinc/34/92/14/1129349214.db2.gz TUROFVXAYPEWHR-UHFFFAOYSA-N 1 1 277.408 3.563 20 10 CHCDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000091974433 1129376233 /nfs/dbraw/zinc/37/62/33/1129376233.db2.gz QFRVYBNEOQMGLH-IUODEOHRSA-N 1 1 271.360 3.741 20 10 CHCDMO Cc1cc(C[N@@H+]2CCSC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000738283266 1129391533 /nfs/dbraw/zinc/39/15/33/1129391533.db2.gz DEZIRWHBGVSAJD-CYBMUJFWSA-N 1 1 293.476 3.935 20 10 CHCDMO Cc1cc(C[N@@H+]2CCSC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000738283267 1129392301 /nfs/dbraw/zinc/39/23/01/1129392301.db2.gz DEZIRWHBGVSAJD-ZDUSSCGKSA-N 1 1 293.476 3.935 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC=C(c3ccco3)C2)cc1C ZINC000795652272 1129407368 /nfs/dbraw/zinc/40/73/68/1129407368.db2.gz WWIIEBWJNYISAD-UHFFFAOYSA-N 1 1 283.371 3.891 20 10 CHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000093317123 1129421071 /nfs/dbraw/zinc/42/10/71/1129421071.db2.gz ZCNMYJDDLKDVRX-OAHLLOKOSA-N 1 1 297.826 3.827 20 10 CHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cccc(OC)c2O)C1 ZINC000093361815 1129422355 /nfs/dbraw/zinc/42/23/55/1129422355.db2.gz LUODKQAPHZCJHR-CQSZACIVSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC000093690283 1129427133 /nfs/dbraw/zinc/42/71/33/1129427133.db2.gz ONDZUCMEOFNYOJ-HOCLYGCPSA-N 1 1 277.433 3.561 20 10 CHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868898 1129428647 /nfs/dbraw/zinc/42/86/47/1129428647.db2.gz PTYRMXCXPXMXPZ-GJZGRUSLSA-N 1 1 279.449 3.807 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](C)C(C)C)c1ccc(F)cc1O ZINC000796771268 1129432089 /nfs/dbraw/zinc/43/20/89/1129432089.db2.gz 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/nfs/dbraw/zinc/58/36/00/1133583600.db2.gz ATABXSMTJCEMPM-MRXNPFEDSA-N 1 1 277.408 3.517 20 10 CHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001205540869 1133585702 /nfs/dbraw/zinc/58/57/02/1133585702.db2.gz LHNXTUDUPTZSIS-MRXNPFEDSA-N 1 1 297.826 3.827 20 10 CHCDMO CCc1cccc(C[N@@H+](CCOC)[C@H]2CC[C@@H](C)C2)c1O ZINC001205608817 1133594280 /nfs/dbraw/zinc/59/42/80/1133594280.db2.gz KQNCMWZGKHTIMR-PBHICJAKSA-N 1 1 291.435 3.592 20 10 CHCDMO CC(C)[C@@H]1[N@@H+](Cc2cc(F)c(F)cc2O)CC1(C)C ZINC001206040246 1133645862 /nfs/dbraw/zinc/64/58/62/1133645862.db2.gz PNALVZLRWLTMNX-AWEZNQCLSA-N 1 1 269.335 3.537 20 10 CHCDMO CC(C)[C@@H]1[N@H+](Cc2cc(F)c(F)cc2O)CC1(C)C ZINC001206040246 1133645858 /nfs/dbraw/zinc/64/58/58/1133645858.db2.gz PNALVZLRWLTMNX-AWEZNQCLSA-N 1 1 269.335 3.537 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)[C@@H](C)[C@H]1C ZINC001206342872 1133692756 /nfs/dbraw/zinc/69/27/56/1133692756.db2.gz MRHLZOWJTJKEBH-UTLUCORTSA-N 1 1 271.763 3.661 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)[C@@H](C)[C@H]1C ZINC001206342872 1133692760 /nfs/dbraw/zinc/69/27/60/1133692760.db2.gz MRHLZOWJTJKEBH-UTLUCORTSA-N 1 1 271.763 3.661 20 10 CHCDMO Oc1cccc2c1C[N@@H+](C/C=C\c1ccc(F)c(F)c1)C2 ZINC001207242932 1133782419 /nfs/dbraw/zinc/78/24/19/1133782419.db2.gz GVBSPGWDZKEAAF-IHWYPQMZSA-N 1 1 287.309 3.699 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2O)Cc2ccccc21 ZINC001207447991 1133802795 /nfs/dbraw/zinc/80/27/95/1133802795.db2.gz IAZYUCVIDBVWBS-LLVKDONJSA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)Cc2ccccc21 ZINC001207447991 1133802798 /nfs/dbraw/zinc/80/27/98/1133802798.db2.gz IAZYUCVIDBVWBS-LLVKDONJSA-N 1 1 289.325 3.790 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCc1ccccc1F)CC2 ZINC001207497401 1133809095 /nfs/dbraw/zinc/80/90/95/1133809095.db2.gz XIAMLTZSMBXFIQ-UHFFFAOYSA-N 1 1 285.362 3.522 20 10 CHCDMO CC[C@@H](Cc1cccs1)[NH2+]Cc1c(O)cccc1F ZINC001207622902 1133832109 /nfs/dbraw/zinc/83/21/09/1133832109.db2.gz QGFQSDGNXNZXDV-NSHDSACASA-N 1 1 279.380 3.704 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+](C)C2CC2)cc1 ZINC001209519457 1134034457 /nfs/dbraw/zinc/03/44/57/1134034457.db2.gz VMADYKBQOBKLHH-UHFFFAOYSA-N 1 1 254.377 3.688 20 10 CHCDMO CC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209519694 1134034900 /nfs/dbraw/zinc/03/49/00/1134034900.db2.gz FLECPAMIBHTMKC-GOSISDBHSA-N 1 1 296.414 3.505 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2cccs2)c1O ZINC000157838985 261153845 /nfs/dbraw/zinc/15/38/45/261153845.db2.gz JKUFLKISSGETRW-NSHDSACASA-N 1 1 277.389 3.655 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2cccs2)c1O ZINC000157839130 261154242 /nfs/dbraw/zinc/15/42/42/261154242.db2.gz JKUFLKISSGETRW-LLVKDONJSA-N 1 1 277.389 3.655 20 10 CHCDMO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000183981860 262003556 /nfs/dbraw/zinc/00/35/56/262003556.db2.gz HXOQJUXIYSAZJP-JSGCOSHPSA-N 1 1 281.371 3.531 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1F ZINC000184927629 262034366 /nfs/dbraw/zinc/03/43/66/262034366.db2.gz ONYCCXRMOZXNPX-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CO[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185101769 262040869 /nfs/dbraw/zinc/04/08/69/262040869.db2.gz MBRWMFRRESYQKM-PXAZEXFGSA-N 1 1 289.350 3.570 20 10 CHCDMO CCOCCC1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CCC1 ZINC000186115931 262079818 /nfs/dbraw/zinc/07/98/18/262079818.db2.gz DIQNVMNVZGCIQT-ZDUSSCGKSA-N 1 1 295.398 3.779 20 10 CHCDMO CCOCCC1(C[NH2+][C@H](C)c2ccc(F)cc2O)CCC1 ZINC000186115948 262080285 /nfs/dbraw/zinc/08/02/85/262080285.db2.gz DIQNVMNVZGCIQT-CYBMUJFWSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[N@H+](Cc1cccs1)Cc1cccc(F)c1O ZINC000272287859 263003241 /nfs/dbraw/zinc/00/32/41/263003241.db2.gz NRUDCNPADKVZOO-UHFFFAOYSA-N 1 1 265.353 3.615 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1cccc(F)c1O ZINC000272287859 263003242 /nfs/dbraw/zinc/00/32/42/263003242.db2.gz NRUDCNPADKVZOO-UHFFFAOYSA-N 1 1 265.353 3.615 20 10 CHCDMO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185351663 327838262 /nfs/dbraw/zinc/83/82/62/327838262.db2.gz USSFMZHWPPYQME-VXGBXAGGSA-N 1 1 289.350 3.519 20 10 CHCDMO Cc1c2ccccc2n(C)c1CNc1[nH+]cccc1C ZINC000468069233 331427954 /nfs/dbraw/zinc/42/79/54/331427954.db2.gz OZEHEXKWRGEQFV-UHFFFAOYSA-N 1 1 265.360 3.802 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ncc(C)s2)cc1 ZINC000230686729 333320833 /nfs/dbraw/zinc/32/08/33/333320833.db2.gz FKXGIBLWPZODQH-UHFFFAOYSA-N 1 1 289.448 3.588 20 10 CHCDMO CCCCN1CCC([NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000037149767 520576953 /nfs/dbraw/zinc/57/69/53/520576953.db2.gz BRYVEQHZYIBCPI-HNNXBMFYSA-N 1 1 290.451 3.616 20 10 CHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000273422124 521006121 /nfs/dbraw/zinc/00/61/21/521006121.db2.gz SMEZBBDFWIHVLE-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000290293409 523120039 /nfs/dbraw/zinc/12/00/39/523120039.db2.gz APQIASJZCRWSBE-HNNXBMFYSA-N 1 1 274.339 3.509 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278803974 525608150 /nfs/dbraw/zinc/60/81/50/525608150.db2.gz RKDGKZIWFBULDG-IUCAKERBSA-N 1 1 290.190 3.529 20 10 CHCDMO COc1cccc(CNc2ccc(C3CCC3)c[nH+]2)c1O ZINC000292889292 526042417 /nfs/dbraw/zinc/04/24/17/526042417.db2.gz CUTROLCLTJQPLN-UHFFFAOYSA-N 1 1 284.359 3.675 20 10 CHCDMO Oc1c(F)cccc1C[NH2+]Cc1ccc(C2CC2)cc1F ZINC000292868650 526330414 /nfs/dbraw/zinc/33/04/14/526330414.db2.gz WELTYWIOGPFTGQ-UHFFFAOYSA-N 1 1 289.325 3.838 20 10 CHCDMO Oc1cccc(Cl)c1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000131117200 526364613 /nfs/dbraw/zinc/36/46/13/526364613.db2.gz LPUAGKATDCNSLC-UHFFFAOYSA-N 1 1 294.807 3.669 20 10 CHCDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccccc1O ZINC000109771143 1125469297 /nfs/dbraw/zinc/46/92/97/1125469297.db2.gz CKJYKTLMAWFYMY-UHFFFAOYSA-N 1 1 293.313 3.626 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1C ZINC000069168369 1118227109 /nfs/dbraw/zinc/22/71/09/1118227109.db2.gz CKHABVFRJZAYND-LBPRGKRZSA-N 1 1 276.405 3.619 20 10 CHCDMO CC(C)C[C@H]1CC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001180267612 1121970532 /nfs/dbraw/zinc/97/05/32/1121970532.db2.gz YUTNHOKJHKSNCX-LLVKDONJSA-N 1 1 269.335 3.538 20 10 CHCDMO CCCC[C@@H](C)[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183918662 1122247909 /nfs/dbraw/zinc/24/79/09/1122247909.db2.gz BETWXKUEOLOTSF-VXGBXAGGSA-N 1 1 253.361 3.836 20 10 CHCDMO Cc1cccc(C[N@@H+](C2CC2)C2CCCCC2)c1O ZINC000775651837 1122866359 /nfs/dbraw/zinc/86/63/59/1122866359.db2.gz QVTJBVBUATWAFT-UHFFFAOYSA-N 1 1 259.393 3.998 20 10 CHCDMO C[C@H]([NH2+][C@H]1C=CCC1)c1cccc(C(F)(F)F)c1O ZINC000850510696 1123278088 /nfs/dbraw/zinc/27/80/88/1123278088.db2.gz WNLRUCNEZAEXAC-UWVGGRQHSA-N 1 1 271.282 3.780 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1Br)C[C@H]1CC1(C)C ZINC001140101086 1131664234 /nfs/dbraw/zinc/66/42/34/1131664234.db2.gz JPQZLKXMTBCJDU-SNVBAGLBSA-N 1 1 298.224 3.633 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140464252 1131750934 /nfs/dbraw/zinc/75/09/34/1131750934.db2.gz IOKNLQFAHVTCOC-PHIMTYICSA-N 1 1 253.773 3.524 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1 ZINC001140619781 1131829161 /nfs/dbraw/zinc/82/91/61/1131829161.db2.gz OLZUAKWSWDDALK-UHFFFAOYSA-N 1 1 269.335 3.568 20 10 CHCDMO C[C@@H]([NH2+]CCCc1ccccn1)c1ccc(Cl)cc1O ZINC000841747390 1125574273 /nfs/dbraw/zinc/57/42/73/1125574273.db2.gz ARGIDTFVNMKYLX-GFCCVEGCSA-N 1 1 290.794 3.724 20 10 CHCDMO Cc1ccc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)nc1 ZINC000841752490 1125584161 /nfs/dbraw/zinc/58/41/61/1125584161.db2.gz AZPKZNIMUKGPEH-GFCCVEGCSA-N 1 1 290.794 3.642 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1F ZINC000886497112 1125681526 /nfs/dbraw/zinc/68/15/26/1125681526.db2.gz SWDXTRVHMTYEIO-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cn1 ZINC000886526884 1125684327 /nfs/dbraw/zinc/68/43/27/1125684327.db2.gz ULNWNUIFMJUYMZ-RYUDHWBXSA-N 1 1 291.370 3.721 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccncc1 ZINC000886532786 1125685213 /nfs/dbraw/zinc/68/52/13/1125685213.db2.gz OUJLUUIKPDOWKL-RISCZKNCSA-N 1 1 274.339 3.728 20 10 CHCDMO COC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886547472 1125688846 /nfs/dbraw/zinc/68/88/46/1125688846.db2.gz LYQJWJPEUIVLCE-IUODEOHRSA-N 1 1 289.350 3.570 20 10 CHCDMO COCC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccco1 ZINC000886587537 1125694046 /nfs/dbraw/zinc/69/40/46/1125694046.db2.gz ASIZMIWDSZJWSE-YPMHNXCESA-N 1 1 293.338 3.553 20 10 CHCDMO COCC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccco1 ZINC000886587534 1125694409 /nfs/dbraw/zinc/69/44/09/1125694409.db2.gz ASIZMIWDSZJWSE-AAEUAGOBSA-N 1 1 293.338 3.553 20 10 CHCDMO C[C@H]([NH2+]CCCC(C)(F)F)c1c(O)cccc1F ZINC000886616150 1125697945 /nfs/dbraw/zinc/69/79/45/1125697945.db2.gz WBSWMQCRGMXQIL-VIFPVBQESA-N 1 1 261.287 3.617 20 10 CHCDMO Cc1cccnc1CCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886618513 1125698660 /nfs/dbraw/zinc/69/86/60/1125698660.db2.gz CQPRHEZGOSCJCM-CYBMUJFWSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1c(O)cccc1F ZINC000886627991 1125699285 /nfs/dbraw/zinc/69/92/85/1125699285.db2.gz CAGFAGYTHGXOFY-RYUDHWBXSA-N 1 1 295.423 3.715 20 10 CHCDMO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1c(O)cccc1F ZINC000886623485 1125699622 /nfs/dbraw/zinc/69/96/22/1125699622.db2.gz FGTXGRKNNYXREM-VIFPVBQESA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCCO1)c1c(O)cccc1F ZINC000886632927 1125700614 /nfs/dbraw/zinc/70/06/14/1125700614.db2.gz JSCBKMUTQRQZAW-KCTSRDHCSA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1cccc(CNc2c(C)cc([NH+](C)C)cc2C)c1O ZINC000184786075 1129250850 /nfs/dbraw/zinc/25/08/50/1129250850.db2.gz NZNSCFHSNPRNEV-UHFFFAOYSA-N 1 1 284.403 3.996 20 10 CHCDMO CCCC[C@@H](COC)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796772447 1129441726 /nfs/dbraw/zinc/44/17/26/1129441726.db2.gz RXVJRUFVUJUMIT-DZGCQCFKSA-N 1 1 283.387 3.777 20 10 CHCDMO CCOc1ccc(C)c(C[N@@H+](C)Cc2ccccc2O)c1 ZINC001238709868 1131235954 /nfs/dbraw/zinc/23/59/54/1131235954.db2.gz WLJWULHVFONWMP-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO C[C@H](C1CC1)[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000768532523 1129861712 /nfs/dbraw/zinc/86/17/12/1129861712.db2.gz MOYCREFCSHQTRC-SNVBAGLBSA-N 1 1 265.784 3.809 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000769236731 1129897084 /nfs/dbraw/zinc/89/70/84/1129897084.db2.gz CEWTVGWBVWZPFI-CQSZACIVSA-N 1 1 265.784 3.810 20 10 CHCDMO Cc1ncc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)s1 ZINC000179790665 1126834007 /nfs/dbraw/zinc/83/40/07/1126834007.db2.gz XPAVKNVGLOKNNE-UHFFFAOYSA-N 1 1 296.823 3.751 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@@H](C)c2ccccn2)c1O ZINC000182066854 1126865805 /nfs/dbraw/zinc/86/58/05/1126865805.db2.gz QKPABYQMIQUOFS-LBPRGKRZSA-N 1 1 290.794 3.942 20 10 CHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2cc(C)ccc2O)cs1 ZINC000189940941 1126937289 /nfs/dbraw/zinc/93/72/89/1126937289.db2.gz PCQJHBMVDRQZPB-OAHLLOKOSA-N 1 1 288.416 3.803 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Br)ccc1O ZINC000133737983 1127017869 /nfs/dbraw/zinc/01/78/69/1127017869.db2.gz KUFSYTCQYDTVBE-WDEREUQCSA-N 1 1 298.224 3.775 20 10 CHCDMO CC[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(N(C)C)cc1 ZINC000271429317 1127080941 /nfs/dbraw/zinc/08/09/41/1127080941.db2.gz AWFGVTZZPMBLSK-SJORKVTESA-N 1 1 298.434 3.594 20 10 CHCDMO Cc1ccc(O)c(CNc2c(C)cc([NH+](C)C)cc2C)c1 ZINC000760631282 1127081292 /nfs/dbraw/zinc/08/12/92/1127081292.db2.gz BOJKDMOWOBUEGS-UHFFFAOYSA-N 1 1 284.403 3.996 20 10 CHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)cc1 ZINC000271436418 1127081683 /nfs/dbraw/zinc/08/16/83/1127081683.db2.gz BQFCUQXAGVXDIE-GUYCJALGSA-N 1 1 298.434 3.594 20 10 CHCDMO Cc1cccnc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000271574179 1127093270 /nfs/dbraw/zinc/09/32/70/1127093270.db2.gz UPSZQGMHICUBCT-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078162 1131046377 /nfs/dbraw/zinc/04/63/77/1131046377.db2.gz OSJLFFSSFZUMGK-VIFPVBQESA-N 1 1 274.191 3.931 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078162 1131046384 /nfs/dbraw/zinc/04/63/84/1131046384.db2.gz OSJLFFSSFZUMGK-VIFPVBQESA-N 1 1 274.191 3.931 20 10 CHCDMO C[N@@H+](Cc1cc(C(F)(F)F)ccc1O)CC(C)(C)C ZINC001237139854 1131057198 /nfs/dbraw/zinc/05/71/98/1131057198.db2.gz QDOAPKGBBTYJTI-UHFFFAOYSA-N 1 1 275.314 3.889 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000284016703 1127169986 /nfs/dbraw/zinc/16/99/86/1127169986.db2.gz HXVXPPMESBQCPZ-HKUYNNGSSA-N 1 1 297.398 3.689 20 10 CHCDMO [O-]c1cc(Cl)c(F)cc1CN1CCCC[C@@H](F)C1 ZINC001237934553 1131153928 /nfs/dbraw/zinc/15/39/28/1131153928.db2.gz KNHDSMXRLIOPOX-SNVBAGLBSA-N 1 1 275.726 3.509 20 10 CHCDMO C[N@H+](Cc1cccs1)Cc1cc(F)c(Cl)cc1O ZINC001237937750 1131154091 /nfs/dbraw/zinc/15/40/91/1131154091.db2.gz UPMDUKNZKSSMES-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1cc(F)c(Cl)cc1O ZINC001237937750 1131154096 /nfs/dbraw/zinc/15/40/96/1131154096.db2.gz UPMDUKNZKSSMES-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO C[C@]1(F)CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237934706 1131154137 /nfs/dbraw/zinc/15/41/37/1131154137.db2.gz NFJDYCWHGRWYOZ-ZDUSSCGKSA-N 1 1 275.726 3.509 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000057535366 1127263154 /nfs/dbraw/zinc/26/31/54/1127263154.db2.gz HFEICHDYJJYCTM-ZDUSSCGKSA-N 1 1 287.325 3.783 20 10 CHCDMO COCC(C)(C)CCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000286934333 1127275663 /nfs/dbraw/zinc/27/56/63/1127275663.db2.gz GKPDPKFXJRZTMF-GFCCVEGCSA-N 1 1 283.387 3.635 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001308694612 1127430768 /nfs/dbraw/zinc/43/07/68/1127430768.db2.gz LNARPPULAITYHB-LBPRGKRZSA-N 1 1 282.378 3.653 20 10 CHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c1O ZINC000294050997 1127545375 /nfs/dbraw/zinc/54/53/75/1127545375.db2.gz WZMBGAKWXKMAHF-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1cccc(CNc2cccc(C3CC3)[nH+]2)c1O ZINC000294063235 1127546147 /nfs/dbraw/zinc/54/61/47/1127546147.db2.gz XXFXGWSALPVJPS-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C(C)C)c1O ZINC000228606806 1127572156 /nfs/dbraw/zinc/57/21/56/1127572156.db2.gz XVRBCTIZXDRJQT-CYBMUJFWSA-N 1 1 283.799 3.675 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121195 1127650623 /nfs/dbraw/zinc/65/06/23/1127650623.db2.gz WEZAQJGVAMVYNT-MFKMUULPSA-N 1 1 283.799 3.817 20 10 CHCDMO COc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC001232267443 1127653893 /nfs/dbraw/zinc/65/38/93/1127653893.db2.gz BXPNENKLGCLAPQ-PHIMTYICSA-N 1 1 283.799 3.532 20 10 CHCDMO CC[C@H]([NH2+]CCC(C)(F)F)c1ccc(F)cc1O ZINC000297379748 1127694519 /nfs/dbraw/zinc/69/45/19/1127694519.db2.gz QYHJYSUPURNYMU-NSHDSACASA-N 1 1 261.287 3.617 20 10 CHCDMO C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccc(F)cc1O ZINC000062748474 1127773689 /nfs/dbraw/zinc/77/36/89/1127773689.db2.gz KFAOWULNLYWXSE-SNVBAGLBSA-N 1 1 295.304 3.703 20 10 CHCDMO CCC[N@@H+](CCC(=O)c1ccccc1)Cc1ccccc1O ZINC000777594353 1128167440 /nfs/dbraw/zinc/16/74/40/1128167440.db2.gz NMPZEHWOCVFKQL-UHFFFAOYSA-N 1 1 297.398 3.877 20 10 CHCDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785174 1128244533 /nfs/dbraw/zinc/24/45/33/1128244533.db2.gz RIUPUGBZQJNYNI-CXAGYDPISA-N 1 1 273.420 3.891 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCC2(CCC2)O1)c1ccc(F)cc1O ZINC000927009031 1128207527 /nfs/dbraw/zinc/20/75/27/1128207527.db2.gz BPRQRSYJXCUOHZ-GXTWGEPZSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC3(CCC3)C[C@@H]2C)cc1C ZINC000762146155 1128273260 /nfs/dbraw/zinc/27/32/60/1128273260.db2.gz VEWVNZQSFPLMIL-AWEZNQCLSA-N 1 1 259.393 3.774 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000915790580 1128338237 /nfs/dbraw/zinc/33/82/37/1128338237.db2.gz WCLQOXGISXLBSS-GFCCVEGCSA-N 1 1 277.408 3.627 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1F ZINC000777967750 1128352655 /nfs/dbraw/zinc/35/26/55/1128352655.db2.gz ZAMAMLSNMCDXTO-RISCZKNCSA-N 1 1 295.398 3.575 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]1c1ccccc1)CCC2 ZINC000917446487 1128500044 /nfs/dbraw/zinc/50/00/44/1128500044.db2.gz VHZDCZMWPSWSPU-SFHVURJKSA-N 1 1 279.383 3.828 20 10 CHCDMO Oc1ccccc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000154719741 1128544690 /nfs/dbraw/zinc/54/46/90/1128544690.db2.gz FWHIRBAHWSSLMD-UHFFFAOYSA-N 1 1 283.327 3.781 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000158027548 1128663387 /nfs/dbraw/zinc/66/33/87/1128663387.db2.gz BLTMXCTTXHQDQU-MRXNPFEDSA-N 1 1 267.372 3.690 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000778995442 1128674479 /nfs/dbraw/zinc/67/44/79/1128674479.db2.gz RSTWTODCVHHRPT-CYBMUJFWSA-N 1 1 253.345 3.512 20 10 CHCDMO CC[N@@H+](CCc1ccccc1)Cc1cc(F)ccc1O ZINC000778996987 1128675605 /nfs/dbraw/zinc/67/56/05/1128675605.db2.gz YIHRTJGCDFPEFP-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO Cc1ccccc1C[N@@H+](Cc1ccccc1O)C1CC1 ZINC000778996435 1128675795 /nfs/dbraw/zinc/67/57/95/1128675795.db2.gz OMRASWCSAAMHLK-UHFFFAOYSA-N 1 1 267.372 3.865 20 10 CHCDMO C[C@@H]([NH2+]CCc1c(F)cccc1F)c1ccc(F)cc1O ZINC000185067650 1117759416 /nfs/dbraw/zinc/75/94/16/1117759416.db2.gz OMEWLELCFFRPOW-SNVBAGLBSA-N 1 1 295.304 3.703 20 10 CHCDMO C[C@@H]([NH2+]CCCNc1ccccc1)c1ccc(F)cc1O ZINC000185489413 1117828238 /nfs/dbraw/zinc/82/82/38/1117828238.db2.gz GDAAGMDVZCCAAP-CYBMUJFWSA-N 1 1 288.366 3.684 20 10 CHCDMO C[C@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccc(F)cc1O ZINC000185828821 1117914018 /nfs/dbraw/zinc/91/40/18/1117914018.db2.gz OVALGMWJBABYKU-LRDDRELGSA-N 1 1 295.398 3.513 20 10 CHCDMO C[N@H+](Cc1ccsc1)Cc1c(O)cccc1Cl ZINC000120476204 1117921879 /nfs/dbraw/zinc/92/18/79/1117921879.db2.gz HRUUPHVLVBRIHL-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO C[N@@H+](Cc1ccsc1)Cc1c(O)cccc1Cl ZINC000120476204 1117921882 /nfs/dbraw/zinc/92/18/82/1117921882.db2.gz HRUUPHVLVBRIHL-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000179596669 1128748560 /nfs/dbraw/zinc/74/85/60/1128748560.db2.gz FSDHSAJBDUMLGY-AWEZNQCLSA-N 1 1 255.361 3.894 20 10 CHCDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179568938 1128748690 /nfs/dbraw/zinc/74/86/90/1128748690.db2.gz QVGPOCOVRNFJMT-INIZCTEOSA-N 1 1 283.371 3.738 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000211517717 1118069660 /nfs/dbraw/zinc/06/96/60/1118069660.db2.gz NKLVXSIRSZVNIU-LLVKDONJSA-N 1 1 253.773 3.668 20 10 CHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179664438 1128753864 /nfs/dbraw/zinc/75/38/64/1128753864.db2.gz JXJIDMODUSWZAU-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO CCC[N@@H+](CCCc1ccncc1)Cc1ccccc1O ZINC000764960197 1118128142 /nfs/dbraw/zinc/12/81/42/1118128142.db2.gz LFEFGDSPCPOWFP-UHFFFAOYSA-N 1 1 284.403 3.632 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](C)CC(F)F)c1ccc(F)cc1O ZINC000842892326 1118158132 /nfs/dbraw/zinc/15/81/32/1118158132.db2.gz AYRJCWUZAQCUCA-BXKDBHETSA-N 1 1 275.314 3.863 20 10 CHCDMO CC[C@@H](NCC[N@@H+](C)[C@@H](C)CC)c1ccc(N(C)C)cc1 ZINC000765657140 1118188011 /nfs/dbraw/zinc/18/80/11/1118188011.db2.gz VVBXLNISASITFZ-MAUKXSAKSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](NCC[N@H+](C)[C@@H](C)CC)c1ccc(N(C)C)cc1 ZINC000765657140 1118188014 /nfs/dbraw/zinc/18/80/14/1118188014.db2.gz VVBXLNISASITFZ-MAUKXSAKSA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC001140181947 1118246647 /nfs/dbraw/zinc/24/66/47/1118246647.db2.gz XXUSRHARAXGKIM-LSDHHAIUSA-N 1 1 259.393 3.631 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000179934858 1128767432 /nfs/dbraw/zinc/76/74/32/1128767432.db2.gz BPMFOJMTGPBLPA-CQSZACIVSA-N 1 1 271.335 3.521 20 10 CHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179955155 1128769135 /nfs/dbraw/zinc/76/91/35/1128769135.db2.gz FFHPLQQEPSKFCA-MRXNPFEDSA-N 1 1 297.398 3.699 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1Cl)CC1(O)CCCCCC1 ZINC000779204463 1128787245 /nfs/dbraw/zinc/78/72/45/1128787245.db2.gz SSCDIWBMHIEQJL-UHFFFAOYSA-N 1 1 297.826 3.563 20 10 CHCDMO C[C@@H]1CCCC[N@H+]1Cc1c(O)cccc1Br ZINC000707135419 1118641559 /nfs/dbraw/zinc/64/15/59/1118641559.db2.gz SITMCVRUCZPDMH-SNVBAGLBSA-N 1 1 284.197 3.529 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1c(O)cccc1Br ZINC000707138800 1118642631 /nfs/dbraw/zinc/64/26/31/1118642631.db2.gz HODGWVMYVMZYHB-QWRGUYRKSA-N 1 1 298.224 3.918 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Br)[C@@H](C)[C@H]1C ZINC000707138843 1118643729 /nfs/dbraw/zinc/64/37/29/1118643729.db2.gz IDDACCIGBWYJTL-VWYCJHECSA-N 1 1 298.224 3.631 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707147316 1118648453 /nfs/dbraw/zinc/64/84/53/1118648453.db2.gz YHBHIUDHHFLRGD-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Br)CC1 ZINC000707153051 1118650751 /nfs/dbraw/zinc/65/07/51/1118650751.db2.gz SZJUFIGYKWLYLM-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2ccc(Cl)cc2O)CC1 ZINC001140461922 1118720493 /nfs/dbraw/zinc/72/04/93/1118720493.db2.gz YJPYOBZMHJIMLO-CQSZACIVSA-N 1 1 271.763 3.760 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1F ZINC000091974508 1118952809 /nfs/dbraw/zinc/95/28/09/1118952809.db2.gz ZDSULDSEXDANEN-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1cccnc1 ZINC000076074097 1119182573 /nfs/dbraw/zinc/18/25/73/1119182573.db2.gz MNLFLESVBWUFOP-CQSZACIVSA-N 1 1 270.376 3.760 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cccc(F)c2[O-])C1 ZINC000708442163 1119467005 /nfs/dbraw/zinc/46/70/05/1119467005.db2.gz DOJJSMGFIVDNIT-ZDUSSCGKSA-N 1 1 265.372 3.789 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC000708442163 1119467006 /nfs/dbraw/zinc/46/70/06/1119467006.db2.gz DOJJSMGFIVDNIT-ZDUSSCGKSA-N 1 1 265.372 3.789 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000708442163 1119467009 /nfs/dbraw/zinc/46/70/09/1119467009.db2.gz DOJJSMGFIVDNIT-ZDUSSCGKSA-N 1 1 265.372 3.789 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@H]2C(C)C)c([O-])c1Cl ZINC001236805669 1128895432 /nfs/dbraw/zinc/89/54/32/1128895432.db2.gz DPRUHSXTBLWUSM-LBPRGKRZSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1ccc(C[N@@H+]2CCC[C@H]2C(C)C)c(O)c1Cl ZINC001236805669 1128895436 /nfs/dbraw/zinc/89/54/36/1128895436.db2.gz DPRUHSXTBLWUSM-LBPRGKRZSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@H]2C(C)C)c(O)c1Cl ZINC001236805669 1128895440 /nfs/dbraw/zinc/89/54/40/1128895440.db2.gz DPRUHSXTBLWUSM-LBPRGKRZSA-N 1 1 283.799 3.675 20 10 CHCDMO Cc1ccc([C@H](C)NCC[NH+](C(C)C)C(C)C)c(O)c1C ZINC000756374109 1120276930 /nfs/dbraw/zinc/27/69/30/1120276930.db2.gz XXPSMGQDHDQHGD-INIZCTEOSA-N 1 1 292.467 3.778 20 10 CHCDMO CCCC(O)(CCC)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185500737 1120378005 /nfs/dbraw/zinc/37/80/05/1120378005.db2.gz VJHCHFPVTKUKPV-GFCCVEGCSA-N 1 1 283.387 3.513 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cccc(C)c3C2)c1O ZINC000763502105 1128912852 /nfs/dbraw/zinc/91/28/52/1128912852.db2.gz HEODXUZIOUFJOH-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(F)cc1O ZINC000695731478 1120414014 /nfs/dbraw/zinc/41/40/14/1120414014.db2.gz SWBZYZRBEABSJI-NSHDSACASA-N 1 1 263.356 3.905 20 10 CHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)on1 ZINC000053420221 1120495432 /nfs/dbraw/zinc/49/54/32/1120495432.db2.gz JRUFXBWFMXQJFX-UHFFFAOYSA-N 1 1 299.418 3.605 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)on1 ZINC000053420221 1120495435 /nfs/dbraw/zinc/49/54/35/1120495435.db2.gz JRUFXBWFMXQJFX-UHFFFAOYSA-N 1 1 299.418 3.605 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1C ZINC000024980202 1120528681 /nfs/dbraw/zinc/52/86/81/1120528681.db2.gz YHRNBHMMIVSVSP-UHFFFAOYSA-N 1 1 298.430 3.707 20 10 CHCDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000093558707 1120822554 /nfs/dbraw/zinc/82/25/54/1120822554.db2.gz NAQMNWPJWLRFPB-ZDUSSCGKSA-N 1 1 267.438 3.582 20 10 CHCDMO Cc1[nH+]ccn1CCCN(C)c1ccc(OC(C)C)cc1 ZINC000759933669 1120899296 /nfs/dbraw/zinc/89/92/96/1120899296.db2.gz OIIRLUWRYDUYAN-UHFFFAOYSA-N 1 1 287.407 3.505 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1ccc(F)cc1O ZINC000094322629 1120999964 /nfs/dbraw/zinc/99/99/64/1120999964.db2.gz FYIJSJQKKNLSFU-IINYFYTJSA-N 1 1 251.345 3.761 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001237077814 1128964507 /nfs/dbraw/zinc/96/45/07/1128964507.db2.gz KJVQZDMWFARTQD-NXEZZACHSA-N 1 1 286.202 3.931 20 10 CHCDMO C[C@H]1CSCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000192180406 1128974280 /nfs/dbraw/zinc/97/42/80/1128974280.db2.gz LUKWZUZNSUDZMF-CYBMUJFWSA-N 1 1 287.428 3.730 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706225412 1121421218 /nfs/dbraw/zinc/42/12/18/1121421218.db2.gz IWFINHNGSNCMRB-NWDGAFQWSA-N 1 1 263.356 3.762 20 10 CHCDMO C[C@H](c1cccs1)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC000893947247 1121445527 /nfs/dbraw/zinc/44/55/27/1121445527.db2.gz VKZXXVJVXOOXNM-SECBINFHSA-N 1 1 283.343 3.925 20 10 CHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000893947247 1121445532 /nfs/dbraw/zinc/44/55/32/1121445532.db2.gz VKZXXVJVXOOXNM-SECBINFHSA-N 1 1 283.343 3.925 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000708485197 1121468545 /nfs/dbraw/zinc/46/85/45/1121468545.db2.gz JDPQWOXHOPUFNO-INIZCTEOSA-N 1 1 259.393 3.937 20 10 CHCDMO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccc(F)cc1O ZINC000688501493 1129004228 /nfs/dbraw/zinc/00/42/28/1129004228.db2.gz JPLTWYZSCKYWPT-SECBINFHSA-N 1 1 273.298 3.760 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000255956305 1121715697 /nfs/dbraw/zinc/71/56/97/1121715697.db2.gz GUGHSWIFABWSIF-ZIAGYGMSSA-N 1 1 291.435 3.607 20 10 CHCDMO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232709 1121828553 /nfs/dbraw/zinc/82/85/53/1121828553.db2.gz IVIMJUAQMROBND-UKRRQHHQSA-N 1 1 286.394 3.838 20 10 CHCDMO CC[C@@](C)([NH2+]Cc1c(O)ccc(Cl)c1F)C1CC1 ZINC001179183486 1121854042 /nfs/dbraw/zinc/85/40/42/1121854042.db2.gz KSKJPSFMAALMRU-CQSZACIVSA-N 1 1 271.763 3.853 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CCCC[C@@H]2C(C)C)c1O ZINC001179952863 1121930841 /nfs/dbraw/zinc/93/08/41/1121930841.db2.gz SWAZBAAAEAISRI-OAHLLOKOSA-N 1 1 277.408 3.720 20 10 CHCDMO CCN(C)c1ccc(C[NH2+][C@H](C)c2ncc(C)s2)cc1 ZINC000773839484 1121939312 /nfs/dbraw/zinc/93/93/12/1121939312.db2.gz NQMIAIKFQJCKOI-CYBMUJFWSA-N 1 1 289.448 3.758 20 10 CHCDMO CC(C)C[C@H]1CC[N@@H+](Cc2cc(F)c(F)cc2[O-])C1 ZINC001180267612 1121970518 /nfs/dbraw/zinc/97/05/18/1121970518.db2.gz YUTNHOKJHKSNCX-LLVKDONJSA-N 1 1 269.335 3.538 20 10 CHCDMO CC(C)C[C@H]1CC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001180267612 1121970525 /nfs/dbraw/zinc/97/05/25/1121970525.db2.gz YUTNHOKJHKSNCX-LLVKDONJSA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)c(F)cc2O)C[C@H]1C ZINC001180707275 1122009805 /nfs/dbraw/zinc/00/98/05/1122009805.db2.gz GRSREKDJRGKWTN-FOGDFJRCSA-N 1 1 269.335 3.585 20 10 CHCDMO CCc1cccc(C[N@H+]2CCc3c(cccc3OC)C2)c1O ZINC001180801138 1122017271 /nfs/dbraw/zinc/01/72/71/1122017271.db2.gz FVAYXYPNELUIRP-UHFFFAOYSA-N 1 1 297.398 3.522 20 10 CHCDMO C[C@@H]1CC[C@@H](C[NH2+]Cc2ccc(Cl)cc2O)C1 ZINC001181399746 1122053134 /nfs/dbraw/zinc/05/31/34/1122053134.db2.gz MBYXIZQUTFBDSU-GHMZBOCLSA-N 1 1 253.773 3.571 20 10 CHCDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001182044231 1122105924 /nfs/dbraw/zinc/10/59/24/1122105924.db2.gz VZWOWCMHJFVGIB-LLVKDONJSA-N 1 1 285.840 3.621 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000779604090 1129031880 /nfs/dbraw/zinc/03/18/80/1129031880.db2.gz FZJVDMOJJWWKRB-LBPRGKRZSA-N 1 1 263.356 3.543 20 10 CHCDMO CO[C@H](C)[C@H](C)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774376450 1122158045 /nfs/dbraw/zinc/15/80/45/1122158045.db2.gz YGQIEFWNUPGDGJ-XHNCKOQMSA-N 1 1 292.206 3.773 20 10 CHCDMO CC1=CCC[C@@H](C)[C@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC001183454573 1122224048 /nfs/dbraw/zinc/22/40/48/1122224048.db2.gz MHLFGBRQEDGYBA-HIFRSBDPSA-N 1 1 257.377 3.700 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@H]1CCc2c1cccc2F ZINC001183863279 1122245110 /nfs/dbraw/zinc/24/51/10/1122245110.db2.gz AUTZHWLLXYRKKW-HNNXBMFYSA-N 1 1 293.288 3.587 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H]3CSC[C@@]3(C)C2)c(Cl)c1 ZINC001184188489 1122257559 /nfs/dbraw/zinc/25/75/59/1122257559.db2.gz MQQASHWUSKRQEM-XHDPSFHLSA-N 1 1 297.851 3.539 20 10 CHCDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(Cl)ccc1O ZINC001203664383 1122432993 /nfs/dbraw/zinc/43/29/93/1122432993.db2.gz CHGPMEDKGCYMLY-LBPRGKRZSA-N 1 1 287.790 3.992 20 10 CHCDMO Cc1cc(C)cc(C[N@H+](C)Cc2cc(F)ccc2O)c1 ZINC000775147435 1122444245 /nfs/dbraw/zinc/44/42/45/1122444245.db2.gz BXEAQLVNVTWRPK-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645508 1122654842 /nfs/dbraw/zinc/65/48/42/1122654842.db2.gz NRIOPXPZMKGLTH-GDBMZVCRSA-N 1 1 260.425 3.824 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645510 1122654896 /nfs/dbraw/zinc/65/48/96/1122654896.db2.gz NRIOPXPZMKGLTH-HOCLYGCPSA-N 1 1 260.425 3.824 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000775641677 1122849900 /nfs/dbraw/zinc/84/99/00/1122849900.db2.gz DAWOOLDQAKDYOQ-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2cccc(Cl)c2)c1O ZINC000775642361 1122850435 /nfs/dbraw/zinc/85/04/35/1122850435.db2.gz FXBUUWGTGFLPES-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCn3cccc3[C@@H]2C)c1O ZINC000775643192 1122850878 /nfs/dbraw/zinc/85/08/78/1122850878.db2.gz NTDZUOAEKRIYQO-LBPRGKRZSA-N 1 1 290.794 3.732 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCn3cccc3[C@@H]2C)c1O ZINC000775643192 1122850882 /nfs/dbraw/zinc/85/08/82/1122850882.db2.gz NTDZUOAEKRIYQO-LBPRGKRZSA-N 1 1 290.794 3.732 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775642935 1122851279 /nfs/dbraw/zinc/85/12/79/1122851279.db2.gz PSDVCIYSXZAPLK-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc(OC)ccc1O ZINC000775652968 1122868147 /nfs/dbraw/zinc/86/81/47/1122868147.db2.gz XQPZSCJWRGQFHA-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775662566 1122875804 /nfs/dbraw/zinc/87/58/04/1122875804.db2.gz YLGPHECDWSDDLN-UHFFFAOYSA-N 1 1 279.767 3.887 20 10 CHCDMO Cc1cc(Cl)cc(C[NH+]2Cc3ccccc3C2)c1O ZINC000775680763 1122902169 /nfs/dbraw/zinc/90/21/69/1122902169.db2.gz IMEHRBIOHMQSMB-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1O ZINC000775686555 1122908304 /nfs/dbraw/zinc/90/83/04/1122908304.db2.gz KLHMLAHHZHEZQG-CQSZACIVSA-N 1 1 285.362 3.829 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1O ZINC000775690578 1122911065 /nfs/dbraw/zinc/91/10/65/1122911065.db2.gz PQIAOWKWFNUTCJ-HNNXBMFYSA-N 1 1 285.362 3.829 20 10 CHCDMO Cc1cccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1O ZINC000775701319 1122912159 /nfs/dbraw/zinc/91/21/59/1122912159.db2.gz KICDQJHAJIBREY-FMKPAKJESA-N 1 1 259.393 3.854 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2C[C@@H](C)CC2(C)C)cc1 ZINC001197360111 1122954282 /nfs/dbraw/zinc/95/42/82/1122954282.db2.gz UWZNKLBMLFQNAF-AWEZNQCLSA-N 1 1 260.425 3.763 20 10 CHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H](C)CO ZINC000776002605 1123035091 /nfs/dbraw/zinc/03/50/91/1123035091.db2.gz GGWQZZKIGGHXHD-JKSUJKDBSA-N 1 1 299.414 3.584 20 10 CHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)ccc1O ZINC000776012506 1123035945 /nfs/dbraw/zinc/03/59/45/1123035945.db2.gz HFNQRRYJXWAIKQ-CABZTGNLSA-N 1 1 291.288 3.694 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@@H]2CCCOC2)cc1C(C)C ZINC000107671976 1123225611 /nfs/dbraw/zinc/22/56/11/1123225611.db2.gz BUIPCDCQXWGIOZ-HNNXBMFYSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000850541007 1123288342 /nfs/dbraw/zinc/28/83/42/1123288342.db2.gz UEOJXHCBLRHXDU-NOZJJQNGSA-N 1 1 253.773 3.885 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(F)cc1O ZINC000850551817 1123289945 /nfs/dbraw/zinc/28/99/45/1123289945.db2.gz KAZYLZHCDKPRDC-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO COc1ccc(O)c([C@@H](C)[NH2+]CC(F)(F)C(C)(C)C)c1 ZINC000850573006 1123295049 /nfs/dbraw/zinc/29/50/49/1123295049.db2.gz SCDQVNFCBIFISO-SNVBAGLBSA-N 1 1 287.350 3.733 20 10 CHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C2CCCC2)co1 ZINC000851771573 1123379492 /nfs/dbraw/zinc/37/94/92/1123379492.db2.gz JBFVAKRDAWXQHO-UHFFFAOYSA-N 1 1 286.375 3.633 20 10 CHCDMO C[N@@H+](CCOc1ccccc1Cl)Cc1ccccc1O ZINC000111235159 1123432464 /nfs/dbraw/zinc/43/24/64/1123432464.db2.gz NWGUHOCLYFECAQ-UHFFFAOYSA-N 1 1 291.778 3.556 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@H](CCF)C1 ZINC000853564206 1123444213 /nfs/dbraw/zinc/44/42/13/1123444213.db2.gz KNTAGFFXMLIZMP-CYBMUJFWSA-N 1 1 288.366 3.512 20 10 CHCDMO CC[N@@H+](CCc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000729542449 1123486125 /nfs/dbraw/zinc/48/61/25/1123486125.db2.gz GDCBFAOLFMLNOH-UHFFFAOYSA-N 1 1 288.460 3.879 20 10 CHCDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000857082696 1123586023 /nfs/dbraw/zinc/58/60/23/1123586023.db2.gz XAZKRQQEIJFKAM-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)C3CCCC3)c2c1 ZINC000194571952 1129135290 /nfs/dbraw/zinc/13/52/90/1129135290.db2.gz IVHBEGIYUZNMNQ-UHFFFAOYSA-N 1 1 285.387 3.928 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc2ccccc2c1O ZINC000194990374 1129140594 /nfs/dbraw/zinc/14/05/94/1129140594.db2.gz JVNWZBGSDUMWSJ-LSDHHAIUSA-N 1 1 298.430 3.538 20 10 CHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000896953249 1123792773 /nfs/dbraw/zinc/79/27/73/1123792773.db2.gz WPVAJXQCFYQCHA-SCZZXKLOSA-N 1 1 289.803 3.558 20 10 CHCDMO CCC[N@@H+](Cc1cnc(C2CC2)o1)Cc1ccccc1O ZINC000862236872 1123794154 /nfs/dbraw/zinc/79/41/54/1123794154.db2.gz FNOQJGWOJIULGG-UHFFFAOYSA-N 1 1 286.375 3.670 20 10 CHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000862239193 1123794682 /nfs/dbraw/zinc/79/46/82/1123794682.db2.gz YRSKCCXCBCZWBM-CYBMUJFWSA-N 1 1 296.208 3.529 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)nc1C ZINC000840782922 1123797926 /nfs/dbraw/zinc/79/79/26/1123797926.db2.gz GFDLZHPCQJASEV-LLVKDONJSA-N 1 1 292.329 3.533 20 10 CHCDMO Oc1cccc(Br)c1C[N@H+]1CCCC2(CC2)C1 ZINC000862328190 1123799991 /nfs/dbraw/zinc/79/99/91/1123799991.db2.gz MCLARKRKPITBBO-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO CC(=O)[C@H]1CC[N@@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859021 1123855195 /nfs/dbraw/zinc/85/51/95/1123855195.db2.gz FLBIGBFEHBMDSW-KRWDZBQOSA-N 1 1 296.414 3.505 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000840938337 1124030943 /nfs/dbraw/zinc/03/09/43/1124030943.db2.gz BUZLUEWECXVWEB-OAHLLOKOSA-N 1 1 283.419 3.649 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]CCc1ccccc1Cl ZINC001648973070 1124039908 /nfs/dbraw/zinc/03/99/08/1124039908.db2.gz CEWDGMSKVFNEBV-UHFFFAOYSA-N 1 1 297.732 3.656 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(Cl)cc1O ZINC000866403883 1124063487 /nfs/dbraw/zinc/06/34/87/1124063487.db2.gz SLDHLVWHHLXMKI-WDEREUQCSA-N 1 1 285.840 3.839 20 10 CHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000122884436 1124544005 /nfs/dbraw/zinc/54/40/05/1124544005.db2.gz ASXAVKXZOQKKFU-ZDUSSCGKSA-N 1 1 289.448 3.758 20 10 CHCDMO CC(C)OC1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CCC1 ZINC000872116597 1124687061 /nfs/dbraw/zinc/68/70/61/1124687061.db2.gz TXDBZYYLDCECIF-LBPRGKRZSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000124296766 1124733222 /nfs/dbraw/zinc/73/32/22/1124733222.db2.gz HDRIOQCMHDMENF-HNNXBMFYSA-N 1 1 258.409 3.661 20 10 CHCDMO Cc1ccc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)c(O)c1 ZINC000877343168 1125023373 /nfs/dbraw/zinc/02/33/73/1125023373.db2.gz VXDAANLUIBIBSB-PBHICJAKSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)c(O)c1 ZINC000877343170 1125024965 /nfs/dbraw/zinc/02/49/65/1125024965.db2.gz VXDAANLUIBIBSB-RHSMWYFYSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000877548694 1125042486 /nfs/dbraw/zinc/04/24/86/1125042486.db2.gz RIUVIMCIOMSHFK-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO CC(C)O[C@H](C[N@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877703205 1125066279 /nfs/dbraw/zinc/06/62/79/1125066279.db2.gz WDJCZMFFBDAWIR-LJQANCHMSA-N 1 1 297.398 3.874 20 10 CHCDMO C[C@@H]([NH2+]Cc1scnc1Cl)c1ccc(N(C)C)cc1 ZINC000878454489 1125155405 /nfs/dbraw/zinc/15/54/05/1125155405.db2.gz DDRWKQMHZSUUES-SNVBAGLBSA-N 1 1 295.839 3.713 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c1O ZINC000127579174 1125202517 /nfs/dbraw/zinc/20/25/17/1125202517.db2.gz LVSXDCKMRQSJHT-PBHICJAKSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130667632 1125366111 /nfs/dbraw/zinc/36/61/11/1125366111.db2.gz CZCYRQQWZGTWTL-KXBFYZLASA-N 1 1 297.398 3.663 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)c1O ZINC000130808483 1125369189 /nfs/dbraw/zinc/36/91/89/1125369189.db2.gz JJSIZSUGHFRTIP-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO COc1ccc(C[NH2+]Cc2cc(O)ccc2Cl)cc1C ZINC000883325112 1125397279 /nfs/dbraw/zinc/39/72/79/1125397279.db2.gz OUCUBYWQWQXWOI-UHFFFAOYSA-N 1 1 291.778 3.652 20 10 CHCDMO C[C@H]([N@H+](C)Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000132557336 1125419973 /nfs/dbraw/zinc/41/99/73/1125419973.db2.gz AHFDZYKACLWTKI-JTQLQIEISA-N 1 1 255.789 3.912 20 10 CHCDMO C[C@H]([N@@H+](C)Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000132557336 1125419974 /nfs/dbraw/zinc/41/99/74/1125419974.db2.gz AHFDZYKACLWTKI-JTQLQIEISA-N 1 1 255.789 3.912 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)c1 ZINC000245700140 1129218968 /nfs/dbraw/zinc/21/89/68/1129218968.db2.gz CZCYRQQWZGTWTL-DNVCBOLYSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1cc(C[N@H+]2CCc3ccccc3C2)ccc1N(C)C ZINC001139670129 1131359220 /nfs/dbraw/zinc/35/92/20/1131359220.db2.gz XHFAMOAORKOACP-UHFFFAOYSA-N 1 1 280.415 3.619 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)c1O ZINC000245871439 1129230530 /nfs/dbraw/zinc/23/05/30/1129230530.db2.gz RQYPLEIQMWUURB-MAUKXSAKSA-N 1 1 297.398 3.663 20 10 CHCDMO C[C@H]1CC[C@H](C)[NH+]1Cc1cccc(Br)c1O ZINC000091937698 1129375347 /nfs/dbraw/zinc/37/53/47/1129375347.db2.gz QGKPYFRTWHJHFT-UWVGGRQHSA-N 1 1 284.197 3.528 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000738225549 1129390770 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ZINC001237487377 1131104302 /nfs/dbraw/zinc/10/43/02/1131104302.db2.gz IFRYMNGHPBAQLB-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC001237492077 1131104375 /nfs/dbraw/zinc/10/43/75/1131104375.db2.gz OGVYLTXROLCEPD-UHFFFAOYSA-N 1 1 281.399 3.994 20 10 CHCDMO CC(C)(C)CC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816533130 1131105542 /nfs/dbraw/zinc/10/55/42/1131105542.db2.gz KAYWXYJGLWZOLR-UHFFFAOYSA-N 1 1 259.752 3.711 20 10 CHCDMO C[C@H](Cc1cccs1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816532632 1131105717 /nfs/dbraw/zinc/10/57/17/1131105717.db2.gz PKUKKHNTFAOCJH-SECBINFHSA-N 1 1 299.798 3.967 20 10 CHCDMO C[N@H+](CCNCc1ccc2ccccc2c1O)C1CCCC1 ZINC000816547755 1131106878 /nfs/dbraw/zinc/10/68/78/1131106878.db2.gz IAMCACWKFBOYEC-UHFFFAOYSA-N 1 1 298.430 3.509 20 10 CHCDMO C[N@@H+](CCNCc1ccc2ccccc2c1O)C1CCCC1 ZINC000816547755 1131106880 /nfs/dbraw/zinc/10/68/80/1131106880.db2.gz IAMCACWKFBOYEC-UHFFFAOYSA-N 1 1 298.430 3.509 20 10 CHCDMO CC(C)(C)SCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816547624 1131107207 /nfs/dbraw/zinc/10/72/07/1131107207.db2.gz BYFQUOHVDCKXSR-UHFFFAOYSA-N 1 1 291.819 3.806 20 10 CHCDMO C[C@@H]1CSCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816591980 1131109898 /nfs/dbraw/zinc/10/98/98/1131109898.db2.gz TUTFWQGTCUIMPL-ZDUSSCGKSA-N 1 1 287.428 3.730 20 10 CHCDMO C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816554790 1131110255 /nfs/dbraw/zinc/11/02/55/1131110255.db2.gz JDZADDBOOUGMMO-IAGOWNOFSA-N 1 1 298.430 3.508 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C[C@H](C2CC2)O1 ZINC000816594518 1131110328 /nfs/dbraw/zinc/11/03/28/1131110328.db2.gz HBVIFPMINIQMRZ-SCLBCKFNSA-N 1 1 297.398 3.545 20 10 CHCDMO Cc1ccsc1CC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816560277 1131111351 /nfs/dbraw/zinc/11/13/51/1131111351.db2.gz KGXKFOMZWHXVIW-UHFFFAOYSA-N 1 1 299.798 3.887 20 10 CHCDMO CC(C)CSCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816559200 1131111407 /nfs/dbraw/zinc/11/14/07/1131111407.db2.gz BJNPMLGNXCXOHD-UHFFFAOYSA-N 1 1 291.819 3.664 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCCCS1 ZINC000816566974 1131112551 /nfs/dbraw/zinc/11/25/51/1131112551.db2.gz MWCDVJAUMIFCPI-SNVBAGLBSA-N 1 1 289.803 3.560 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000816615509 1131116589 /nfs/dbraw/zinc/11/65/89/1131116589.db2.gz YDWNRMMMHBANMF-HNNXBMFYSA-N 1 1 295.785 3.949 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000816615509 1131116591 /nfs/dbraw/zinc/11/65/91/1131116591.db2.gz YDWNRMMMHBANMF-HNNXBMFYSA-N 1 1 295.785 3.949 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@](C)(CF)C2)c1O ZINC001237682078 1131126828 /nfs/dbraw/zinc/12/68/28/1131126828.db2.gz XIZYAZCLNPDMNR-CQSZACIVSA-N 1 1 271.763 3.536 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C(C)C)c1O ZINC001237689884 1131128131 /nfs/dbraw/zinc/12/81/31/1131128131.db2.gz RIOREIJSKPZVIS-CQSZACIVSA-N 1 1 267.800 3.974 20 10 CHCDMO [O-]c1c(Cl)cc(F)cc1C[N@H+]1CCc2ccsc2C1 ZINC001237798237 1131140741 /nfs/dbraw/zinc/14/07/41/1131140741.db2.gz BYXNPUYLCFRLCZ-UHFFFAOYSA-N 1 1 297.782 3.805 20 10 CHCDMO [O-]c1c(Cl)cc(F)cc1CN1CCc2ccsc2C1 ZINC001237798237 1131140745 /nfs/dbraw/zinc/14/07/45/1131140745.db2.gz BYXNPUYLCFRLCZ-UHFFFAOYSA-N 1 1 297.782 3.805 20 10 CHCDMO CCCC[N@@H+](CC)Cc1ccc(N2CCCC2)cc1 ZINC001116438592 1131145459 /nfs/dbraw/zinc/14/54/59/1131145459.db2.gz ITNWQRVVHXYKJL-UHFFFAOYSA-N 1 1 260.425 3.909 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])[C@@H](C)C1 ZINC001237936580 1131152638 /nfs/dbraw/zinc/15/26/38/1131152638.db2.gz KPBCSRGMOGNYDQ-UWVGGRQHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2O)[C@@H](C)C1 ZINC001237936580 1131152641 /nfs/dbraw/zinc/15/26/41/1131152641.db2.gz KPBCSRGMOGNYDQ-UWVGGRQHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2O)[C@@H](C)C1 ZINC001237936580 1131152643 /nfs/dbraw/zinc/15/26/43/1131152643.db2.gz KPBCSRGMOGNYDQ-UWVGGRQHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237937750 1131154090 /nfs/dbraw/zinc/15/40/90/1131154090.db2.gz UPMDUKNZKSSMES-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+](C)CCc2ccccc2)c1O ZINC001238059022 1131165267 /nfs/dbraw/zinc/16/52/67/1131165267.db2.gz YBFJJKBAGSXYJW-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001238057402 1131165740 /nfs/dbraw/zinc/16/57/40/1131165740.db2.gz KPJKTCICHCTCAT-LLVKDONJSA-N 1 1 287.325 3.707 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001238059356 1131166473 /nfs/dbraw/zinc/16/64/73/1131166473.db2.gz CFIJXDOPNNRCTM-UHFFFAOYSA-N 1 1 287.325 3.707 20 10 CHCDMO Cc1cc(F)cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC001238067377 1131166759 /nfs/dbraw/zinc/16/67/59/1131166759.db2.gz SUUUVFQHOZVVDU-QGZVFWFLSA-N 1 1 285.362 3.959 20 10 CHCDMO C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000817976625 1131193949 /nfs/dbraw/zinc/19/39/49/1131193949.db2.gz PTJJDSYEZBJCEL-KBPBESRZSA-N 1 1 286.419 3.714 20 10 CHCDMO C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817981487 1131194980 /nfs/dbraw/zinc/19/49/80/1131194980.db2.gz SCWIJEHWQUVKJJ-GOEBONIOSA-N 1 1 298.430 3.728 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817981485 1131195092 /nfs/dbraw/zinc/19/50/92/1131195092.db2.gz SCWIJEHWQUVKJJ-GDBMZVCRSA-N 1 1 298.430 3.728 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc(F)cc1O ZINC000168860664 1131199831 /nfs/dbraw/zinc/19/98/31/1131199831.db2.gz JSAZKOLLTZJRIW-PWSUYJOCSA-N 1 1 251.345 3.761 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCSc2ccccc2C1 ZINC001137840066 1131421745 /nfs/dbraw/zinc/42/17/45/1131421745.db2.gz QSDALXOGZXJMGN-UHFFFAOYSA-N 1 1 289.375 3.639 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCSc2ccccc2C1 ZINC001137840066 1131421746 /nfs/dbraw/zinc/42/17/46/1131421746.db2.gz QSDALXOGZXJMGN-UHFFFAOYSA-N 1 1 289.375 3.639 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854374 1131424234 /nfs/dbraw/zinc/42/42/34/1131424234.db2.gz SUJLZNOFIUZJFM-CQSZACIVSA-N 1 1 296.414 3.505 20 10 CHCDMO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854374 1131424236 /nfs/dbraw/zinc/42/42/36/1131424236.db2.gz SUJLZNOFIUZJFM-CQSZACIVSA-N 1 1 296.414 3.505 20 10 CHCDMO Cc1cc(C[N@H+](C)C2CCOCC2)c(C)n1-c1ccccc1 ZINC001137854224 1131424495 /nfs/dbraw/zinc/42/44/95/1131424495.db2.gz NOYAWMFSSXTFHP-UHFFFAOYSA-N 1 1 298.430 3.705 20 10 CHCDMO CC[N@@H+](CCOC)Cc1cc(C)n(-c2ccccc2)c1C ZINC001137854098 1131424556 /nfs/dbraw/zinc/42/45/56/1131424556.db2.gz IKIFJEWATUCHJH-UHFFFAOYSA-N 1 1 286.419 3.562 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1F ZINC001137892297 1131430322 /nfs/dbraw/zinc/43/03/22/1131430322.db2.gz NYZHWWYVWCYEHS-UHFFFAOYSA-N 1 1 295.304 3.832 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2cccc(F)c2O)cc1C ZINC001138129514 1131469845 /nfs/dbraw/zinc/46/98/45/1131469845.db2.gz HZQVWAXZVSSGHQ-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cccc(F)c2O)cc1C ZINC001138129514 1131469847 /nfs/dbraw/zinc/46/98/47/1131469847.db2.gz HZQVWAXZVSSGHQ-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO C[N@H+](C/C=C/c1ccccc1)Cc1cccc(F)c1O ZINC001138128315 1131469959 /nfs/dbraw/zinc/46/99/59/1131469959.db2.gz CJUQJBUQCWOXEA-RMKNXTFCSA-N 1 1 271.335 3.677 20 10 CHCDMO C[N@@H+](C/C=C/c1ccccc1)Cc1cccc(F)c1O ZINC001138128315 1131469961 /nfs/dbraw/zinc/46/99/61/1131469961.db2.gz CJUQJBUQCWOXEA-RMKNXTFCSA-N 1 1 271.335 3.677 20 10 CHCDMO FC[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138222126 1131478834 /nfs/dbraw/zinc/47/88/34/1131478834.db2.gz HRBDEYGWNSUMAN-QGZVFWFLSA-N 1 1 276.399 3.611 20 10 CHCDMO Cc1c(C[N@@H+](C)CCc2ccncc2)c2ccccc2n1C ZINC001138256674 1131483114 /nfs/dbraw/zinc/48/31/14/1131483114.db2.gz GHPMVKJYYSWDLA-UHFFFAOYSA-N 1 1 293.414 3.556 20 10 CHCDMO Cc1cc(C[N@H+]2[C@@H](C)CCC2(C)C)ccc1N(C)C ZINC001171078716 1131504256 /nfs/dbraw/zinc/50/42/56/1131504256.db2.gz RLQPONKCIQFLQF-AWEZNQCLSA-N 1 1 260.425 3.824 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)cc1C(C)C ZINC000844753169 1131595448 /nfs/dbraw/zinc/59/54/48/1131595448.db2.gz VFGPBJVBRBVAMH-OKILXGFUSA-N 1 1 281.346 3.521 20 10 CHCDMO CCOc1ccc(C)cc1C[N@@H+](C)Cc1ccccc1O ZINC001139607598 1131621495 /nfs/dbraw/zinc/62/14/95/1131621495.db2.gz XCXAZJKQDQIIBD-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO COc1c(Cl)cccc1C[N@@H+](C)Cc1ccccc1O ZINC001140062281 1131661687 /nfs/dbraw/zinc/66/16/87/1131661687.db2.gz QOWHCWVGAJFCCH-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC001140182551 1131674327 /nfs/dbraw/zinc/67/43/27/1131674327.db2.gz VDNOVTYOURTYFE-GDBMZVCRSA-N 1 1 259.393 3.774 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CCc2cccs2)c1O ZINC001140182518 1131674645 /nfs/dbraw/zinc/67/46/45/1131674645.db2.gz UDRRKYGJRLBFNM-UHFFFAOYSA-N 1 1 275.417 3.745 20 10 CHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC12CCCC2 ZINC000846000143 1131676414 /nfs/dbraw/zinc/67/64/14/1131676414.db2.gz NIFWISLFKYKTBL-UHFFFAOYSA-N 1 1 296.208 3.673 20 10 CHCDMO C[C@]1(F)CCCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001140337871 1131702412 /nfs/dbraw/zinc/70/24/12/1131702412.db2.gz KFWGHIWJZVTFPP-AWEZNQCLSA-N 1 1 271.763 3.760 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC001140337955 1131702785 /nfs/dbraw/zinc/70/27/85/1131702785.db2.gz OQISEOIQKKZMPA-JTQLQIEISA-N 1 1 289.753 3.913 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2c(O)cccc2Cl)CC1 ZINC001140338127 1131702878 /nfs/dbraw/zinc/70/28/78/1131702878.db2.gz VYNGKGTYJDPFQP-CQSZACIVSA-N 1 1 271.763 3.760 20 10 CHCDMO CCc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000846210380 1131703276 /nfs/dbraw/zinc/70/32/76/1131703276.db2.gz ZLFKLWXYRDEIQE-GFCCVEGCSA-N 1 1 273.351 3.945 20 10 CHCDMO Oc1cccc2c1[C@@H]([NH2+]CC(F)(F)c1ccccc1)CC2 ZINC000834779639 1131704167 /nfs/dbraw/zinc/70/41/67/1131704167.db2.gz PMICVHQFBNJYEO-AWEZNQCLSA-N 1 1 289.325 3.761 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C(F)F ZINC000834827735 1131707638 /nfs/dbraw/zinc/70/76/38/1131707638.db2.gz LEPHXYCCZZYRNQ-UJNFCWOMSA-N 1 1 273.298 3.713 20 10 CHCDMO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccc(F)cc1O ZINC000834885504 1131718589 /nfs/dbraw/zinc/71/85/89/1131718589.db2.gz XACAHBHJAYMUQN-PELKAZGASA-N 1 1 292.181 3.766 20 10 CHCDMO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(F)cc1O ZINC000834910532 1131729957 /nfs/dbraw/zinc/72/99/57/1131729957.db2.gz DZNRNKULAFXDPO-DJSGYFEHSA-N 1 1 281.371 3.530 20 10 CHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1ccc(Cl)cc1O ZINC001140461066 1131746860 /nfs/dbraw/zinc/74/68/60/1131746860.db2.gz DDBPARQYANLEMR-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001140463097 1131749298 /nfs/dbraw/zinc/74/92/98/1131749298.db2.gz SHNPFKCTVLVKSN-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCc2sccc2C1 ZINC001140463097 1131749303 /nfs/dbraw/zinc/74/93/03/1131749303.db2.gz SHNPFKCTVLVKSN-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)cc2O)c1 ZINC001140465103 1131750159 /nfs/dbraw/zinc/75/01/59/1131750159.db2.gz IDJRHGLGEJKNQE-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[N@H+](Cc1ccc(Cl)cc1O)C[C@@H]1CC1(C)C ZINC001140465661 1131751213 /nfs/dbraw/zinc/75/12/13/1131751213.db2.gz QGUQCMFSGZQFBB-NSHDSACASA-N 1 1 253.773 3.524 20 10 CHCDMO CC(C)[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC000835026002 1131759500 /nfs/dbraw/zinc/75/95/00/1131759500.db2.gz PTSXBCFOEUXNBR-WAYWQWQTSA-N 1 1 258.409 3.639 20 10 CHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)Cc2ccc(O)cc2)cc1 ZINC000835054764 1131766127 /nfs/dbraw/zinc/76/61/27/1131766127.db2.gz YBCPJKYAEZJENJ-SNAWJCMRSA-N 1 1 296.414 3.603 20 10 CHCDMO Cc1ccncc1C[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835051084 1131766350 /nfs/dbraw/zinc/76/63/50/1131766350.db2.gz CDOPRNWTPCUROO-AATRIKPKSA-N 1 1 295.430 3.601 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2c([O-])cc(F)cc2F)c1 ZINC001140582411 1131807676 /nfs/dbraw/zinc/80/76/76/1131807676.db2.gz ILQSGLKWFWBOLQ-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+](C)Cc2cccc(Cl)c2)c1O ZINC001140745945 1131905588 /nfs/dbraw/zinc/90/55/88/1131905588.db2.gz 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298.430 3.562 20 10 CHCDMO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209519691 1134034197 /nfs/dbraw/zinc/03/41/97/1134034197.db2.gz FDTWTSLDOMXQCZ-IBGZPJMESA-N 1 1 296.414 3.648 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001209519448 1134034359 /nfs/dbraw/zinc/03/43/59/1134034359.db2.gz UWQHDFDGOVAQKG-CQSZACIVSA-N 1 1 296.414 3.505 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001209519448 1134034362 /nfs/dbraw/zinc/03/43/62/1134034362.db2.gz UWQHDFDGOVAQKG-CQSZACIVSA-N 1 1 296.414 3.505 20 10 CHCDMO CC[N@@H+](Cc1c(C)[nH]c2ncccc12)Cc1ccccc1O ZINC001209592225 1134041709 /nfs/dbraw/zinc/04/17/09/1134041709.db2.gz DNWGHJMADABEAL-UHFFFAOYSA-N 1 1 295.386 3.599 20 10 CHCDMO Oc1c(Cl)cccc1Nc1cc[nH+]cc1C(F)(F)F ZINC001210216702 1134169242 /nfs/dbraw/zinc/16/92/42/1134169242.db2.gz NHCZNOGCWZSXCW-UHFFFAOYSA-N 1 1 288.656 3.625 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N)cc1 ZINC001217967702 1135032383 /nfs/dbraw/zinc/03/23/83/1135032383.db2.gz UAGDOVWEJLHWBR-KXBFYZLASA-N 1 1 296.414 3.558 20 10 CHCDMO CC[N@@H+](Cc1scnc1C)Cc1ccc(N(C)C)cc1 ZINC000156848927 261133690 /nfs/dbraw/zinc/13/36/90/261133690.db2.gz WTALKJGHZMAQFM-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2cccs2)c1O ZINC000162703436 261291504 /nfs/dbraw/zinc/29/15/04/261291504.db2.gz SNCCVICAGOQUOK-ZDUSSCGKSA-N 1 1 289.400 3.799 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1O ZINC000186129171 262080689 /nfs/dbraw/zinc/08/06/89/262080689.db2.gz UUHSBRYFKFDLMN-JSGCOSHPSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1O ZINC000285496613 263093583 /nfs/dbraw/zinc/09/35/83/263093583.db2.gz APSYXSOZKBCRIE-UKPHBRMFSA-N 1 1 293.382 3.530 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000271843553 328198039 /nfs/dbraw/zinc/19/80/39/328198039.db2.gz QQOFWBKQNWNHHV-UHFFFAOYSA-N 1 1 291.700 3.740 20 10 CHCDMO [O-]c1c(Cl)cccc1CN1CC=C(C(F)(F)F)CC1 ZINC000271843553 328198040 /nfs/dbraw/zinc/19/80/40/328198040.db2.gz QQOFWBKQNWNHHV-UHFFFAOYSA-N 1 1 291.700 3.740 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2occc2C)c1O ZINC000292827660 522538166 /nfs/dbraw/zinc/53/81/66/522538166.db2.gz QTLDPDTUDYRQRD-UHFFFAOYSA-N 1 1 295.766 3.588 20 10 CHCDMO C[C@H]([NH2+]CCC(C)(C)O)c1cc(Cl)c(Cl)cc1O ZINC000278803890 525326967 /nfs/dbraw/zinc/32/69/67/525326967.db2.gz RJKJVDXMPQGJFE-QMMMGPOBSA-N 1 1 292.206 3.511 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC000228137560 1125462388 /nfs/dbraw/zinc/46/23/88/1125462388.db2.gz WYOFZMLOLXOPHQ-XJKSGUPXSA-N 1 1 275.392 3.555 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1cc(F)cc(F)c1O ZINC000834885105 1118610142 /nfs/dbraw/zinc/61/01/42/1118610142.db2.gz GOKYEAMWRHELQP-RKDXNWHRSA-N 1 1 291.288 3.756 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccccc2O)s1 ZINC000179572855 1119751189 /nfs/dbraw/zinc/75/11/89/1119751189.db2.gz QMRXSHSSPQDORT-NSHDSACASA-N 1 1 276.405 3.659 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cccc(C)c2O)s1 ZINC000180036079 1120262739 /nfs/dbraw/zinc/26/27/39/1120262739.db2.gz OXUQIKRIQAEAOG-UHFFFAOYSA-N 1 1 261.390 3.703 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000850541009 1123287686 /nfs/dbraw/zinc/28/76/86/1123287686.db2.gz UEOJXHCBLRHXDU-TVQRCGJNSA-N 1 1 253.773 3.885 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)[C@H]2CCSC2)cc1C(C)C ZINC000125022035 1124834165 /nfs/dbraw/zinc/83/41/65/1124834165.db2.gz ZLZJVNULGSBAEK-AWEZNQCLSA-N 1 1 279.449 3.761 20 10 CHCDMO CCSC[C@@H](C)[N@@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001173316448 1132477449 /nfs/dbraw/zinc/47/74/49/1132477449.db2.gz XDSHLKUDGXMVFA-CQSZACIVSA-N 1 1 280.481 3.716 20 10 CHCDMO CCOCC(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841755532 1125591836 /nfs/dbraw/zinc/59/18/36/1125591836.db2.gz INMDCRFCVQMYLB-NSHDSACASA-N 1 1 285.815 3.759 20 10 CHCDMO C[C@H](Cc1ccncc1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841758086 1125598409 /nfs/dbraw/zinc/59/84/09/1125598409.db2.gz KKOXPUUMSHHISB-VXGBXAGGSA-N 1 1 290.794 3.722 20 10 CHCDMO C[C@H]([NH2+]CCCC1CCOCC1)c1ccc(Cl)cc1O ZINC000841759528 1125598894 /nfs/dbraw/zinc/59/88/94/1125598894.db2.gz ZHCJEKNEDXYMFA-LBPRGKRZSA-N 1 1 297.826 3.903 20 10 CHCDMO Cc1cc(O)c(C[NH2+]Cc2cc(C3CC3)no2)c(Cl)c1 ZINC000886269274 1125664546 /nfs/dbraw/zinc/66/45/46/1125664546.db2.gz QAPBBESUSHTUCW-UHFFFAOYSA-N 1 1 292.766 3.509 20 10 CHCDMO COc1ccc(C[N@H+]2CCC3(C2)CCCCC3)c(O)c1 ZINC000093663766 1125674040 /nfs/dbraw/zinc/67/40/40/1125674040.db2.gz AZWZRPMTXMXVAG-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886542609 1125687216 /nfs/dbraw/zinc/68/72/16/1125687216.db2.gz CPTQVEQXTIECLU-NEPJUHHUSA-N 1 1 274.339 3.647 20 10 CHCDMO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1c(O)cccc1F ZINC000886557257 1125690003 /nfs/dbraw/zinc/69/00/03/1125690003.db2.gz XAJDPAQIHMDLAY-GTNSWQLSSA-N 1 1 286.350 3.728 20 10 CHCDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)CO2 ZINC000886551851 1125690552 /nfs/dbraw/zinc/69/05/52/1125690552.db2.gz PNKAGUCEVNUQQB-RISCZKNCSA-N 1 1 287.334 3.624 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1c(C)noc1C ZINC000886556981 1125690727 /nfs/dbraw/zinc/69/07/27/1125690727.db2.gz OFZQENJGUIMNME-TVQRCGJNSA-N 1 1 292.354 3.938 20 10 CHCDMO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2c(O)cccc2F)s1 ZINC000886589836 1125694327 /nfs/dbraw/zinc/69/43/27/1125694327.db2.gz HGYNBFCVIIPRSR-GXSJLCMTSA-N 1 1 294.395 3.751 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1c(O)cccc1F ZINC000886607548 1125696824 /nfs/dbraw/zinc/69/68/24/1125696824.db2.gz UIYBLGOWIBWZBY-CRWXNKLISA-N 1 1 295.398 3.776 20 10 CHCDMO CC(C)[C@@H]1C[C@H](C[NH2+][C@@H](C)c2c(O)cccc2F)CCO1 ZINC000886618948 1125699892 /nfs/dbraw/zinc/69/98/92/1125699892.db2.gz PDOVTXGDVSGKJN-ZENOOKHLSA-N 1 1 295.398 3.633 20 10 CHCDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886639326 1125701118 /nfs/dbraw/zinc/70/11/18/1125701118.db2.gz ALJANUOIRYQGTP-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CSCC1(CC[NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886636200 1125701358 /nfs/dbraw/zinc/70/13/58/1125701358.db2.gz HQIUSLSIFYOSHD-LLVKDONJSA-N 1 1 283.412 3.715 20 10 CHCDMO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1c(O)cccc1F ZINC000886649618 1125701961 /nfs/dbraw/zinc/70/19/61/1125701961.db2.gz DUFBBDOFGABNBJ-SECBINFHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1c(O)cccc1F ZINC000886732585 1125714849 /nfs/dbraw/zinc/71/48/49/1125714849.db2.gz KQMMFUDFFKNFGQ-OLZOCXBDSA-N 1 1 293.382 3.531 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ncccc1C ZINC000093177558 1125766037 /nfs/dbraw/zinc/76/60/37/1125766037.db2.gz ICXQVPMPRFAQSC-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000093867533 1125774300 /nfs/dbraw/zinc/77/43/00/1125774300.db2.gz ZBHAQJIOGXDSDZ-GUYCJALGSA-N 1 1 283.371 3.594 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1cc(Cl)ccc1O ZINC000768160834 1129837367 /nfs/dbraw/zinc/83/73/67/1129837367.db2.gz SQNQARUHRVUZPL-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000769246265 1129898280 /nfs/dbraw/zinc/89/82/80/1129898280.db2.gz YWJDUBITKRWGNV-CQSZACIVSA-N 1 1 265.784 3.810 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)C2(C)CCCC2)c(O)c1 ZINC000787334000 1130145072 /nfs/dbraw/zinc/14/50/72/1130145072.db2.gz CCNXIZZKMINEKX-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO CC[N@@H+](CCC(F)(F)F)Cc1cc2c(cc1O)CCC2 ZINC000748294612 1130228325 /nfs/dbraw/zinc/22/83/25/1130228325.db2.gz ACVIBYPVKMLRQQ-UHFFFAOYSA-N 1 1 287.325 3.655 20 10 CHCDMO CSc1ccc(C[N@@H+](C)Cc2ccccc2O)s1 ZINC000811457197 1130610226 /nfs/dbraw/zinc/61/02/26/1130610226.db2.gz KHLKIRDKCZKISV-UHFFFAOYSA-N 1 1 279.430 3.808 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)[C@H](C)C2CC2)c1 ZINC000781897128 1130746412 /nfs/dbraw/zinc/74/64/12/1130746412.db2.gz OPTWUTAMSFHTIY-SNVBAGLBSA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)[C@H](C)C2CC2)c1 ZINC000781897128 1130746416 /nfs/dbraw/zinc/74/64/16/1130746416.db2.gz OPTWUTAMSFHTIY-SNVBAGLBSA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)cs1 ZINC000189940455 1126936923 /nfs/dbraw/zinc/93/69/23/1126936923.db2.gz NHXBMLBYCZQLFN-CQSZACIVSA-N 1 1 292.379 3.633 20 10 CHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)cs1 ZINC000189940455 1126936925 /nfs/dbraw/zinc/93/69/25/1126936925.db2.gz NHXBMLBYCZQLFN-CQSZACIVSA-N 1 1 292.379 3.633 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCO1)c1cc(Cl)c(Cl)cc1O ZINC000192595955 1126962293 /nfs/dbraw/zinc/96/22/93/1126962293.db2.gz IBOZEQYSQTYRML-RKDXNWHRSA-N 1 1 290.190 3.529 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)CC1CCC1 ZINC001236795041 1131008780 /nfs/dbraw/zinc/00/87/80/1131008780.db2.gz ACJWLDZCEJMJLQ-UHFFFAOYSA-N 1 1 274.191 3.931 20 10 CHCDMO C[N@H+](Cc1cc(Cl)c(Cl)cc1O)CC1CCC1 ZINC001236795041 1131008783 /nfs/dbraw/zinc/00/87/83/1131008783.db2.gz ACJWLDZCEJMJLQ-UHFFFAOYSA-N 1 1 274.191 3.931 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(N(C)C)cc1 ZINC000271429307 1127080752 /nfs/dbraw/zinc/08/07/52/1127080752.db2.gz AWFGVTZZPMBLSK-IAGOWNOFSA-N 1 1 298.434 3.594 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1OC(F)(F)F)CC1CCC1 ZINC001237122309 1131056022 /nfs/dbraw/zinc/05/60/22/1131056022.db2.gz IBWPWXXFBGTWAZ-UHFFFAOYSA-N 1 1 289.297 3.523 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237138870 1131058880 /nfs/dbraw/zinc/05/88/80/1131058880.db2.gz HXVMKHDEEUUZOL-UHFFFAOYSA-N 1 1 273.298 3.643 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1cccs1 ZINC000816529351 1131107838 /nfs/dbraw/zinc/10/78/38/1131107838.db2.gz POKGKALGHKFCNH-UHFFFAOYSA-N 1 1 285.771 3.579 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817412061 1131160031 /nfs/dbraw/zinc/16/00/31/1131160031.db2.gz BZBBHTANOTVSFX-SNVBAGLBSA-N 1 1 291.288 3.696 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1ccc(F)cc1O ZINC000286153101 1127261250 /nfs/dbraw/zinc/26/12/50/1127261250.db2.gz PMZHGUGCGDVRTH-JYYAWHABSA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)ccc1N(C)C ZINC000293749622 1127517110 /nfs/dbraw/zinc/51/71/10/1127517110.db2.gz IOTFSXMOYJIPLC-HNNXBMFYSA-N 1 1 283.419 3.649 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)cc1Cl ZINC001231870793 1127544420 /nfs/dbraw/zinc/54/44/20/1127544420.db2.gz UFQOUVPCTDFWLR-PWSUYJOCSA-N 1 1 267.800 3.974 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000228630099 1127576384 /nfs/dbraw/zinc/57/63/84/1127576384.db2.gz XNMFLNZZYHFXNK-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)c1O ZINC000229554506 1127695906 /nfs/dbraw/zinc/69/59/06/1127695906.db2.gz IFLUVVTVPFGWLX-MCIONIFRSA-N 1 1 277.408 3.657 20 10 CHCDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccccc1O ZINC000171926032 1127734661 /nfs/dbraw/zinc/73/46/61/1127734661.db2.gz UXTAPLCSMNYPCO-NSHDSACASA-N 1 1 277.314 3.863 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000366942936 1127748708 /nfs/dbraw/zinc/74/87/08/1127748708.db2.gz IYEIGXFVLKTZKP-LJQANCHMSA-N 1 1 297.398 3.548 20 10 CHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062745070 1127772212 /nfs/dbraw/zinc/77/22/12/1127772212.db2.gz LMEBTNSMXXWCGZ-STQMWFEESA-N 1 1 273.351 3.986 20 10 CHCDMO CC[C@H](c1cc(Cl)ccc1[O-])[NH+]1CCC([NH3+])(CC)CC1 ZINC000925760351 1128140906 /nfs/dbraw/zinc/14/09/06/1128140906.db2.gz PULSAAMBASORHK-CQSZACIVSA-N 1 1 296.842 3.700 20 10 CHCDMO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)C1CC1 ZINC000324207777 1128160239 /nfs/dbraw/zinc/16/02/39/1128160239.db2.gz CJUROFCSBPOJQB-BONVTDFDSA-N 1 1 251.345 3.617 20 10 CHCDMO C[C@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(Cl)cc1O ZINC000926915072 1128202489 /nfs/dbraw/zinc/20/24/89/1128202489.db2.gz DOGFAADLRZGRHL-IUIKQTSFSA-N 1 1 295.810 3.655 20 10 CHCDMO CC(C)[N@H+](Cc1c(O)ccc2ccncc21)CC1CC1 ZINC000915207516 1128290086 /nfs/dbraw/zinc/29/00/86/1128290086.db2.gz AZNFYVMIUJCBHN-UHFFFAOYSA-N 1 1 270.376 3.561 20 10 CHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(C)cc(C)c2O)on1 ZINC000754727544 1128299276 /nfs/dbraw/zinc/29/92/76/1128299276.db2.gz IJMBXFZSWMPXFZ-OAHLLOKOSA-N 1 1 286.375 3.643 20 10 CHCDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccccc1O ZINC000780793300 1128451295 /nfs/dbraw/zinc/45/12/95/1128451295.db2.gz LCBADQPOALYTCU-PWSUYJOCSA-N 1 1 273.298 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CC2CCCC2)C2CC2)cc1 ZINC000917074993 1128475123 /nfs/dbraw/zinc/47/51/23/1128475123.db2.gz OFIHBTRECLRNND-UHFFFAOYSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000158024665 1128663477 /nfs/dbraw/zinc/66/34/77/1128663477.db2.gz JYRYRQMBLCAZQK-KRWDZBQOSA-N 1 1 267.372 3.820 20 10 CHCDMO C[C@@H](C[N@@H+](C)Cc1cc(F)ccc1O)c1ccccc1 ZINC000779009931 1128676902 /nfs/dbraw/zinc/67/69/02/1128676902.db2.gz QSWZWOCNPONDEY-ZDUSSCGKSA-N 1 1 273.351 3.767 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000779015859 1128682102 /nfs/dbraw/zinc/68/21/02/1128682102.db2.gz XJAYMJYMWDASGE-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO CC(C)CC[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000921049414 1128699598 /nfs/dbraw/zinc/69/95/98/1128699598.db2.gz FATDTLZMHCLONG-UHFFFAOYSA-N 1 1 279.424 3.873 20 10 CHCDMO C[C@@H]([NH2+][C@H](C1CC1)C1CCC1)c1ccc(F)cc1O ZINC000324775591 1128708590 /nfs/dbraw/zinc/70/85/90/1128708590.db2.gz FCAQGBLUMIHYER-HWPZZCPQSA-N 1 1 263.356 3.761 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(C)c1 ZINC000185066636 1117759332 /nfs/dbraw/zinc/75/93/32/1117759332.db2.gz FMJIBBUEHCGBTG-ZDUSSCGKSA-N 1 1 273.351 3.999 20 10 CHCDMO Cc1ccc(O)c([C@H](C)NCCC[NH+](C(C)C)C(C)C)c1 ZINC000185626689 1117859746 /nfs/dbraw/zinc/85/97/46/1117859746.db2.gz RTAZWNFBBDMTLO-INIZCTEOSA-N 1 1 292.467 3.860 20 10 CHCDMO C[C@@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccc(F)cc1O ZINC000185828878 1117914431 /nfs/dbraw/zinc/91/44/31/1117914431.db2.gz OVALGMWJBABYKU-MLGOLLRUSA-N 1 1 295.398 3.513 20 10 CHCDMO CC[C@@H]([NH2+]CCc1cccc(C)n1)c1ccc(F)cc1O ZINC000287636530 1117980688 /nfs/dbraw/zinc/98/06/88/1117980688.db2.gz ULMDZJOKOUPYPW-MRXNPFEDSA-N 1 1 288.366 3.518 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NCCC[NH+](CC)CC)cc1 ZINC000764432100 1118091709 /nfs/dbraw/zinc/09/17/09/1118091709.db2.gz HYFPEDGGADZNQU-MRXNPFEDSA-N 1 1 291.483 3.525 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)CC1(c2ccccc2)CC1 ZINC000188716923 1128764477 /nfs/dbraw/zinc/76/44/77/1128764477.db2.gz IQFUXMYJPSRBHT-UHFFFAOYSA-N 1 1 267.372 3.556 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CC[C@H]3CCC[C@H]3C2)c1O ZINC001140181943 1118246206 /nfs/dbraw/zinc/24/62/06/1118246206.db2.gz XXUSRHARAXGKIM-CABCVRRESA-N 1 1 259.393 3.631 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCc3ccccc3C2)c1O ZINC001140182751 1118251939 /nfs/dbraw/zinc/25/19/39/1118251939.db2.gz ZAWCESJUPQVFMS-UHFFFAOYSA-N 1 1 281.399 3.957 20 10 CHCDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1cc(Cl)c(F)cc1[O-] ZINC001652675028 1118274260 /nfs/dbraw/zinc/27/42/60/1118274260.db2.gz WSTHKIPFUVVQQE-VIFPVBQESA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC001652675028 1118274263 /nfs/dbraw/zinc/27/42/63/1118274263.db2.gz WSTHKIPFUVVQQE-VIFPVBQESA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC001652675028 1118274266 /nfs/dbraw/zinc/27/42/66/1118274266.db2.gz WSTHKIPFUVVQQE-VIFPVBQESA-N 1 1 271.763 3.805 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000179944267 1128768639 /nfs/dbraw/zinc/76/86/39/1128768639.db2.gz IAKYFJVGEZSPON-KRWDZBQOSA-N 1 1 297.398 3.910 20 10 CHCDMO CC[C@@H]([NH2+]CCOc1ccccc1)c1ccc(F)cc1O ZINC000796673484 1118322334 /nfs/dbraw/zinc/32/23/34/1118322334.db2.gz QVGMQVSWUNKFAG-MRXNPFEDSA-N 1 1 289.350 3.651 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)C2CC2)cc1Cl ZINC001658124592 1118460970 /nfs/dbraw/zinc/46/09/70/1118460970.db2.gz ORZUSVWPRBLIAR-SNVBAGLBSA-N 1 1 253.773 3.584 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1c(O)cccc1Br ZINC000707129085 1118640280 /nfs/dbraw/zinc/64/02/80/1118640280.db2.gz DUVSJOTZPFKVRE-UHFFFAOYSA-N 1 1 284.197 3.529 20 10 CHCDMO CC[N@H+](Cc1cccc(C)c1O)C[C@H](O)c1ccc(C)cc1 ZINC000180419803 1128791314 /nfs/dbraw/zinc/79/13/14/1128791314.db2.gz ZBXDJISERTUCGE-SFHVURJKSA-N 1 1 299.414 3.565 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)cccc2Br)CC1 ZINC000707153052 1118650977 /nfs/dbraw/zinc/65/09/77/1118650977.db2.gz SZJUFIGYKWLYLM-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@]1(F)CCC[N@@H+](Cc2ccc(Cl)cc2O)CC1 ZINC001140461921 1118720422 /nfs/dbraw/zinc/72/04/22/1118720422.db2.gz YJPYOBZMHJIMLO-AWEZNQCLSA-N 1 1 271.763 3.760 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140464595 1118736120 /nfs/dbraw/zinc/73/61/20/1118736120.db2.gz WNUUJYMXRANEAS-ZDUSSCGKSA-N 1 1 253.773 3.666 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@@H]1CCOC(C)(C)C1 ZINC000291536356 1118985057 /nfs/dbraw/zinc/98/50/57/1118985057.db2.gz KUZPRJBFPSPSHL-MRXNPFEDSA-N 1 1 291.435 3.789 20 10 CHCDMO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1cc(F)ccc1O ZINC000180909853 1128818937 /nfs/dbraw/zinc/81/89/37/1128818937.db2.gz ZNTXAPVCACWMGL-UHFFFAOYSA-N 1 1 299.267 3.581 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1OC(F)F ZINC000111236426 1119079338 /nfs/dbraw/zinc/07/93/38/1119079338.db2.gz OHWPHEBYRVSORA-UHFFFAOYSA-N 1 1 293.313 3.626 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176673540 1119092212 /nfs/dbraw/zinc/09/22/12/1119092212.db2.gz KKDDLCSGDOSSES-AWEZNQCLSA-N 1 1 255.361 3.975 20 10 CHCDMO [O-]c1cc(F)cc(F)c1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC001140582467 1119148357 /nfs/dbraw/zinc/14/83/57/1119148357.db2.gz JAFALQQWJJBLNT-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)CCc2cccc(F)c2)c1 ZINC001140622870 1119294060 /nfs/dbraw/zinc/29/40/60/1119294060.db2.gz CSLJNHBVKSOGJC-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO C[C@@H](C[N@@H+](C)Cc1cc(F)cc(F)c1[O-])C(C)(C)C ZINC000708433530 1119452209 /nfs/dbraw/zinc/45/22/09/1119452209.db2.gz LIBJPVULCIKNHV-JTQLQIEISA-N 1 1 271.351 3.784 20 10 CHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccsc1 ZINC000708453146 1119467157 /nfs/dbraw/zinc/46/71/57/1119467157.db2.gz DCTRSGPAMAODKR-QMMMGPOBSA-N 1 1 269.316 3.583 20 10 CHCDMO c1ccc2[nH+]c(NCc3ccc(N4CCCC4)cc3)[nH]c2c1 ZINC000179282423 1119700652 /nfs/dbraw/zinc/70/06/52/1119700652.db2.gz VJWBYWGSENTBNO-UHFFFAOYSA-N 1 1 292.386 3.775 20 10 CHCDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000179706617 1119758277 /nfs/dbraw/zinc/75/82/77/1119758277.db2.gz SCAZZNKMYDKYGS-OAHLLOKOSA-N 1 1 290.794 3.721 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCOC(C)C)cc1 ZINC000728688050 1120140240 /nfs/dbraw/zinc/14/02/40/1120140240.db2.gz CCVCOYXFBCKOAP-UHFFFAOYSA-N 1 1 292.467 3.780 20 10 CHCDMO CCC[N@@H+](CC)Cc1cc(Br)cc(F)c1[O-] ZINC000715702577 1120237236 /nfs/dbraw/zinc/23/72/36/1120237236.db2.gz LXXRYDQPONBQCX-UHFFFAOYSA-N 1 1 290.176 3.526 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC000715705066 1120238907 /nfs/dbraw/zinc/23/89/07/1120238907.db2.gz YLKPYXDUEUMDAA-QMMMGPOBSA-N 1 1 290.176 3.524 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(F)cc1O ZINC000796798994 1120818279 /nfs/dbraw/zinc/81/82/79/1120818279.db2.gz OVJCQKMDURIZIS-WBMJQRKESA-N 1 1 288.366 3.771 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)CCSCC)c1O ZINC000093870953 1120893098 /nfs/dbraw/zinc/89/30/98/1120893098.db2.gz YHOZVIJTDHBBNO-CYBMUJFWSA-N 1 1 297.464 3.754 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H](C)C2)c1O ZINC000703203774 1121239330 /nfs/dbraw/zinc/23/93/30/1121239330.db2.gz FMVVPGYAJDYUOK-LLVKDONJSA-N 1 1 283.799 3.676 20 10 CHCDMO CC(C)CC1(C[NH2+]Cc2cc(F)cc(F)c2O)CCC1 ZINC001178175861 1121769244 /nfs/dbraw/zinc/76/92/44/1121769244.db2.gz BTLMQPDDLJNYSM-UHFFFAOYSA-N 1 1 283.362 3.976 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)C2CCC2)c1 ZINC001178425884 1121787953 /nfs/dbraw/zinc/78/79/53/1121787953.db2.gz KXAGARAJKLFRJJ-SNVBAGLBSA-N 1 1 298.224 3.741 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000773749500 1121794170 /nfs/dbraw/zinc/79/41/70/1121794170.db2.gz WNMCCGGYAHRZSV-QGZVFWFLSA-N 1 1 258.409 3.517 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)c(F)c1)Cc1ccccc1O ZINC001204226488 1121811992 /nfs/dbraw/zinc/81/19/92/1121811992.db2.gz BGHHUHBQMMOPFN-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CCOCC[N@@H+](CC)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000730801776 1121828005 /nfs/dbraw/zinc/82/80/05/1121828005.db2.gz KXDTZYKGFWCGRE-UHFFFAOYSA-N 1 1 293.451 3.857 20 10 CHCDMO CCC[N@@H+](Cc1ccc2c(c1)CCO2)Cc1ccccc1O ZINC000731850272 1121887224 /nfs/dbraw/zinc/88/72/24/1121887224.db2.gz RURSGSURPYJJTO-UHFFFAOYSA-N 1 1 297.398 3.739 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000732184225 1121910067 /nfs/dbraw/zinc/91/00/67/1121910067.db2.gz XSONLRDOIJFQAV-AWEZNQCLSA-N 1 1 294.354 3.523 20 10 CHCDMO CC(C)C[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC001179983703 1121932404 /nfs/dbraw/zinc/93/24/04/1121932404.db2.gz FDLXYEQLDSSQLZ-WAYWQWQTSA-N 1 1 272.436 3.886 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC[C@@H]1C ZINC001180198581 1121964671 /nfs/dbraw/zinc/96/46/71/1121964671.db2.gz DWXFECKJFCCYCM-UWVGGRQHSA-N 1 1 271.763 3.663 20 10 CHCDMO C[C@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CC[C@@H]1C ZINC001180198581 1121964677 /nfs/dbraw/zinc/96/46/77/1121964677.db2.gz DWXFECKJFCCYCM-UWVGGRQHSA-N 1 1 271.763 3.663 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H](C)CC2)c1O ZINC000110806794 1122003158 /nfs/dbraw/zinc/00/31/58/1122003158.db2.gz YLOBDYLFXFVYRK-NSHDSACASA-N 1 1 295.810 3.870 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)CC2)c1O ZINC000110806794 1122003167 /nfs/dbraw/zinc/00/31/67/1122003167.db2.gz YLOBDYLFXFVYRK-NSHDSACASA-N 1 1 295.810 3.870 20 10 CHCDMO Oc1ccc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)c(O)c1 ZINC001204278286 1122009554 /nfs/dbraw/zinc/00/95/54/1122009554.db2.gz CXHIYAIFXZVJAJ-CQSZACIVSA-N 1 1 275.392 3.500 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(Cl)cc1O ZINC001181102183 1122032773 /nfs/dbraw/zinc/03/27/73/1122032773.db2.gz JNAVLPFLUDFZJQ-GXFFZTMASA-N 1 1 253.773 3.666 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC001182184597 1122116923 /nfs/dbraw/zinc/11/69/23/1122116923.db2.gz PFSIFHRUXGIXHC-QGZVFWFLSA-N 1 1 272.436 3.681 20 10 CHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2)c1 ZINC000273422116 1122233130 /nfs/dbraw/zinc/23/31/30/1122233130.db2.gz SLMNPGIQBHLQER-STQMWFEESA-N 1 1 299.370 3.591 20 10 CHCDMO CCCC[C@H](C)[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183918660 1122248576 /nfs/dbraw/zinc/24/85/76/1122248576.db2.gz BETWXKUEOLOTSF-NWDGAFQWSA-N 1 1 253.361 3.836 20 10 CHCDMO CC1(C)C(C)(C)C1(C)[NH2+]Cc1ccc(Cl)cc1O ZINC001184180111 1122258356 /nfs/dbraw/zinc/25/83/56/1122258356.db2.gz YOUQXMXOACTGAC-UHFFFAOYSA-N 1 1 267.800 3.960 20 10 CHCDMO CC1(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCC1 ZINC000774819882 1122317177 /nfs/dbraw/zinc/31/71/77/1122317177.db2.gz APXHJSVRUCMRMU-MRXNPFEDSA-N 1 1 289.419 3.563 20 10 CHCDMO CC[N@@H+](Cc1c(O)ccc2ccc(OC)cc21)C1CC1 ZINC000192993881 1129049832 /nfs/dbraw/zinc/04/98/32/1129049832.db2.gz IUGNQTHQKAFGJH-UHFFFAOYSA-N 1 1 271.360 3.538 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000824714723 1122412060 /nfs/dbraw/zinc/41/20/60/1122412060.db2.gz FGGQWGCJNZODJY-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C[C@H]1CC1(C)C ZINC001203664211 1122431966 /nfs/dbraw/zinc/43/19/66/1122431966.db2.gz RBEFSGWHPLWVLH-LLVKDONJSA-N 1 1 253.773 3.524 20 10 CHCDMO CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775484489 1122616119 /nfs/dbraw/zinc/61/61/19/1122616119.db2.gz CUVFLGLILICUIA-OAHLLOKOSA-N 1 1 296.842 3.572 20 10 CHCDMO Cc1cccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC000775646123 1122854139 /nfs/dbraw/zinc/85/41/39/1122854139.db2.gz GYCDRXXBNWGSEV-AWEZNQCLSA-N 1 1 267.372 3.820 20 10 CHCDMO COc1c(C)cc(C[N@@H+](C)Cc2cccc(C)c2O)cc1C ZINC000775670078 1122883451 /nfs/dbraw/zinc/88/34/51/1122883451.db2.gz HXDNLINBGJWRKK-UHFFFAOYSA-N 1 1 299.414 3.958 20 10 CHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682505 1122901833 /nfs/dbraw/zinc/90/18/33/1122901833.db2.gz ZNJYCOGTWUHNEW-CHWSQXEVSA-N 1 1 277.408 3.800 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC=C(C)CC2)c1O ZINC000775702557 1122913155 /nfs/dbraw/zinc/91/31/55/1122913155.db2.gz SPEVFFXCSZMBHK-UHFFFAOYSA-N 1 1 251.757 3.506 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c1 ZINC000775702333 1122914360 /nfs/dbraw/zinc/91/43/60/1122914360.db2.gz QAIALTXJPQFYDL-ZBFHGGJFSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1cccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC000775716073 1122922509 /nfs/dbraw/zinc/92/25/09/1122922509.db2.gz BDMZGDZQEZWERI-CQSZACIVSA-N 1 1 267.372 3.647 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000775724866 1122926205 /nfs/dbraw/zinc/92/62/05/1122926205.db2.gz JARSKIKVQPFBPT-LJQANCHMSA-N 1 1 297.398 3.564 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2CCC(C)C)c1 ZINC000775730389 1122927252 /nfs/dbraw/zinc/92/72/52/1122927252.db2.gz APBRZTHCVMUTQT-HNNXBMFYSA-N 1 1 277.408 3.801 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1O ZINC000775735570 1122929133 /nfs/dbraw/zinc/92/91/33/1122929133.db2.gz WOYZNCZOUMBWTM-RHSMWYFYSA-N 1 1 267.372 3.894 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)c1O ZINC000775741599 1122933369 /nfs/dbraw/zinc/93/33/69/1122933369.db2.gz TVWKODAQLJFZRM-KSSFIOAISA-N 1 1 297.398 3.525 20 10 CHCDMO C[N@H+]1CCCC[C@H]1CCSc1ncc(Cl)s1 ZINC000849998592 1123236283 /nfs/dbraw/zinc/23/62/83/1123236283.db2.gz PJNDELGLDINKFB-VIFPVBQESA-N 1 1 276.858 3.763 20 10 CHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2cscn2)c(Cl)c1 ZINC000850359220 1123256518 /nfs/dbraw/zinc/25/65/18/1123256518.db2.gz AIFKAATXEVCDFA-VIFPVBQESA-N 1 1 282.796 3.661 20 10 CHCDMO C[C@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)CC1(F)F ZINC000850380454 1123260574 /nfs/dbraw/zinc/26/05/74/1123260574.db2.gz GFZWAJXHHODXKH-LBPRGKRZSA-N 1 1 293.716 3.710 20 10 CHCDMO C[C@H]([NH2+]CCc1ccoc1)c1cccc(C(F)(F)F)c1O ZINC000850532850 1123286030 /nfs/dbraw/zinc/28/60/30/1123286030.db2.gz YGPZBDRVMSIZQZ-JTQLQIEISA-N 1 1 299.292 3.897 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(F)cc1O ZINC000850551822 1123289861 /nfs/dbraw/zinc/28/98/61/1123289861.db2.gz KAZYLZHCDKPRDC-WCQYABFASA-N 1 1 287.325 3.863 20 10 CHCDMO Oc1ccccc1C[N@@H+](CC1CCOCC1)C1CCCC1 ZINC000112698140 1123497491 /nfs/dbraw/zinc/49/74/91/1123497491.db2.gz WXEKZWJJRWZUSU-UHFFFAOYSA-N 1 1 289.419 3.563 20 10 CHCDMO CC[C@@H]([NH2+]CC(F)(F)CC)c1ccc(C)cc1O ZINC000858507551 1123659483 /nfs/dbraw/zinc/65/94/83/1123659483.db2.gz PIENVDIJOAYSEM-GFCCVEGCSA-N 1 1 257.324 3.787 20 10 CHCDMO C[C@H]([NH2+]Cc1cocn1)c1ccc(N2CCCCCC2)cc1 ZINC000777035327 1123661497 /nfs/dbraw/zinc/66/14/97/1123661497.db2.gz DPYRXIUJQGTDKJ-HNNXBMFYSA-N 1 1 299.418 3.906 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3c(C)cc(C)cc3C2)c1 ZINC000777218587 1123784910 /nfs/dbraw/zinc/78/49/10/1123784910.db2.gz CDHRZTXOEZNJHK-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO CCOc1cccc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862438378 1123810070 /nfs/dbraw/zinc/81/00/70/1123810070.db2.gz ALNAHDCAKUXXLK-TXEJJXNPSA-N 1 1 299.361 3.514 20 10 CHCDMO Oc1ccccc1C[N@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000862528779 1123816515 /nfs/dbraw/zinc/81/65/15/1123816515.db2.gz ISEFJLUHOCXEQE-OKZBNKHCSA-N 1 1 279.383 3.628 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC3(CCC3)C[C@@H]2C)c1O ZINC000763645406 1129149898 /nfs/dbraw/zinc/14/98/98/1129149898.db2.gz FNDXQHQNTCHVNH-ZDUSSCGKSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c(O)cc1C ZINC000794686855 1123927372 /nfs/dbraw/zinc/92/73/72/1123927372.db2.gz SIMYNTATZWPMAR-AWEZNQCLSA-N 1 1 277.408 3.720 20 10 CHCDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000763647957 1129155141 /nfs/dbraw/zinc/15/51/41/1129155141.db2.gz PHHSRKOCUZMVJY-CYBMUJFWSA-N 1 1 276.399 3.656 20 10 CHCDMO CC[N@@H+](Cc1occc1C)Cc1cc(C)ccc1O ZINC000840969775 1124067469 /nfs/dbraw/zinc/06/74/69/1124067469.db2.gz KFIFDFBJNJSSCI-UHFFFAOYSA-N 1 1 259.349 3.624 20 10 CHCDMO COc1cccc(F)c1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC001120366426 1131275089 /nfs/dbraw/zinc/27/50/89/1131275089.db2.gz UKRNYOLGORLIQY-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872262125 1124701465 /nfs/dbraw/zinc/70/14/65/1124701465.db2.gz QDHUSCDMNKWFOZ-QGZVFWFLSA-N 1 1 289.419 3.624 20 10 CHCDMO CC[N@H+](Cc1ccccc1O)Cc1ccnc(Cl)c1F ZINC001139665471 1131281135 /nfs/dbraw/zinc/28/11/35/1131281135.db2.gz RDSUEKPVKHISSQ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccnc(Cl)c1F ZINC001139665471 1131281137 /nfs/dbraw/zinc/28/11/37/1131281137.db2.gz RDSUEKPVKHISSQ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@@H](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000874090103 1124817062 /nfs/dbraw/zinc/81/70/62/1124817062.db2.gz OPOGDIXDMRYXCH-LBPRGKRZSA-N 1 1 291.435 3.929 20 10 CHCDMO CC(C)[N@@H+](Cc1ccns1)Cc1ccc(N(C)C)cc1 ZINC000876584541 1124964050 /nfs/dbraw/zinc/96/40/50/1124964050.db2.gz IXJJTLQRLREPJE-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO Cc1cccc(O)c1C[N@H+](C)[C@H](C)c1cccs1 ZINC000876590138 1124964579 /nfs/dbraw/zinc/96/45/79/1124964579.db2.gz SVCJZELPPWITLT-GFCCVEGCSA-N 1 1 261.390 3.955 20 10 CHCDMO Cc1cccc(O)c1CNc1cc(C2CC2)cc[nH+]1 ZINC000877540997 1125041954 /nfs/dbraw/zinc/04/19/54/1125041954.db2.gz JOVCRAYWOMFVHO-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO CC(C)O[C@@H](C[N@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877703204 1125066202 /nfs/dbraw/zinc/06/62/02/1125066202.db2.gz WDJCZMFFBDAWIR-IBGZPJMESA-N 1 1 297.398 3.874 20 10 CHCDMO CCc1nocc1C[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000826016877 1125120703 /nfs/dbraw/zinc/12/07/03/1125120703.db2.gz MTRIUBDDFOYEIX-UHFFFAOYSA-N 1 1 294.782 3.536 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1O ZINC000127579564 1125203049 /nfs/dbraw/zinc/20/30/49/1125203049.db2.gz LVSXDCKMRQSJHT-RHSMWYFYSA-N 1 1 297.398 3.779 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCc2ccccc2C1 ZINC000211489250 1125306911 /nfs/dbraw/zinc/30/69/11/1125306911.db2.gz ZWSOADYITRSEOU-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO COc1cccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882905702 1125361531 /nfs/dbraw/zinc/36/15/31/1125361531.db2.gz QBKVTDTYPUMWQW-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cccc(OCC)c1O ZINC000213582865 1125363139 /nfs/dbraw/zinc/36/31/39/1125363139.db2.gz BQLZWGSWSCWTML-OAHLLOKOSA-N 1 1 277.408 3.946 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000882988458 1125366142 /nfs/dbraw/zinc/36/61/42/1125366142.db2.gz QPNHMVDLCVQHLI-OAHLLOKOSA-N 1 1 293.288 3.587 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)C2CCCC2)c1O ZINC000132162627 1125414863 /nfs/dbraw/zinc/41/48/63/1125414863.db2.gz ASGSFNKAMNXIQE-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000091901841 1129374548 /nfs/dbraw/zinc/37/45/48/1129374548.db2.gz RCUFDEQAJKNSIF-UHFFFAOYSA-N 1 1 287.325 3.865 20 10 CHCDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000092326840 1129386498 /nfs/dbraw/zinc/38/64/98/1129386498.db2.gz WAYLTOBKRAOHPK-IUCAKERBSA-N 1 1 278.327 3.548 20 10 CHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861683 1129420741 /nfs/dbraw/zinc/42/07/41/1129420741.db2.gz QXGUYJRCLQFRBM-IAGOWNOFSA-N 1 1 291.435 3.644 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000093704418 1129427324 /nfs/dbraw/zinc/42/73/24/1129427324.db2.gz WSKTVNDOMKYPFF-SFHVURJKSA-N 1 1 296.414 3.777 20 10 CHCDMO CC(C)[N@@H+](CCCCF)Cc1ccc(N(C)C)cc1 ZINC000795868744 1129453937 /nfs/dbraw/zinc/45/39/37/1129453937.db2.gz RWMWKTHHKWRZOW-UHFFFAOYSA-N 1 1 266.404 3.713 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2c(O)cccc2Cl)CC1 ZINC000796020256 1129462830 /nfs/dbraw/zinc/46/28/30/1129462830.db2.gz KTZBAGYBPWGKIE-UHFFFAOYSA-N 1 1 251.757 3.588 20 10 CHCDMO Cc1cc(F)c(C[N@H+](C)Cc2ccccc2O)c(F)c1 ZINC000822443473 1131377895 /nfs/dbraw/zinc/37/78/95/1131377895.db2.gz UWHCAKJEKOQNBE-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1cc(F)c(C[N@@H+](C)Cc2ccccc2O)c(F)c1 ZINC000822443473 1131377903 /nfs/dbraw/zinc/37/79/03/1131377903.db2.gz UWHCAKJEKOQNBE-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccncc1 ZINC000743870147 1129542263 /nfs/dbraw/zinc/54/22/63/1129542263.db2.gz IUHSQPSOZKLXJY-CQSZACIVSA-N 1 1 270.376 3.760 20 10 CHCDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444603 1129578278 /nfs/dbraw/zinc/57/82/78/1129578278.db2.gz XQCDMCCTQKBEOF-LRDDRELGSA-N 1 1 259.393 3.501 20 10 CHCDMO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc(F)cc1O ZINC000720911723 1129720227 /nfs/dbraw/zinc/72/02/27/1129720227.db2.gz LNIAQJQYOUNYPJ-SECBINFHSA-N 1 1 273.298 3.617 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3cccc(F)c3C2)cc1C ZINC000767990398 1129824803 /nfs/dbraw/zinc/82/48/03/1129824803.db2.gz ZOIPGUFYHBAZFX-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)C2CCC(C)CC2)c(O)c1 ZINC000768197822 1129843471 /nfs/dbraw/zinc/84/34/71/1129843471.db2.gz NYNZMXZDFUOZRW-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000768236041 1129845569 /nfs/dbraw/zinc/84/55/69/1129845569.db2.gz CJUZPYLMLPYGGH-HNNXBMFYSA-N 1 1 298.430 3.954 20 10 CHCDMO CCOc1cccc(C[N@@H+](CCC(C)C)C2CC2)c1O ZINC000768257127 1129847778 /nfs/dbraw/zinc/84/77/78/1129847778.db2.gz GZOJLATYEXWMRN-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2CC(C)C)c1 ZINC000768316319 1129852628 /nfs/dbraw/zinc/85/26/28/1129852628.db2.gz CKFVUPQFHUFJPL-OAHLLOKOSA-N 1 1 277.408 3.801 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@@H](CC(C)C)C2)c(O)cc1C ZINC000768465489 1129858761 /nfs/dbraw/zinc/85/87/61/1129858761.db2.gz IDCNBVHWBPGPEA-AWEZNQCLSA-N 1 1 277.408 3.577 20 10 CHCDMO CCC(CC)C[N@@H+](CC)Cc1c(O)cccc1OC ZINC000768507948 1129859533 /nfs/dbraw/zinc/85/95/33/1129859533.db2.gz XVVQESGCLQBQJV-UHFFFAOYSA-N 1 1 265.397 3.659 20 10 CHCDMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000768532886 1129861347 /nfs/dbraw/zinc/86/13/47/1129861347.db2.gz QCEIRGVPWOQJOR-LBPRGKRZSA-N 1 1 276.399 3.655 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](CC(C)C)C1CCCC1 ZINC000768650191 1129866848 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CC[C@H]1CCC[N@@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236801123 1131012115 /nfs/dbraw/zinc/01/21/15/1131012115.db2.gz DDZIJPNIZQHODW-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO COc1cc(C)c(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001236811648 1131012484 /nfs/dbraw/zinc/01/24/84/1131012484.db2.gz UQHPHSDXTQZLPG-YOEHRIQHSA-N 1 1 289.419 3.864 20 10 CHCDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)c(O)c1 ZINC001236821563 1131014141 /nfs/dbraw/zinc/01/41/41/1131014141.db2.gz QXKVKEWFHPADEU-UHFFFAOYSA-N 1 1 299.414 3.958 20 10 CHCDMO COc1cc(C)c(C[N@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC001236817072 1131014741 /nfs/dbraw/zinc/01/47/41/1131014741.db2.gz CLZRXALIDRTKMO-CQSZACIVSA-N 1 1 297.398 3.829 20 10 CHCDMO C[C@@]1(F)CC[N@@H+](Cc2cc3ccccc3cc2O)C[C@@H]1F ZINC001236827184 1131017085 /nfs/dbraw/zinc/01/70/85/1131017085.db2.gz QUHRSKCUMMJNRI-DLBZAZTESA-N 1 1 291.341 3.817 20 10 CHCDMO Oc1cc2ccccc2cc1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001236827525 1131017450 /nfs/dbraw/zinc/01/74/50/1131017450.db2.gz UORYYDYKUOXCFQ-HNNXBMFYSA-N 1 1 295.304 3.725 20 10 CHCDMO Oc1cc2ccccc2cc1C[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001236827525 1131017454 /nfs/dbraw/zinc/01/74/54/1131017454.db2.gz UORYYDYKUOXCFQ-HNNXBMFYSA-N 1 1 295.304 3.725 20 10 CHCDMO Oc1cc2ccccc2cc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001236838131 1131017822 /nfs/dbraw/zinc/01/78/22/1131017822.db2.gz VJHNYIAOLWPGKX-ZBFHGGJFSA-N 1 1 253.345 3.530 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc3ccccc3cc2O)C2(CC2)C1 ZINC001236836261 1131018163 /nfs/dbraw/zinc/01/81/63/1131018163.db2.gz GJUCNENHIXDIIN-ZDUSSCGKSA-N 1 1 267.372 3.920 20 10 CHCDMO CS[C@@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000798180899 1131027912 /nfs/dbraw/zinc/02/79/12/1131027912.db2.gz DHABVODKIXJAER-IUCAKERBSA-N 1 1 293.354 3.813 20 10 CHCDMO CCC[N@@H+](Cc1ccc(OCC)cc1O)[C@@H](C)CC ZINC001237044703 1131038581 /nfs/dbraw/zinc/03/85/81/1131038581.db2.gz MIVOXZCEGIAVPL-ZDUSSCGKSA-N 1 1 265.397 3.801 20 10 CHCDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccncc2)c(O)c1 ZINC001237044778 1131038851 /nfs/dbraw/zinc/03/88/51/1131038851.db2.gz DJWJOKIXKWFPCG-UHFFFAOYSA-N 1 1 270.376 3.543 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2O)[C@H](C)C1 ZINC001237051517 1131041692 /nfs/dbraw/zinc/04/16/92/1131041692.db2.gz MKYPJHDSPMRPIK-CZUORRHYSA-N 1 1 277.408 3.515 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](c3ccncc3)C2)c(O)c1 ZINC001237053970 1131042132 /nfs/dbraw/zinc/04/21/32/1131042132.db2.gz RXPHNLRTJXAZAG-QGZVFWFLSA-N 1 1 296.414 3.900 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCOc3ccccc3C2)c(O)c1 ZINC001237053928 1131043526 /nfs/dbraw/zinc/04/35/26/1131043526.db2.gz RKFBKFBXEGWETC-UHFFFAOYSA-N 1 1 297.398 3.910 20 10 CHCDMO CC[C@H](C)[N@H+](C)Cc1c(O)ccc(Cl)c1Cl ZINC001237079273 1131046801 /nfs/dbraw/zinc/04/68/01/1131046801.db2.gz JMKCHKYIDSNMMF-QMMMGPOBSA-N 1 1 262.180 3.929 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1c(O)ccc(Cl)c1Cl ZINC001237079273 1131046806 /nfs/dbraw/zinc/04/68/06/1131046806.db2.gz JMKCHKYIDSNMMF-QMMMGPOBSA-N 1 1 262.180 3.929 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001237083495 1131047601 /nfs/dbraw/zinc/04/76/01/1131047601.db2.gz DPKHZVYBYAGNJQ-KCJUWKMLSA-N 1 1 272.175 3.683 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001237083495 1131047596 /nfs/dbraw/zinc/04/75/96/1131047596.db2.gz DPKHZVYBYAGNJQ-KCJUWKMLSA-N 1 1 272.175 3.683 20 10 CHCDMO Cc1c(C[N@H+]2CCc3cccc(O)c3C2)ccc(F)c1F ZINC001237167909 1131065245 /nfs/dbraw/zinc/06/52/45/1131065245.db2.gz TYBBDFSDVPPQBR-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816485343 1131099204 /nfs/dbraw/zinc/09/92/04/1131099204.db2.gz JGAGWLAESYSWIW-VIFPVBQESA-N 1 1 283.730 3.971 20 10 CHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816485343 1131099208 /nfs/dbraw/zinc/09/92/08/1131099208.db2.gz JGAGWLAESYSWIW-VIFPVBQESA-N 1 1 283.730 3.971 20 10 CHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CCc2ccsc2C1 ZINC000816512538 1131103350 /nfs/dbraw/zinc/10/33/50/1131103350.db2.gz MBURVKFOSSCANY-UHFFFAOYSA-N 1 1 297.782 3.805 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2c(C)cccc2O)c1 ZINC001237482407 1131103975 /nfs/dbraw/zinc/10/39/75/1131103975.db2.gz LBPLTAHFWLPCMZ-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001237485349 1131104263 /nfs/dbraw/zinc/10/42/63/1131104263.db2.gz ORZUAYHBECEYGV-UHFFFAOYSA-N 1 1 259.393 3.857 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1c(C)cccc1O ZINC001237483752 1131104666 /nfs/dbraw/zinc/10/46/66/1131104666.db2.gz SQFVDAPLGOYWQO-UHFFFAOYSA-N 1 1 255.361 3.723 20 10 CHCDMO C[C@@H](Cc1cccs1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816532633 1131105506 /nfs/dbraw/zinc/10/55/06/1131105506.db2.gz PKUKKHNTFAOCJH-VIFPVBQESA-N 1 1 299.798 3.967 20 10 CHCDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816560353 1131110662 /nfs/dbraw/zinc/11/06/62/1131110662.db2.gz MBRGJGIIMNHODI-SNVBAGLBSA-N 1 1 294.757 3.739 20 10 CHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@@H]1CCCC[C@@H]1O ZINC000816564945 1131111760 /nfs/dbraw/zinc/11/17/60/1131111760.db2.gz WCUYSYDAZVUTQY-YJBOKZPZSA-N 1 1 299.414 3.528 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC000816565052 1131111865 /nfs/dbraw/zinc/11/18/65/1131111865.db2.gz ZQNRBKWTCXKFAG-LRDDRELGSA-N 1 1 273.351 3.725 20 10 CHCDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816613159 1131116019 /nfs/dbraw/zinc/11/60/19/1131116019.db2.gz LAJRTPFIPCDPLG-LJQANCHMSA-N 1 1 299.414 3.530 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000816619752 1131117239 /nfs/dbraw/zinc/11/72/39/1131117239.db2.gz UCOAHAHZVVMXOG-INIZCTEOSA-N 1 1 297.398 3.780 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237810540 1131142612 /nfs/dbraw/zinc/14/26/12/1131142612.db2.gz QGAJYVCNMBLDEW-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1C ZINC001116444437 1131146681 /nfs/dbraw/zinc/14/66/81/1131146681.db2.gz SVPKESUXFGXILR-CVEARBPZSA-N 1 1 272.436 3.907 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001237933605 1131152564 /nfs/dbraw/zinc/15/25/64/1131152564.db2.gz DUNUBWMEDYIWRN-GHMZBOCLSA-N 1 1 283.774 3.807 20 10 CHCDMO CCCC[N@@H+](CCC)Cc1cc(F)cc(C)c1O ZINC001238060090 1131166302 /nfs/dbraw/zinc/16/63/02/1131166302.db2.gz HFBYZVFWKIGACF-UHFFFAOYSA-N 1 1 253.361 3.852 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC3(CCCC3)C2)c1O ZINC001238063503 1131167226 /nfs/dbraw/zinc/16/72/26/1131167226.db2.gz XMGUCHBHSJMHQK-UHFFFAOYSA-N 1 1 263.356 3.606 20 10 CHCDMO CC[N@@H+](Cc1ccncc1)Cc1ccc(N2CCCC2)cc1 ZINC001117583789 1131190009 /nfs/dbraw/zinc/19/00/09/1131190009.db2.gz XIQKRXXTAHCRDO-UHFFFAOYSA-N 1 1 295.430 3.704 20 10 CHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001117638236 1131190438 /nfs/dbraw/zinc/19/04/38/1131190438.db2.gz NXGWASHUTAHUMI-INIZCTEOSA-N 1 1 292.492 3.860 20 10 CHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])c1[O-] ZINC000817959255 1131192038 /nfs/dbraw/zinc/19/20/38/1131192038.db2.gz DMBJCLVRFPCBLD-HUBLWGQQSA-N 1 1 296.842 3.522 20 10 CHCDMO CC[C@@H]([NH2+]CC([NH3+])(CC)CC)c1cc(Cl)ccc1[O-] ZINC000817960820 1131192183 /nfs/dbraw/zinc/19/21/83/1131192183.db2.gz QXCQQRSXBQIXBB-CYBMUJFWSA-N 1 1 284.831 3.604 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC12CC2)c1cccc(C(F)(F)F)c1O ZINC000818356518 1131211465 /nfs/dbraw/zinc/21/14/65/1131211465.db2.gz NWJWMMGMTLKZKP-GZMMTYOYSA-N 1 1 271.282 3.614 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CC12CC2)c1cc(Cl)c(Cl)cc1O ZINC000818357197 1131211838 /nfs/dbraw/zinc/21/18/38/1131211838.db2.gz WNCHDVCOVFOETF-KRTXAFLBSA-N 1 1 272.175 3.902 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@H](F)C2)c(C)n1-c1ccccc1 ZINC001137854024 1131424250 /nfs/dbraw/zinc/42/42/50/1131424250.db2.gz FMWFZYSEOWQUIS-INIZCTEOSA-N 1 1 272.367 3.638 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@@H](F)C2)ccc1N1CCCCC1 ZINC000830480489 1131458645 /nfs/dbraw/zinc/45/86/45/1131458645.db2.gz QQMDUFXLXGFQEX-MRXNPFEDSA-N 1 1 276.399 3.529 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC(c2cccs2)CC1 ZINC001138127465 1131470311 /nfs/dbraw/zinc/47/03/11/1131470311.db2.gz DONGTKPGIQJXJQ-UHFFFAOYSA-N 1 1 291.391 3.972 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccco2)cc1Cl ZINC000824522479 1131472349 /nfs/dbraw/zinc/47/23/49/1131472349.db2.gz PDGCXFFINNDBAJ-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1c(C[N@@H+]2CCC[C@H](C)C2)c2ccccc2n1C ZINC001138252810 1131482101 /nfs/dbraw/zinc/48/21/01/1131482101.db2.gz VNFHDLBFSCUXGV-ZDUSSCGKSA-N 1 1 256.393 3.719 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1c2ccccc2n(C)c1C ZINC001138257123 1131483252 /nfs/dbraw/zinc/48/32/52/1131483252.db2.gz XGUFHVQKCSSTDU-AWEZNQCLSA-N 1 1 256.393 3.861 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCC[C@@H]4CCC[C@@H]43)ccc21 ZINC001138355736 1131493967 /nfs/dbraw/zinc/49/39/67/1131493967.db2.gz BDCPTXRWNAKFBF-LPHOPBHVSA-N 1 1 284.447 3.834 20 10 CHCDMO CCCC[N@@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138388008 1131496973 /nfs/dbraw/zinc/49/69/73/1131496973.db2.gz ONJISLWBSXACCD-UHFFFAOYSA-N 1 1 278.440 3.773 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccncc2)cc1Cl ZINC000825501307 1131513476 /nfs/dbraw/zinc/51/34/76/1131513476.db2.gz ODNGLMJKRRLTDD-LBPRGKRZSA-N 1 1 290.794 3.942 20 10 CHCDMO Cc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1N(C)C ZINC001139672719 1131627082 /nfs/dbraw/zinc/62/70/82/1131627082.db2.gz CUAYIKDNPQKSMK-WMZOPIPTSA-N 1 1 272.436 3.826 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccccc1C1CC1)CC2 ZINC001139883089 1131645582 /nfs/dbraw/zinc/64/55/82/1131645582.db2.gz AUOUAGWWFRWBFZ-UHFFFAOYSA-N 1 1 279.383 3.828 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Br)C2(CC2)C1 ZINC001140103530 1131664600 /nfs/dbraw/zinc/66/46/00/1131664600.db2.gz NRFUZKIQNSHTLW-JTQLQIEISA-N 1 1 296.208 3.529 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc3cnccc3o2)cc1 ZINC000845903869 1131669119 /nfs/dbraw/zinc/66/91/19/1131669119.db2.gz URSDIXFPZWWBGR-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CCc2ccccc2)c1O ZINC001140181514 1131672990 /nfs/dbraw/zinc/67/29/90/1131672990.db2.gz VSTGQEJSDNBBOT-UHFFFAOYSA-N 1 1 269.388 3.684 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCc3sccc3C2)c1O ZINC001140180936 1131673319 /nfs/dbraw/zinc/67/33/19/1131673319.db2.gz NVQWLSXXDLHEFF-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](Cc2ccco2)C2CC2)c1O ZINC001140184080 1131674096 /nfs/dbraw/zinc/67/40/96/1131674096.db2.gz MAIOKAOLYYAUCV-UHFFFAOYSA-N 1 1 271.360 3.767 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@]3(CC3(F)F)C2)ccc2ccccc21 ZINC000846115988 1131688151 /nfs/dbraw/zinc/68/81/51/1131688151.db2.gz CTHKDWYYYCDPQW-INIZCTEOSA-N 1 1 289.325 3.777 20 10 CHCDMO Oc1cccc(Cl)c1C[N@@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001140337738 1131702853 /nfs/dbraw/zinc/70/28/53/1131702853.db2.gz BQUKOBPVGLJVDD-AOOOYVTPSA-N 1 1 287.737 3.523 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001140341510 1131703379 /nfs/dbraw/zinc/70/33/79/1131703379.db2.gz SATIVZHQRPWNDB-VIFPVBQESA-N 1 1 275.726 3.523 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC001140345500 1131704641 /nfs/dbraw/zinc/70/46/41/1131704641.db2.gz VLHABVFZGDDZJK-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1ccc(F)cc1O ZINC000834905064 1131728945 /nfs/dbraw/zinc/72/89/45/1131728945.db2.gz FDGBKVTYHJTGHU-CQDKDKBSSA-N 1 1 263.356 3.618 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461380 1131747099 /nfs/dbraw/zinc/74/70/99/1131747099.db2.gz JZEDKQGAGFKOLS-VIFPVBQESA-N 1 1 275.726 3.523 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC12CCCC2 ZINC001140462994 1131749086 /nfs/dbraw/zinc/74/90/86/1131749086.db2.gz RHMIDOCFRFWNDP-UHFFFAOYSA-N 1 1 251.757 3.564 20 10 CHCDMO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)Cc1ccncc1 ZINC000835054829 1131767032 /nfs/dbraw/zinc/76/70/32/1131767032.db2.gz ZKALTQKUCAPAFY-WAYWQWQTSA-N 1 1 295.430 3.683 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140542605 1131786062 /nfs/dbraw/zinc/78/60/62/1131786062.db2.gz PTRVTRMHZLXYGT-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140542605 1131786067 /nfs/dbraw/zinc/78/60/67/1131786067.db2.gz PTRVTRMHZLXYGT-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCSc3ccccc3C2)c1 ZINC001140623701 1131832316 /nfs/dbraw/zinc/83/23/16/1131832316.db2.gz QPNWRXZESIVAEJ-UHFFFAOYSA-N 1 1 285.412 3.809 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](F)CC2)c(O)c1 ZINC001140850037 1131945845 /nfs/dbraw/zinc/94/58/45/1131945845.db2.gz BBYYARNJNRCZMJ-HNNXBMFYSA-N 1 1 294.414 3.562 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2C(C)C)c(O)c1 ZINC001140856477 1131948474 /nfs/dbraw/zinc/94/84/74/1131948474.db2.gz CJOONTBWEKJNQI-KRWDZBQOSA-N 1 1 290.451 3.859 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCCC[C@H](F)C2)c(Cl)c1 ZINC001140922548 1131963256 /nfs/dbraw/zinc/96/32/56/1131963256.db2.gz UGOJGBLFGZBVCU-ZDUSSCGKSA-N 1 1 284.806 3.730 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@H](F)C2)c(Cl)c1 ZINC001140922548 1131963263 /nfs/dbraw/zinc/96/32/63/1131963263.db2.gz UGOJGBLFGZBVCU-ZDUSSCGKSA-N 1 1 284.806 3.730 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1Cl ZINC001140923657 1131966376 /nfs/dbraw/zinc/96/63/76/1131966376.db2.gz GCPUZHNOGHLYCK-CYBMUJFWSA-N 1 1 266.816 3.780 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2ccc(C)cc2O)c1 ZINC001140948611 1131969217 /nfs/dbraw/zinc/96/92/17/1131969217.db2.gz QXLBTZBFOXNURQ-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140951010 1131971856 /nfs/dbraw/zinc/97/18/56/1131971856.db2.gz SXUSIZUJDZCWRZ-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO CC(C)N(CC[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000037188684 1132009964 /nfs/dbraw/zinc/00/99/64/1132009964.db2.gz KHYZTVMWXYZFEA-INIZCTEOSA-N 1 1 291.483 3.522 20 10 CHCDMO C[C@@H]1CC[C@@H]([N@H+]2CCCc3cc(O)c(O)cc3C2)C[C@H]1C ZINC001172379415 1132171550 /nfs/dbraw/zinc/17/15/50/1132171550.db2.gz OGJDVXGEPJBOSU-XJKCOSOUSA-N 1 1 289.419 3.671 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000840187172 1132249368 /nfs/dbraw/zinc/24/93/68/1132249368.db2.gz ACFOLSZCFIFSGA-OAHLLOKOSA-N 1 1 282.387 3.562 20 10 CHCDMO 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OKENWFPKFVESPT-QGZVFWFLSA-N 1 1 297.398 3.876 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3cccc(O)c3C2)c(C)c1 ZINC001203746854 1133364482 /nfs/dbraw/zinc/36/44/82/1133364482.db2.gz XWYIPVNIDAFBNG-UHFFFAOYSA-N 1 1 281.399 3.876 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(O)c(O)c2)c1 ZINC001203873290 1133378895 /nfs/dbraw/zinc/37/88/95/1133378895.db2.gz BFMGTBGIEZNOAF-MRXNPFEDSA-N 1 1 283.371 3.743 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2COC)cc1 ZINC001203940788 1133386474 /nfs/dbraw/zinc/38/64/74/1133386474.db2.gz ZIEAWYUOYKXOES-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c2ccccc21 ZINC001204240340 1133423744 /nfs/dbraw/zinc/42/37/44/1133423744.db2.gz PFPNTRURXFJONL-MPGHIAIKSA-N 1 1 298.405 3.838 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2CF)c2ccccc21 ZINC001204241165 1133424588 /nfs/dbraw/zinc/42/45/88/1133424588.db2.gz YITQVXMKCKWTHE-OAHLLOKOSA-N 1 1 286.394 3.840 20 10 CHCDMO Oc1ccc(C[N@H+]2CCCC[C@H]2c2ccccc2)c(O)c1 ZINC001204272522 1133427139 /nfs/dbraw/zinc/42/71/39/1133427139.db2.gz PCONUTKJJPLINY-KRWDZBQOSA-N 1 1 283.371 3.825 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324925 1133437727 /nfs/dbraw/zinc/43/77/27/1133437727.db2.gz PKKHSRXRPSDYES-INIZCTEOSA-N 1 1 272.436 3.909 20 10 CHCDMO CCc1cccc(C[N@@H+](C)Cc2ccccc2F)c1O ZINC001204714658 1133478351 /nfs/dbraw/zinc/47/83/51/1133478351.db2.gz XESOYZXAXDGOCU-UHFFFAOYSA-N 1 1 273.351 3.726 20 10 CHCDMO CCC[C@@H](C[N@@H+](Cc1ccccc1O)C1CCCC1)OC ZINC001204923353 1133500152 /nfs/dbraw/zinc/50/01/52/1133500152.db2.gz KUJHFNJBBCJQAQ-KRWDZBQOSA-N 1 1 291.435 3.952 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CC1CCC(F)(F)CC1 ZINC001205527607 1133584803 /nfs/dbraw/zinc/58/48/03/1133584803.db2.gz YMLWKJBLOLJSMB-UHFFFAOYSA-N 1 1 289.753 3.961 20 10 CHCDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(C(C)C)ccc1O ZINC001205589535 1133591495 /nfs/dbraw/zinc/59/14/95/1133591495.db2.gz QKBNOYMEGCODME-SFHVURJKSA-N 1 1 291.435 3.643 20 10 CHCDMO Cc1nc(C)c(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)o1 ZINC001205708967 1133604743 /nfs/dbraw/zinc/60/47/43/1133604743.db2.gz MVVIHXOMTWIAAN-UHFFFAOYSA-N 1 1 299.418 3.524 20 10 CHCDMO Cc1cccnc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001205793705 1133613964 /nfs/dbraw/zinc/61/39/64/1133613964.db2.gz ZWUAYVOHNBQRFG-UHFFFAOYSA-N 1 1 295.430 3.622 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC001206049659 1133649512 /nfs/dbraw/zinc/64/95/12/1133649512.db2.gz QHMVFEQJJNSTOA-QGZVFWFLSA-N 1 1 270.351 3.745 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CCC[C@@H]1C=CCC1 ZINC001207424160 1133798685 /nfs/dbraw/zinc/79/86/85/1133798685.db2.gz MRHXMJQNLJIRLL-GFCCVEGCSA-N 1 1 265.784 3.882 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CC2(c3ccccc3)CC2)cc1 ZINC001207839909 1133852981 /nfs/dbraw/zinc/85/29/81/1133852981.db2.gz YSTXVISFAKRKEX-UHFFFAOYSA-N 1 1 294.442 3.916 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)CC1(c2ccccc2)CC1 ZINC001207839187 1133853080 /nfs/dbraw/zinc/85/30/80/1133853080.db2.gz ITFSSLRNAFKRKV-UHFFFAOYSA-N 1 1 281.399 3.946 20 10 CHCDMO CC/C=C\CC[N@@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001208734571 1133937113 /nfs/dbraw/zinc/93/71/13/1133937113.db2.gz PXUTUYMTADALCE-FPLPWBNLSA-N 1 1 260.425 3.931 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCc1ccc(Cl)cc1)CC2 ZINC001208741598 1133939973 /nfs/dbraw/zinc/93/99/73/1133939973.db2.gz GKJNMWCMMYFNQN-UHFFFAOYSA-N 1 1 287.790 3.646 20 10 CHCDMO CC(=O)[C@H]1CC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209519695 1134034738 /nfs/dbraw/zinc/03/47/38/1134034738.db2.gz FLECPAMIBHTMKC-SFHVURJKSA-N 1 1 296.414 3.505 20 10 CHCDMO CC(C)c1cc([N@H+](C)c2ccc(N)cc2)ccc1N ZINC001216046523 1134760090 /nfs/dbraw/zinc/76/00/90/1134760090.db2.gz FALMUJFDYTVFOT-UHFFFAOYSA-N 1 1 255.365 3.742 20 10 CHCDMO CC(C)c1cc([N@@H+](C)c2ccc(N)cc2)ccc1N ZINC001216046523 1134760096 /nfs/dbraw/zinc/76/00/96/1134760096.db2.gz FALMUJFDYTVFOT-UHFFFAOYSA-N 1 1 255.365 3.742 20 10 CHCDMO Cc1cccc(NCc2ccc(N3CCSCC3)cc2)[nH+]1 ZINC000114184827 228044192 /nfs/dbraw/zinc/04/41/92/228044192.db2.gz YRYQAIIKHUWUDJ-UHFFFAOYSA-N 1 1 299.443 3.555 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000179585630 261800396 /nfs/dbraw/zinc/80/03/96/261800396.db2.gz MRMNUNRFQMHFIU-UHFFFAOYSA-N 1 1 273.298 3.557 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1ccc(F)cc1O ZINC000285496601 263093385 /nfs/dbraw/zinc/09/33/85/263093385.db2.gz APSYXSOZKBCRIE-KMFMINBZSA-N 1 1 293.382 3.530 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(C)on2)cc1 ZINC000282689655 328243106 /nfs/dbraw/zinc/24/31/06/328243106.db2.gz NZHOBXRMYYYCJI-CQSZACIVSA-N 1 1 287.407 3.680 20 10 CHCDMO CC[C@H]([NH2+]Cc1cccc(F)c1O)c1ccccc1 ZINC000083432501 326936365 /nfs/dbraw/zinc/93/63/65/326936365.db2.gz BNVDXPNXVKTTRX-HNNXBMFYSA-N 1 1 259.324 3.772 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(F)cc1O ZINC000403416278 327360723 /nfs/dbraw/zinc/36/07/23/327360723.db2.gz WMEANHVMCHUSSP-QNWHQSFQSA-N 1 1 263.356 3.618 20 10 CHCDMO CC[C@H](Nc1cc(CCOC)cc[nH+]1)c1ccccc1O ZINC000287391507 522765851 /nfs/dbraw/zinc/76/58/51/522765851.db2.gz IRPUUNYGKNTRLO-HNNXBMFYSA-N 1 1 286.375 3.539 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(C)ccc1O ZINC000290557638 522967806 /nfs/dbraw/zinc/96/78/06/522967806.db2.gz SECUUHOCXZHXDJ-MRXNPFEDSA-N 1 1 270.376 3.679 20 10 CHCDMO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062747710 524154944 /nfs/dbraw/zinc/15/49/44/524154944.db2.gz BPUPEQRGQUJLDO-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@H]([NH2+]Cc1ccn(C)c1)c1cc(Cl)c(Cl)cc1O ZINC000278356430 525468253 /nfs/dbraw/zinc/46/82/53/525468253.db2.gz BCNUDHVTEGRCJY-VIFPVBQESA-N 1 1 299.201 3.888 20 10 CHCDMO C[C@@H](O)CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278973361 525759084 /nfs/dbraw/zinc/75/90/84/525759084.db2.gz CGPHPSMKYHZUPZ-RKDXNWHRSA-N 1 1 292.206 3.511 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127428115 526364079 /nfs/dbraw/zinc/36/40/79/526364079.db2.gz QKFHNVMMTFPMDZ-AWEZNQCLSA-N 1 1 276.767 3.711 20 10 CHCDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccccc1O ZINC000109772796 1125469593 /nfs/dbraw/zinc/46/95/93/1125469593.db2.gz AQNCPDDOYUYUNL-LBPRGKRZSA-N 1 1 259.324 3.724 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)CC2CCCCC2)c1O ZINC000133574332 1125475708 /nfs/dbraw/zinc/47/57/08/1125475708.db2.gz KETSVUWADTWTBK-UHFFFAOYSA-N 1 1 277.408 3.803 20 10 CHCDMO C[N@H+](Cc1csc(C(C)(C)C)n1)Cc1ccccc1O ZINC000111235225 1125481381 /nfs/dbraw/zinc/48/13/81/1125481381.db2.gz ZOXPUTLEFUQARG-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO C[N@@H+](Cc1csc(C(C)(C)C)n1)Cc1ccccc1O ZINC000111235225 1125481382 /nfs/dbraw/zinc/48/13/82/1125481382.db2.gz ZOXPUTLEFUQARG-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000689882082 1120436254 /nfs/dbraw/zinc/43/62/54/1120436254.db2.gz MDZMFWIIDATQAV-NSHDSACASA-N 1 1 271.763 3.617 20 10 CHCDMO C[C@H]1CCC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001177240679 1121719463 /nfs/dbraw/zinc/71/94/63/1121719463.db2.gz QIUVQUGCTDJPKI-UWVGGRQHSA-N 1 1 271.763 3.853 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001182865564 1122192314 /nfs/dbraw/zinc/19/23/14/1122192314.db2.gz ZNUWZXZWKNAUGZ-UTUOFQBUSA-N 1 1 287.737 3.569 20 10 CHCDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccs2)c(O)c1 ZINC000876589790 1124964353 /nfs/dbraw/zinc/96/43/53/1124964353.db2.gz OUMCMDIQHBKZJY-LBPRGKRZSA-N 1 1 261.390 3.955 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)CCc2cccs2)c(O)c1 ZINC001231846156 1132378885 /nfs/dbraw/zinc/37/88/85/1132378885.db2.gz GXWRCZVHPWLDFN-UHFFFAOYSA-N 1 1 275.417 3.745 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)cc1Cl ZINC001231868667 1132385073 /nfs/dbraw/zinc/38/50/73/1132385073.db2.gz VZFCSVJBRITMFE-UONOGXRCSA-N 1 1 289.753 3.626 20 10 CHCDMO C[C@@H]([NH2+]C1CCSCC1)c1ccc(Cl)cc1O ZINC000841749650 1132390527 /nfs/dbraw/zinc/39/05/27/1132390527.db2.gz PVMMCGVSCWGSJP-SECBINFHSA-N 1 1 271.813 3.592 20 10 CHCDMO CC1CC([N@@H+](C)Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143103642 1132501248 /nfs/dbraw/zinc/50/12/48/1132501248.db2.gz IHGWJMDCJWMGCW-UHFFFAOYSA-N 1 1 261.409 3.920 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1c(O)cccc1Cl ZINC000133736688 1132604653 /nfs/dbraw/zinc/60/46/53/1132604653.db2.gz SGLNQFCQLWLWRT-WDEREUQCSA-N 1 1 253.773 3.666 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001203657424 1133349819 /nfs/dbraw/zinc/34/98/19/1133349819.db2.gz KWPGIFOOWDZPCE-VIFPVBQESA-N 1 1 275.726 3.523 20 10 CHCDMO CC[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)N1CCCC1 ZINC000841746228 1125571076 /nfs/dbraw/zinc/57/10/76/1125571076.db2.gz WFZMOZYWQBVEDD-TZMCWYRMSA-N 1 1 296.842 3.571 20 10 CHCDMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000137278390 1125657285 /nfs/dbraw/zinc/65/72/85/1125657285.db2.gz VVEHKOLCSQTJQO-CQSZACIVSA-N 1 1 255.361 3.894 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1c(C)noc1C ZINC000886556982 1125690016 /nfs/dbraw/zinc/69/00/16/1125690016.db2.gz OFZQENJGUIMNME-ZANVPECISA-N 1 1 292.354 3.938 20 10 CHCDMO COCC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccco1 ZINC000886587535 1125694399 /nfs/dbraw/zinc/69/43/99/1125694399.db2.gz ASIZMIWDSZJWSE-DGCLKSJQSA-N 1 1 293.338 3.553 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1c(O)cccc1F ZINC000886626703 1125699356 /nfs/dbraw/zinc/69/93/56/1125699356.db2.gz JCCNHKWGFWGTHL-GFCCVEGCSA-N 1 1 288.366 3.555 20 10 CHCDMO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1c(O)cccc1F ZINC000886619163 1125699446 /nfs/dbraw/zinc/69/94/46/1125699446.db2.gz VGXNAVZDGBQMTC-QPUJVOFHSA-N 1 1 292.181 3.766 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1c(O)cccc1F ZINC000886619235 1125699771 /nfs/dbraw/zinc/69/97/71/1125699771.db2.gz XGTYLASYNMFMJG-NXEZZACHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1c(O)cccc1F ZINC000886649619 1125702924 /nfs/dbraw/zinc/70/29/24/1125702924.db2.gz DUFBBDOFGABNBJ-VIFPVBQESA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1ccc(F)cc1O ZINC000886731123 1125714141 /nfs/dbraw/zinc/71/41/41/1125714141.db2.gz VSJFDMYTVHZVPX-JSGCOSHPSA-N 1 1 293.382 3.531 20 10 CHCDMO CSCC[C@@H](C)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792165740 1130434953 /nfs/dbraw/zinc/43/49/53/1130434953.db2.gz KUOCDJIFMPFWRE-SECBINFHSA-N 1 1 291.819 3.758 20 10 CHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792165740 1130434957 /nfs/dbraw/zinc/43/49/57/1130434957.db2.gz KUOCDJIFMPFWRE-SECBINFHSA-N 1 1 291.819 3.758 20 10 CHCDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccccc1O)c1ccccc1 ZINC000179580176 1126830944 /nfs/dbraw/zinc/83/09/44/1126830944.db2.gz GAWAOEMWSXRRBI-QGZVFWFLSA-N 1 1 295.382 3.630 20 10 CHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000179935616 1126836853 /nfs/dbraw/zinc/83/68/53/1126836853.db2.gz PKFXDMQKKHZUSV-SNVBAGLBSA-N 1 1 265.353 3.786 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@H]2C(C)C)c1 ZINC000781924248 1130748965 /nfs/dbraw/zinc/74/89/65/1130748965.db2.gz OMJIYXSJDKIEHK-ZDUSSCGKSA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@H]2C(C)C)c1 ZINC000781924248 1130748967 /nfs/dbraw/zinc/74/89/67/1130748967.db2.gz OMJIYXSJDKIEHK-ZDUSSCGKSA-N 1 1 298.224 3.693 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CCCCS1)c1ccc(F)cc1O ZINC000796932814 1130946833 /nfs/dbraw/zinc/94/68/33/1130946833.db2.gz LUZKSJONJACTGS-OCCSQVGLSA-N 1 1 283.412 3.858 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC(C)=C(Br)C2)c1O ZINC000797604156 1130994613 /nfs/dbraw/zinc/99/46/13/1130994613.db2.gz AGZWTMZGVGDCLK-UHFFFAOYSA-N 1 1 296.208 3.575 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cscn2)cc1 ZINC000271113213 1127068555 /nfs/dbraw/zinc/06/85/55/1127068555.db2.gz HQOUVYWLEUUSBA-ZDUSSCGKSA-N 1 1 289.448 3.840 20 10 CHCDMO COc1ccc(C[N@H+]2[C@H](C)CCC[C@@H]2C)c(O)c1Cl ZINC001236806537 1131012028 /nfs/dbraw/zinc/01/20/28/1131012028.db2.gz YBEXMRIPGVNWOW-PHIMTYICSA-N 1 1 283.799 3.817 20 10 CHCDMO COc1ccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c(O)c1Cl ZINC001236806537 1131012034 /nfs/dbraw/zinc/01/20/34/1131012034.db2.gz YBEXMRIPGVNWOW-PHIMTYICSA-N 1 1 283.799 3.817 20 10 CHCDMO CCCCOC1C[NH+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237053332 1131042501 /nfs/dbraw/zinc/04/25/01/1131042501.db2.gz JNAVGEMBUVJNMD-UHFFFAOYSA-N 1 1 277.408 3.517 20 10 CHCDMO CCCCC[N@@H+](C)Cc1c(O)cccc1OC(F)(F)F ZINC001237121594 1131057050 /nfs/dbraw/zinc/05/70/50/1131057050.db2.gz XZNSFUVIBJTDNQ-UHFFFAOYSA-N 1 1 291.313 3.913 20 10 CHCDMO Cc1ccoc1C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816617002 1131115775 /nfs/dbraw/zinc/11/57/75/1131115775.db2.gz LRRQYDXYQCLKSU-UHFFFAOYSA-N 1 1 283.730 3.718 20 10 CHCDMO Cc1ccoc1C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816617002 1131115777 /nfs/dbraw/zinc/11/57/77/1131115777.db2.gz LRRQYDXYQCLKSU-UHFFFAOYSA-N 1 1 283.730 3.718 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2cc(F)c(Cl)cc2O)C2(CC2)C1 ZINC001237939810 1131154160 /nfs/dbraw/zinc/15/41/60/1131154160.db2.gz GHNVLNZZBSUEFV-VIFPVBQESA-N 1 1 269.747 3.559 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)c(Cl)cc2O)C2(CC2)C1 ZINC001237939810 1131154164 /nfs/dbraw/zinc/15/41/64/1131154164.db2.gz GHNVLNZZBSUEFV-VIFPVBQESA-N 1 1 269.747 3.559 20 10 CHCDMO CC[C@@H]([NH2+]Cc1nc(C)cs1)c1ccc(F)cc1O ZINC000285784579 1127242942 /nfs/dbraw/zinc/24/29/42/1127242942.db2.gz UJVHWUNGEOSUAK-GFCCVEGCSA-N 1 1 280.368 3.537 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(F)cc1O ZINC000286218299 1127263486 /nfs/dbraw/zinc/26/34/86/1127263486.db2.gz SFJMTPXMACTJIE-GXFFZTMASA-N 1 1 294.395 3.832 20 10 CHCDMO CCOC1CC(CC[NH2+][C@H](CC)c2ccc(F)cc2O)C1 ZINC000287651999 1127311921 /nfs/dbraw/zinc/31/19/21/1127311921.db2.gz UZTGQEHBDLWUCN-LDZOIKDWSA-N 1 1 295.398 3.777 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CC(C2CCCCC2)C1 ZINC001308808214 1127488432 /nfs/dbraw/zinc/48/84/32/1127488432.db2.gz QLXZCNYUZNCZAU-UHFFFAOYSA-N 1 1 263.356 3.543 20 10 CHCDMO CCc1noc(C)c1C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000293669467 1127512149 /nfs/dbraw/zinc/51/21/49/1127512149.db2.gz JIVDTYSWGIFDJF-AWEZNQCLSA-N 1 1 292.354 3.631 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)ccc1N(C)C ZINC000293700792 1127513538 /nfs/dbraw/zinc/51/35/38/1127513538.db2.gz XDISFGPGSDMVPG-JKSUJKDBSA-N 1 1 294.389 3.538 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1cc(Cl)cc(OC)c1O ZINC000761194348 1127517600 /nfs/dbraw/zinc/51/76/00/1127517600.db2.gz ZFCPERWQNRDAQD-UHFFFAOYSA-N 1 1 295.766 3.669 20 10 CHCDMO CC[C@@H]([NH2+]CCC1(COC)CCC1)c1ccc(F)cc1O ZINC000293759312 1127518019 /nfs/dbraw/zinc/51/80/19/1127518019.db2.gz RDMVUTDLHKYTFJ-OAHLLOKOSA-N 1 1 295.398 3.779 20 10 CHCDMO C[C@H]1CCC[C@H]([NH2+]Cc2c(O)cccc2F)CC1 ZINC001308947533 1127598027 /nfs/dbraw/zinc/59/80/27/1127598027.db2.gz GDGPWNYCHZXVBX-RYUDHWBXSA-N 1 1 251.345 3.590 20 10 CHCDMO CC[C@H]([NH2+]CCc1ncccc1C)c1ccc(F)cc1O ZINC000296462489 1127672102 /nfs/dbraw/zinc/67/21/02/1127672102.db2.gz NJNQYRDKEKYFNB-HNNXBMFYSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1ccc(F)cc1O ZINC000230407940 1127751946 /nfs/dbraw/zinc/75/19/46/1127751946.db2.gz IXDZFOJUWGSKKR-WOPDTQHZSA-N 1 1 251.345 3.618 20 10 CHCDMO C[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccc(F)cc1O ZINC000062748473 1127773850 /nfs/dbraw/zinc/77/38/50/1127773850.db2.gz KFAOWULNLYWXSE-JTQLQIEISA-N 1 1 295.304 3.703 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)cc1 ZINC000374302213 1127887948 /nfs/dbraw/zinc/88/79/48/1127887948.db2.gz NVLKOEOHHQZYTM-OAHLLOKOSA-N 1 1 287.432 3.546 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2nccs2)cc1 ZINC000374302213 1127887950 /nfs/dbraw/zinc/88/79/50/1127887950.db2.gz NVLKOEOHHQZYTM-OAHLLOKOSA-N 1 1 287.432 3.546 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)ccc2C1 ZINC001168440946 1128067435 /nfs/dbraw/zinc/06/74/35/1128067435.db2.gz NQGVBKDWBKSSSY-KRWDZBQOSA-N 1 1 285.362 3.521 20 10 CHCDMO Cc1cc(O)c(C[N@H+]([C@@H](C)C2CC2)C2CC2)cc1C ZINC000914850615 1128254103 /nfs/dbraw/zinc/25/41/03/1128254103.db2.gz MUGIUFXBHBPHTG-ZDUSSCGKSA-N 1 1 259.393 3.772 20 10 CHCDMO C[C@@H]([N@@H+](C)Cc1c(O)ccc2ccncc21)C(C)(C)C ZINC000914569538 1128211331 /nfs/dbraw/zinc/21/13/31/1128211331.db2.gz XMNNAIPQNKABCT-GFCCVEGCSA-N 1 1 272.392 3.807 20 10 CHCDMO C[C@@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccc(N(C)C)cc1 ZINC000777693397 1128242895 /nfs/dbraw/zinc/24/28/95/1128242895.db2.gz JVEDCFZXLPMTPF-CYBMUJFWSA-N 1 1 294.402 3.812 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC000754726796 1128299116 /nfs/dbraw/zinc/29/91/16/1128299116.db2.gz UBUFENZRIUMOPA-SWLSCSKDSA-N 1 1 277.408 3.720 20 10 CHCDMO CC[N@@H+](Cc1c2ccccc2n(C)c1C)Cc1cccnc1 ZINC001138256838 1128303417 /nfs/dbraw/zinc/30/34/17/1128303417.db2.gz MLBUQPRYAXFRQQ-UHFFFAOYSA-N 1 1 293.414 3.904 20 10 CHCDMO CC(C)C(C[NH2+]Cc1cccc(F)c1O)C(C)C ZINC000229533024 1128344841 /nfs/dbraw/zinc/34/48/41/1128344841.db2.gz PLGLHHFVWKXWSD-UHFFFAOYSA-N 1 1 253.361 3.549 20 10 CHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc2c(cc1O)CCC2 ZINC000915826224 1128350187 /nfs/dbraw/zinc/35/01/87/1128350187.db2.gz XVGLMDIUUGQPFU-UHFFFAOYSA-N 1 1 285.362 3.652 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000917075127 1128474740 /nfs/dbraw/zinc/47/47/40/1128474740.db2.gz HCMDFSPRKZZGQB-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO CC(C)=CC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075415 1128475140 /nfs/dbraw/zinc/47/51/40/1128475140.db2.gz VMNLGPOBKTUMMQ-UHFFFAOYSA-N 1 1 260.425 3.929 20 10 CHCDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ccccc1O ZINC000778995527 1128674816 /nfs/dbraw/zinc/67/48/16/1128674816.db2.gz BFFAYGZIGUCHMN-SFHVURJKSA-N 1 1 297.398 3.910 20 10 CHCDMO CCC(CC)[N@@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778996436 1128675232 /nfs/dbraw/zinc/67/52/32/1128675232.db2.gz ONWBADXFVAPBIM-UHFFFAOYSA-N 1 1 251.345 3.684 20 10 CHCDMO CC[N@@H+](CCc1cccs1)Cc1cc(F)ccc1O ZINC000778999625 1128675344 /nfs/dbraw/zinc/67/53/44/1128675344.db2.gz IZLSNVRRMGSPFB-UHFFFAOYSA-N 1 1 279.380 3.657 20 10 CHCDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccccc2O)C1 ZINC000779022977 1128686883 /nfs/dbraw/zinc/68/68/83/1128686883.db2.gz MZWXBEISTRFVAZ-SFHVURJKSA-N 1 1 267.372 3.556 20 10 CHCDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179564979 1128748700 /nfs/dbraw/zinc/74/87/00/1128748700.db2.gz IDRDXRRRCOIDGZ-QGZVFWFLSA-N 1 1 297.398 3.608 20 10 CHCDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1O ZINC000179576727 1128749594 /nfs/dbraw/zinc/74/95/94/1128749594.db2.gz YLCRFNSYHOGBER-PBHICJAKSA-N 1 1 267.372 3.770 20 10 CHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179646443 1128751677 /nfs/dbraw/zinc/75/16/77/1128751677.db2.gz MJSQBUXBCPQAHC-CRAIPNDOSA-N 1 1 299.414 3.726 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c1O ZINC000779149036 1128752300 /nfs/dbraw/zinc/75/23/00/1128752300.db2.gz KCRWFMMGTAKMNI-NOZJJQNGSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c1O ZINC000779149036 1128752304 /nfs/dbraw/zinc/75/23/04/1128752304.db2.gz KCRWFMMGTAKMNI-NOZJJQNGSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098297 1118134963 /nfs/dbraw/zinc/13/49/63/1118134963.db2.gz GITHWOWKYGYYHN-UONOGXRCSA-N 1 1 291.435 3.607 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(C#N)cc1)Cc1cc(F)ccc1O ZINC000179933637 1128767413 /nfs/dbraw/zinc/76/74/13/1128767413.db2.gz RYUZJVPTORYVQA-UHFFFAOYSA-N 1 1 298.361 3.814 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000179926519 1128768065 /nfs/dbraw/zinc/76/80/65/1128768065.db2.gz PWJJEVAOASXMIA-UHFFFAOYSA-N 1 1 277.364 3.757 20 10 CHCDMO COc1cc(F)cc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000186216560 1118360790 /nfs/dbraw/zinc/36/07/90/1118360790.db2.gz JROFTVNXWDTLCJ-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO CC[N@@H+](Cc1ccccn1)Cc1cc2c(cc1O)CCCC2 ZINC000160380418 1118381011 /nfs/dbraw/zinc/38/10/11/1118381011.db2.gz QXRSZIFLZWEKQS-UHFFFAOYSA-N 1 1 296.414 3.688 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1nccs1)C1CCCC1 ZINC000749513253 1118573377 /nfs/dbraw/zinc/57/33/77/1118573377.db2.gz AYAXVHMFHAZVJK-UHFFFAOYSA-N 1 1 288.416 3.794 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707147313 1118648106 /nfs/dbraw/zinc/64/81/06/1118648106.db2.gz YHBHIUDHHFLRGD-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707141273 1118648836 /nfs/dbraw/zinc/64/88/36/1118648836.db2.gz XFUNLARYAOMVIS-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO CC[C@H]([NH2+]CCCOCC(C)C)c1ccc(F)cc1O ZINC000796676492 1118685449 /nfs/dbraw/zinc/68/54/49/1118685449.db2.gz RUUIOFYEXNKXFW-HNNXBMFYSA-N 1 1 283.387 3.635 20 10 CHCDMO COc1ccc(C[N@@H+](C)C2CCCCCC2)c(O)c1OC ZINC000891533748 1118704907 /nfs/dbraw/zinc/70/49/07/1118704907.db2.gz DOWFRHQSFBWJCQ-UHFFFAOYSA-N 1 1 293.407 3.564 20 10 CHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cccc(C)c2O)C1 ZINC000180667996 1128801966 /nfs/dbraw/zinc/80/19/66/1128801966.db2.gz GDHRUIZDRNBNCX-LSDHHAIUSA-N 1 1 279.449 3.807 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c1O ZINC000132830657 1118856392 /nfs/dbraw/zinc/85/63/92/1118856392.db2.gz VLXBQQRRTRPULO-MRXNPFEDSA-N 1 1 289.419 3.946 20 10 CHCDMO C[N@H+](Cc1nccs1)Cc1c(O)ccc2ccccc21 ZINC000074724487 1119018294 /nfs/dbraw/zinc/01/82/94/1119018294.db2.gz SGXACZDOAULNMN-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO C[N@@H+](Cc1nccs1)Cc1c(O)ccc2ccccc21 ZINC000074724487 1119018298 /nfs/dbraw/zinc/01/82/98/1119018298.db2.gz SGXACZDOAULNMN-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@@H]2Cc2ccccc2)ccc1N(C)C ZINC001167593939 1119141088 /nfs/dbraw/zinc/14/10/88/1119141088.db2.gz GDELTQGBQYGZOB-LJQANCHMSA-N 1 1 294.442 3.878 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000226561853 1119157392 /nfs/dbraw/zinc/15/73/92/1119157392.db2.gz LPMLKPNHKOSOPK-QWHCGFSZSA-N 1 1 263.356 3.543 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000179556785 1119751369 /nfs/dbraw/zinc/75/13/69/1119751369.db2.gz DWNYFVWOIKCPRX-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000179706600 1119758015 /nfs/dbraw/zinc/75/80/15/1119758015.db2.gz SCAZZNKMYDKYGS-HNNXBMFYSA-N 1 1 290.794 3.721 20 10 CHCDMO CCc1cccc(C[N@H+]2CC[C@@H](C3CCCC3)C2)c1O ZINC000708869433 1120038978 /nfs/dbraw/zinc/03/89/78/1120038978.db2.gz LLWJUJBMTAHCSJ-MRXNPFEDSA-N 1 1 273.420 3.967 20 10 CHCDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)cc1 ZINC000130814432 1120091241 /nfs/dbraw/zinc/09/12/41/1120091241.db2.gz KPJXYGCSZZYZQX-CYBMUJFWSA-N 1 1 299.370 3.622 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC3(C2)CCCCC3)c1O ZINC000311640904 1120097499 /nfs/dbraw/zinc/09/74/99/1120097499.db2.gz XNPRVUPMKHSIBO-UHFFFAOYSA-N 1 1 259.393 3.857 20 10 CHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116444440 1120120837 /nfs/dbraw/zinc/12/08/37/1120120837.db2.gz SVPKESUXFGXILR-JKSUJKDBSA-N 1 1 272.436 3.907 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(C)cc2)c1O ZINC000119539869 1120198432 /nfs/dbraw/zinc/19/84/32/1120198432.db2.gz DXFYDYWPUVVJLS-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+](C)C[C@@H](C)c2nccs2)c1 ZINC000182846391 1120329527 /nfs/dbraw/zinc/32/95/27/1120329527.db2.gz FDEHZTCSFZHJIL-CYBMUJFWSA-N 1 1 290.432 3.701 20 10 CHCDMO CC[N@@H+](Cc1cccc(Cl)c1[O-])CC(C)(C)C ZINC000310422804 1120455580 /nfs/dbraw/zinc/45/55/80/1120455580.db2.gz QYJFWTLLPARUEJ-UHFFFAOYSA-N 1 1 255.789 3.914 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc(F)cc1O ZINC000702548629 1121205102 /nfs/dbraw/zinc/20/51/02/1121205102.db2.gz WBBUMAHDSKEPCQ-ONGXEEELSA-N 1 1 273.298 3.760 20 10 CHCDMO CCc1cccc(C[N@H+]2CCCC(F)(F)CC2)c1O ZINC000702823504 1121214574 /nfs/dbraw/zinc/21/45/74/1121214574.db2.gz IHNBDWFTOJKXJE-UHFFFAOYSA-N 1 1 269.335 3.576 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000766116903 1121266520 /nfs/dbraw/zinc/26/65/20/1121266520.db2.gz JBZIPMLOAJAIIN-LBPRGKRZSA-N 1 1 287.325 3.783 20 10 CHCDMO [O-]c1cccc(F)c1C[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001137838880 1121424238 /nfs/dbraw/zinc/42/42/38/1121424238.db2.gz MBPOFSUOMGLFLI-CQSZACIVSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001137838880 1121424242 /nfs/dbraw/zinc/42/42/42/1121424242.db2.gz MBPOFSUOMGLFLI-CQSZACIVSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001137838880 1121424248 /nfs/dbraw/zinc/42/42/48/1121424248.db2.gz MBPOFSUOMGLFLI-CQSZACIVSA-N 1 1 277.383 3.934 20 10 CHCDMO CCC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000708466418 1121464026 /nfs/dbraw/zinc/46/40/26/1121464026.db2.gz HSDTULNTLZNRRT-GFCCVEGCSA-N 1 1 251.345 3.543 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)c2ccccn2)cc1 ZINC000773802873 1121856671 /nfs/dbraw/zinc/85/66/71/1121856671.db2.gz AGKHQMDBXJMFFM-HNNXBMFYSA-N 1 1 283.419 3.731 20 10 CHCDMO Cc1cc(C)cc(C[N@H+](C)Cc2ccccc2O)c1 ZINC000731843044 1121888187 /nfs/dbraw/zinc/88/81/87/1121888187.db2.gz PEBCQCPXCVBXQY-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO C[C@H](CCc1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000731842774 1121888368 /nfs/dbraw/zinc/88/83/68/1121888368.db2.gz AIDZHBKQDDNZMV-OAHLLOKOSA-N 1 1 269.388 3.845 20 10 CHCDMO C[C@H](Cc1ccsc1)[N@H+](C)Cc1cccc(F)c1O ZINC001180057489 1121944396 /nfs/dbraw/zinc/94/43/96/1121944396.db2.gz GEMNJVSVENPUMB-LLVKDONJSA-N 1 1 279.380 3.656 20 10 CHCDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1cccc(F)c1O ZINC001180057489 1121944405 /nfs/dbraw/zinc/94/44/05/1121944405.db2.gz GEMNJVSVENPUMB-LLVKDONJSA-N 1 1 279.380 3.656 20 10 CHCDMO CC1(C)CCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000732979992 1121949190 /nfs/dbraw/zinc/94/91/90/1121949190.db2.gz OOKYEXDFSPNODB-UHFFFAOYSA-N 1 1 259.393 3.503 20 10 CHCDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC001180136554 1121951118 /nfs/dbraw/zinc/95/11/18/1121951118.db2.gz GHUAVVXZXPFPBK-OAHLLOKOSA-N 1 1 265.372 3.932 20 10 CHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102713 1122032679 /nfs/dbraw/zinc/03/26/79/1122032679.db2.gz RYWXQRCVCSWNNA-GUYCJALGSA-N 1 1 260.425 3.681 20 10 CHCDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001182044232 1122105815 /nfs/dbraw/zinc/10/58/15/1122105815.db2.gz VZWOWCMHJFVGIB-NSHDSACASA-N 1 1 285.840 3.621 20 10 CHCDMO CO[C@H](C)CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774168049 1122137152 /nfs/dbraw/zinc/13/71/52/1122137152.db2.gz FMQJEXFKHCKZNR-RKDXNWHRSA-N 1 1 292.206 3.775 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(F)cc1O ZINC000273528122 1122237947 /nfs/dbraw/zinc/23/79/47/1122237947.db2.gz VVBMXAJOQJMKTF-DETPVDSQSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(Cl)ccc1O ZINC001203664382 1122432611 /nfs/dbraw/zinc/43/26/11/1122432611.db2.gz CHGPMEDKGCYMLY-GFCCVEGCSA-N 1 1 287.790 3.992 20 10 CHCDMO CC(C)[N@H+](Cc1cc(F)ccc1O)CC1CCC1 ZINC000775178566 1122467699 /nfs/dbraw/zinc/46/76/99/1122467699.db2.gz VGJCKRYGXXCBBM-UHFFFAOYSA-N 1 1 251.345 3.542 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC001191085823 1122576393 /nfs/dbraw/zinc/57/63/93/1122576393.db2.gz TWNJBDKKVAYKSF-FUHWJXTLSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)o1 ZINC001203293974 1122647369 /nfs/dbraw/zinc/64/73/69/1122647369.db2.gz NIDKSNGKAIXIRZ-UHFFFAOYSA-N 1 1 284.403 3.820 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CC2CC2)CC2CCC2)cc1 ZINC001193820710 1122723021 /nfs/dbraw/zinc/72/30/21/1122723021.db2.gz SKHQWQCSRWOROW-UHFFFAOYSA-N 1 1 272.436 3.765 20 10 CHCDMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000080271797 1129079511 /nfs/dbraw/zinc/07/95/11/1129079511.db2.gz GUZGBVKJYWZCGU-UWVGGRQHSA-N 1 1 280.368 3.708 20 10 CHCDMO Cc1cccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1O ZINC000775661005 1122874966 /nfs/dbraw/zinc/87/49/66/1122874966.db2.gz JDHIKBVSQHKOQF-KWOWKCNFSA-N 1 1 271.404 3.711 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c1O ZINC000775670797 1122888878 /nfs/dbraw/zinc/88/88/78/1122888878.db2.gz OBMIBBGJROGBFZ-INIZCTEOSA-N 1 1 281.399 3.999 20 10 CHCDMO COc1ccccc1CC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000729466049 1122891414 /nfs/dbraw/zinc/89/14/14/1122891414.db2.gz LGGMHGZIXFTERI-UHFFFAOYSA-N 1 1 299.414 3.692 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3ccccc3[C@H]2C)c1O ZINC000775680168 1122901202 /nfs/dbraw/zinc/90/12/02/1122901202.db2.gz BDWMRAYKSWVVRZ-CQSZACIVSA-N 1 1 267.372 3.820 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1O ZINC000775686554 1122908324 /nfs/dbraw/zinc/90/83/24/1122908324.db2.gz KLHMLAHHZHEZQG-AWEZNQCLSA-N 1 1 285.362 3.829 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2Cc3ccccc3C(C)(C)C2)c1 ZINC000775701218 1122912095 /nfs/dbraw/zinc/91/20/95/1122912095.db2.gz PBYQLKIQPQBTJY-UHFFFAOYSA-N 1 1 297.398 3.694 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1O ZINC000775698993 1122912391 /nfs/dbraw/zinc/91/23/91/1122912391.db2.gz WXYBTZICQABJNJ-MRXNPFEDSA-N 1 1 299.389 3.904 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c1O ZINC000775702384 1122913775 /nfs/dbraw/zinc/91/37/75/1122913775.db2.gz RZDMJBLKPBJJJA-QWRGUYRKSA-N 1 1 285.840 3.680 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1 ZINC000775702332 1122914214 /nfs/dbraw/zinc/91/42/14/1122914214.db2.gz QAIALTXJPQFYDL-HOCLYGCPSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@@H]2C)c1O ZINC000775716549 1122920882 /nfs/dbraw/zinc/92/08/82/1122920882.db2.gz XQOWBYHXVDIISE-KOLCDFICSA-N 1 1 253.773 3.584 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)c1O ZINC000775741597 1122933182 /nfs/dbraw/zinc/93/31/82/1122933182.db2.gz TVWKODAQLJFZRM-KDOFPFPSSA-N 1 1 297.398 3.525 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000160201765 1122945539 /nfs/dbraw/zinc/94/55/39/1122945539.db2.gz DMFUWUXQINBIRE-CHWSQXEVSA-N 1 1 263.356 3.543 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000160201765 1122945541 /nfs/dbraw/zinc/94/55/41/1122945541.db2.gz DMFUWUXQINBIRE-CHWSQXEVSA-N 1 1 263.356 3.543 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]2C(C)C)c1O ZINC000775766278 1122952429 /nfs/dbraw/zinc/95/24/29/1122952429.db2.gz VXCDUMBJKGJWMH-CYBMUJFWSA-N 1 1 253.773 3.584 20 10 CHCDMO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1O ZINC001203882774 1122968862 /nfs/dbraw/zinc/96/88/62/1122968862.db2.gz VEPBXRHZOIKGSJ-OAHLLOKOSA-N 1 1 287.334 3.574 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1O ZINC001203882774 1122968866 /nfs/dbraw/zinc/96/88/66/1122968866.db2.gz VEPBXRHZOIKGSJ-OAHLLOKOSA-N 1 1 287.334 3.574 20 10 CHCDMO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203936562 1123032668 /nfs/dbraw/zinc/03/26/68/1123032668.db2.gz GJNLREZXQOVYBY-HNNXBMFYSA-N 1 1 298.430 3.954 20 10 CHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccccc1O ZINC000776014051 1123034852 /nfs/dbraw/zinc/03/48/52/1123034852.db2.gz QGVSAHASFPGBQN-PWSUYJOCSA-N 1 1 273.298 3.555 20 10 CHCDMO CC[C@H]([NH2+]CCOCCC(C)C)c1ccc(F)cc1O ZINC000796723864 1123193969 /nfs/dbraw/zinc/19/39/69/1123193969.db2.gz PPDXYFYAHOHPAA-HNNXBMFYSA-N 1 1 283.387 3.635 20 10 CHCDMO Cc1cc(O)c(C[NH2+][C@H](C)c2cscn2)c(Cl)c1 ZINC000850359219 1123256249 /nfs/dbraw/zinc/25/62/49/1123256249.db2.gz AIFKAATXEVCDFA-SECBINFHSA-N 1 1 282.796 3.661 20 10 CHCDMO CC[C@@H](COCC1CC1)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000850494986 1123275045 /nfs/dbraw/zinc/27/50/45/1123275045.db2.gz UTTOFTYDXRJESL-HOCLYGCPSA-N 1 1 295.398 3.777 20 10 CHCDMO C[C@H]([NH2+][C@@H]1C=CCC1)c1cccc(C(F)(F)F)c1O ZINC000850510697 1123278127 /nfs/dbraw/zinc/27/81/27/1123278127.db2.gz WNLRUCNEZAEXAC-VHSXEESVSA-N 1 1 271.282 3.780 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(F)cc1O ZINC000850543773 1123289279 /nfs/dbraw/zinc/28/92/79/1123289279.db2.gz PQFMMLUOTSEMRI-QFYYESIMSA-N 1 1 287.334 3.575 20 10 CHCDMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccccc1O ZINC000851841501 1123384434 /nfs/dbraw/zinc/38/44/34/1123384434.db2.gz UIQWTCULSQLNPZ-LLVKDONJSA-N 1 1 257.324 3.505 20 10 CHCDMO CC(C)=CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000851841116 1123384950 /nfs/dbraw/zinc/38/49/50/1123384950.db2.gz NFZPNDIZJAWLGB-KRWDZBQOSA-N 1 1 289.419 3.730 20 10 CHCDMO C[C@@]1(C2CC2)C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000853527766 1123442822 /nfs/dbraw/zinc/44/28/22/1123442822.db2.gz FFSAJYBOIXAKOF-IBGZPJMESA-N 1 1 297.398 3.546 20 10 CHCDMO Cc1cc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000776767023 1123503069 /nfs/dbraw/zinc/50/30/69/1123503069.db2.gz QQDCWDIWULHTBT-OKILXGFUSA-N 1 1 291.435 3.607 20 10 CHCDMO Oc1ccccc1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000895788226 1123514491 /nfs/dbraw/zinc/51/44/91/1123514491.db2.gz MCBBYQDCCZZICY-JSGCOSHPSA-N 1 1 285.309 3.557 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CCO[C@@H](CC)C1 ZINC000780758817 1123544341 /nfs/dbraw/zinc/54/43/41/1123544341.db2.gz WTEZANFHGIOTLU-RDJZCZTQSA-N 1 1 291.435 3.809 20 10 CHCDMO CCC(F)(F)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000858507870 1123659229 /nfs/dbraw/zinc/65/92/29/1123659229.db2.gz SPZSHLIBPHEQOF-LLVKDONJSA-N 1 1 257.324 3.705 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccc(F)cc1O ZINC000858577674 1123665067 /nfs/dbraw/zinc/66/50/67/1123665067.db2.gz UNZOSWGHYOXFLG-JOYOIKCWSA-N 1 1 280.368 3.790 20 10 CHCDMO C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2ccccc2c1[O-] ZINC000194987754 1129140332 /nfs/dbraw/zinc/14/03/32/1129140332.db2.gz REHDTCVHYYGHRY-AWEZNQCLSA-N 1 1 298.430 3.538 20 10 CHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862440428 1123809842 /nfs/dbraw/zinc/80/98/42/1123809842.db2.gz HMASNYWHLLUYOH-IYBDPMFKSA-N 1 1 265.356 3.511 20 10 CHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC000862442759 1123809947 /nfs/dbraw/zinc/80/99/47/1123809947.db2.gz HKCNHWWEWPIGKD-IYBDPMFKSA-N 1 1 298.455 3.836 20 10 CHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)CC1(C)COC1 ZINC000862477767 1123813590 /nfs/dbraw/zinc/81/35/90/1123813590.db2.gz QOHWJPBKSITTDI-UHFFFAOYSA-N 1 1 297.398 3.528 20 10 CHCDMO CCC(F)(F)C[NH2+]Cc1ccc2ccccc2c1O ZINC000862489370 1123815116 /nfs/dbraw/zinc/81/51/16/1123815116.db2.gz JANLJRITLKGSFV-UHFFFAOYSA-N 1 1 265.303 3.680 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@](C)(O)CC2)cc1C(C)C ZINC000794664289 1123923675 /nfs/dbraw/zinc/92/36/75/1123923675.db2.gz CJGPPGQYZRSFJR-SFHVURJKSA-N 1 1 291.435 3.561 20 10 CHCDMO CC[C@@H](NCC[NH+](C(C)C)C(C)C)c1ccccc1O ZINC000084523728 1129153513 /nfs/dbraw/zinc/15/35/13/1129153513.db2.gz VJUKENBSOHYZPQ-MRXNPFEDSA-N 1 1 278.440 3.552 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC3(CCC3)C[C@H]2C)c1 ZINC000763648395 1129154505 /nfs/dbraw/zinc/15/45/05/1129154505.db2.gz SHKQNVFREAZSDI-CYBMUJFWSA-N 1 1 275.392 3.555 20 10 CHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000763647962 1129155170 /nfs/dbraw/zinc/15/51/70/1129155170.db2.gz PHHSRKOCUZMVJY-ZDUSSCGKSA-N 1 1 276.399 3.656 20 10 CHCDMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccc(C)cc1O ZINC000794819155 1123960498 /nfs/dbraw/zinc/96/04/98/1123960498.db2.gz YAQLFPNLQAXGRD-CQSZACIVSA-N 1 1 256.349 3.967 20 10 CHCDMO CN(C)c1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1 ZINC000865823057 1124017911 /nfs/dbraw/zinc/01/79/11/1124017911.db2.gz REECPPPNAPGGDE-KRWDZBQOSA-N 1 1 290.357 3.692 20 10 CHCDMO COc1cccc(F)c1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC001120366425 1131274508 /nfs/dbraw/zinc/27/45/08/1131274508.db2.gz UKRNYOLGORLIQY-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CCCOc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cc1C ZINC000873080201 1124736380 /nfs/dbraw/zinc/73/63/80/1124736380.db2.gz LEAPZMGLGPLSGI-MRXNPFEDSA-N 1 1 299.418 3.674 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccc2ccccc2c1[O-] ZINC000873268623 1124757772 /nfs/dbraw/zinc/75/77/72/1124757772.db2.gz FXOCVWWSDDCGIQ-ZIAGYGMSSA-N 1 1 298.430 3.584 20 10 CHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876756916 1124975217 /nfs/dbraw/zinc/97/52/17/1124975217.db2.gz ACFQWHDDIGNISW-OAHLLOKOSA-N 1 1 297.398 3.699 20 10 CHCDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(C)cc1O ZINC000877494886 1125035471 /nfs/dbraw/zinc/03/54/71/1125035471.db2.gz VOIWQJHQFOVYNK-INIZCTEOSA-N 1 1 299.418 3.644 20 10 CHCDMO CCCC[N@@H+](CCC[C@@H]1CCO1)Cc1ccccc1O ZINC000877503422 1125036984 /nfs/dbraw/zinc/03/69/84/1125036984.db2.gz LPNYYOLSNGYPQD-MRXNPFEDSA-N 1 1 277.408 3.563 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)cc1O ZINC000877532742 1125040674 /nfs/dbraw/zinc/04/06/74/1125040674.db2.gz WUSYSOSFQQNAPS-INIZCTEOSA-N 1 1 270.376 3.679 20 10 CHCDMO CC[C@H]([NH2+]Cc1csc(C)n1)c1ccc(N(C)C)cc1 ZINC000126585768 1125043415 /nfs/dbraw/zinc/04/34/15/1125043415.db2.gz MWPYSIQPIARJJB-INIZCTEOSA-N 1 1 289.448 3.758 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2cc(Cl)c(C)cc2O)CC1(C)C ZINC000826062420 1125169563 /nfs/dbraw/zinc/16/95/63/1125169563.db2.gz RIIXKFIENOMBCO-HNNXBMFYSA-N 1 1 297.826 3.601 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCCc2occc21 ZINC000190753761 1125319051 /nfs/dbraw/zinc/31/90/51/1125319051.db2.gz OVNKXFSERYXSFT-LBPRGKRZSA-N 1 1 295.741 3.945 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000883112043 1125372414 /nfs/dbraw/zinc/37/24/14/1125372414.db2.gz XKXQVDXFZQULAC-VIFPVBQESA-N 1 1 291.288 3.586 20 10 CHCDMO CC[N@H+](Cc1cc(Br)ccc1O)C1CCCC1 ZINC000132159672 1125414983 /nfs/dbraw/zinc/41/49/83/1125414983.db2.gz ORUJEQZNBSDWIG-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO CC[N@@H+](Cc1cc(Br)ccc1O)C1CCCC1 ZINC000132159672 1125414987 /nfs/dbraw/zinc/41/49/87/1125414987.db2.gz ORUJEQZNBSDWIG-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)C2CCCCCC2)c1O ZINC000132360522 1125417372 /nfs/dbraw/zinc/41/73/72/1125417372.db2.gz QDSIXEAJJDMBME-UHFFFAOYSA-N 1 1 277.408 3.946 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000132817011 1125422929 /nfs/dbraw/zinc/42/29/29/1125422929.db2.gz RHGRXSWZJQCHLN-MRXNPFEDSA-N 1 1 259.393 3.855 20 10 CHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000245636842 1129214304 /nfs/dbraw/zinc/21/43/04/1129214304.db2.gz XGLFVBJYTAXYJL-HNAYVOBHSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1 ZINC000245773338 1129224881 /nfs/dbraw/zinc/22/48/81/1129224881.db2.gz SFCNRSSYPWFHJT-QAPCUYQASA-N 1 1 297.398 3.663 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc2O1 ZINC000795428723 1129273952 /nfs/dbraw/zinc/27/39/52/1129273952.db2.gz BAEXMVXAMQLEQK-HNNXBMFYSA-N 1 1 296.414 3.536 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000246496889 1129287307 /nfs/dbraw/zinc/28/73/07/1129287307.db2.gz KCSZXTFNCPALOS-KDOFPFPSSA-N 1 1 297.398 3.902 20 10 CHCDMO CC(=O)c1cc(F)cc(C[NH+](C2CCC2)C2CCC2)c1O ZINC000795451320 1129299756 /nfs/dbraw/zinc/29/97/56/1129299756.db2.gz DRHXPTVDNJQTKI-UHFFFAOYSA-N 1 1 291.366 3.641 20 10 CHCDMO C[N@@H+](Cc1cnc(C2CCC2)s1)Cc1ccccc1O ZINC000091974649 1129375821 /nfs/dbraw/zinc/37/58/21/1129375821.db2.gz NBVITHQRFCMWJH-UHFFFAOYSA-N 1 1 288.416 3.748 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000738221147 1129390856 /nfs/dbraw/zinc/39/08/56/1129390856.db2.gz CDYZYDKNRGLPGN-ZDUSSCGKSA-N 1 1 270.376 3.705 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000738225551 1129391250 /nfs/dbraw/zinc/39/12/50/1129391250.db2.gz GDXDRMQEBXGZPG-ZDUSSCGKSA-N 1 1 259.393 3.645 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(C)s2)c1 ZINC000093049420 1129415982 /nfs/dbraw/zinc/41/59/82/1129415982.db2.gz AFNHLPGYXMBQBI-UHFFFAOYSA-N 1 1 291.416 3.793 20 10 CHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132209 1129417933 /nfs/dbraw/zinc/41/79/33/1129417933.db2.gz DDCVSRMFIRZMLL-CHWSQXEVSA-N 1 1 277.408 3.800 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1ccc(F)cc1O ZINC000248490336 1129419899 /nfs/dbraw/zinc/41/98/99/1129419899.db2.gz IBJKRORTWGEZRJ-XNKSSIQNSA-N 1 1 297.373 3.768 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC000093690285 1129427033 /nfs/dbraw/zinc/42/70/33/1129427033.db2.gz ONDZUCMEOFNYOJ-GOEBONIOSA-N 1 1 277.433 3.561 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCc2cccs2)c1 ZINC000093685567 1129427189 /nfs/dbraw/zinc/42/71/89/1129427189.db2.gz KZPXYNGLIZIBCU-UHFFFAOYSA-N 1 1 291.416 3.527 20 10 CHCDMO CCCC[C@H](COC)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796772451 1129441651 /nfs/dbraw/zinc/44/16/51/1129441651.db2.gz RXVJRUFVUJUMIT-UKRRQHHQSA-N 1 1 283.387 3.777 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCn3cccc3[C@@H]2C)cc1 ZINC000741752654 1129451491 /nfs/dbraw/zinc/45/14/91/1129451491.db2.gz DFIVDBGYZFHZFX-HNNXBMFYSA-N 1 1 283.419 3.521 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCS[C@H](C(C)C)C2)cc1C ZINC000743400082 1129522308 /nfs/dbraw/zinc/52/23/08/1129522308.db2.gz QOIYSKZGEFIFTN-INIZCTEOSA-N 1 1 279.449 3.582 20 10 CHCDMO CCC[C@@]1(C)CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000743404037 1129522625 /nfs/dbraw/zinc/52/26/25/1129522625.db2.gz GVNXWJPMKNNBSO-KRWDZBQOSA-N 1 1 291.391 3.523 20 10 CHCDMO CC(C)O[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)cc2O)C1(C)C ZINC000766331517 1129605258 /nfs/dbraw/zinc/60/52/58/1129605258.db2.gz SFRGKVSDGBQWGJ-XFBWCDHKSA-N 1 1 295.398 3.774 20 10 CHCDMO CCC[N@H+](CC)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000766397806 1129662267 /nfs/dbraw/zinc/66/22/67/1129662267.db2.gz BZFYRLBDTBADQI-SFHVURJKSA-N 1 1 291.483 3.525 20 10 CHCDMO CCC[N@@H+](CC)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000766397806 1129662270 /nfs/dbraw/zinc/66/22/70/1129662270.db2.gz BZFYRLBDTBADQI-SFHVURJKSA-N 1 1 291.483 3.525 20 10 CHCDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763302 1129813137 /nfs/dbraw/zinc/81/31/37/1129813137.db2.gz LKDVNYCTUQFQIN-OCCSQVGLSA-N 1 1 291.391 3.522 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2C)c(O)c1 ZINC000768161311 1129838218 /nfs/dbraw/zinc/83/82/18/1129838218.db2.gz XGNIGJNVHLPNOA-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO COc1cccc(O)c1C[N@H+](C)Cc1ccccc1Cl ZINC000768169008 1129839087 /nfs/dbraw/zinc/83/90/87/1129839087.db2.gz BPUUJAWZPBNVTF-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccccc1Cl ZINC000768169008 1129839093 /nfs/dbraw/zinc/83/90/93/1129839093.db2.gz BPUUJAWZPBNVTF-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000016076976 1129839696 /nfs/dbraw/zinc/83/96/96/1129839696.db2.gz REFQRGQCDUHFQB-CYBMUJFWSA-N 1 1 255.361 3.777 20 10 CHCDMO Cc1cccc(OCC[N@H+](C)Cc2cc(C)ccc2O)c1 ZINC000768213992 1129844033 /nfs/dbraw/zinc/84/40/33/1129844033.db2.gz XQBSJOBNPPGEFQ-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO C[N@H+](Cc1ccc(F)c(F)c1)Cc1c(O)cccc1Cl ZINC000768263639 1129848344 /nfs/dbraw/zinc/84/83/44/1129848344.db2.gz VYPFNIVVCNGTEY-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1c(O)cccc1Cl ZINC000768263639 1129848346 /nfs/dbraw/zinc/84/83/46/1129848346.db2.gz VYPFNIVVCNGTEY-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(O)c1 ZINC000768354080 1129853209 /nfs/dbraw/zinc/85/32/09/1129853209.db2.gz WSMWFKIVIAHOCW-UHFFFAOYSA-N 1 1 298.430 3.869 20 10 CHCDMO COc1cc(C[N@H+]2CCC3(C2)CCCCC3)c(O)cc1C ZINC000768465776 1129859061 /nfs/dbraw/zinc/85/90/61/1129859061.db2.gz LBBRELOFWNUHRE-UHFFFAOYSA-N 1 1 289.419 3.865 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H](C)CO1 ZINC000768536269 1129861236 /nfs/dbraw/zinc/86/12/36/1129861236.db2.gz GXYXNOKJJIAITC-HUUCEWRRSA-N 1 1 297.398 3.668 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC2(CCCC2)CC1 ZINC001137833013 1131420659 /nfs/dbraw/zinc/42/06/59/1131420659.db2.gz PRUFZGSEGWAVMX-UHFFFAOYSA-N 1 1 263.356 3.688 20 10 CHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(O)cccc2Cl)on1 ZINC000768876995 1129879111 /nfs/dbraw/zinc/87/91/11/1129879111.db2.gz FMFGYKPGUCMBPD-ZDUSSCGKSA-N 1 1 292.766 3.679 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c(O)c1 ZINC000769102525 1129889546 /nfs/dbraw/zinc/88/95/46/1129889546.db2.gz OLAOKXHOLFKVDL-CZUORRHYSA-N 1 1 275.392 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000769246232 1129898699 /nfs/dbraw/zinc/89/86/99/1129898699.db2.gz XYWVVKOUGLBDIZ-QGZVFWFLSA-N 1 1 258.409 3.517 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N(C)C)c(F)c2)s1 ZINC000769316623 1129901699 /nfs/dbraw/zinc/90/16/99/1129901699.db2.gz LMWKPKWJCXQPPB-UHFFFAOYSA-N 1 1 292.423 3.894 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000769378254 1129905265 /nfs/dbraw/zinc/90/52/65/1129905265.db2.gz ASQOPOXHZZMEGA-CQSZACIVSA-N 1 1 285.362 3.829 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCc3sccc3C2)cc1 ZINC000769380042 1129905379 /nfs/dbraw/zinc/90/53/79/1129905379.db2.gz FXYOSGIZSGYZRS-UHFFFAOYSA-N 1 1 286.444 3.763 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000769404168 1129906838 /nfs/dbraw/zinc/90/68/38/1129906838.db2.gz KCPOFQSWTJOMMY-JKIFEVAISA-N 1 1 289.419 3.944 20 10 CHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cccc(OC)c1O ZINC000769487071 1129909591 /nfs/dbraw/zinc/90/95/91/1129909591.db2.gz HELYITFFVDCLHM-KRWDZBQOSA-N 1 1 299.414 3.854 20 10 CHCDMO C[N@H+](Cc1ccon1)Cc1cc(-c2ccccc2)ccc1O ZINC000769467423 1129911892 /nfs/dbraw/zinc/91/18/92/1129911892.db2.gz UCXKNAIUVCVDQN-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO C[N@@H+](Cc1ccon1)Cc1cc(-c2ccccc2)ccc1O ZINC000769467423 1129911895 /nfs/dbraw/zinc/91/18/95/1129911895.db2.gz UCXKNAIUVCVDQN-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000769497890 1129913687 /nfs/dbraw/zinc/91/36/87/1129913687.db2.gz HBWDNDVRDNFYOZ-DZGCQCFKSA-N 1 1 297.851 3.906 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000769502828 1129914222 /nfs/dbraw/zinc/91/42/22/1129914222.db2.gz ALNNGHYZUMBUGU-LJQANCHMSA-N 1 1 297.398 3.564 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]2Cc2ccccc2)c1 ZINC000769505530 1129914584 /nfs/dbraw/zinc/91/45/84/1129914584.db2.gz CXVMCQKRLIELFR-QGZVFWFLSA-N 1 1 267.372 3.518 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]2Cc2ccccc2)cc1C ZINC000769505898 1129914976 /nfs/dbraw/zinc/91/49/76/1129914976.db2.gz JZALONLPJPMHDT-GOSISDBHSA-N 1 1 281.399 3.826 20 10 CHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549022 1129917144 /nfs/dbraw/zinc/91/71/44/1129917144.db2.gz JUWGXIWUTIPHAI-CHWSQXEVSA-N 1 1 295.448 3.507 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CCO[C@H](C)C1 ZINC000801594988 1129931250 /nfs/dbraw/zinc/93/12/50/1129931250.db2.gz TVTPTSJYNJEVCU-HZPDHXFCSA-N 1 1 291.435 3.809 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CCO[C@@H](C)C1 ZINC000801594989 1129931368 /nfs/dbraw/zinc/93/13/68/1129931368.db2.gz TVTPTSJYNJEVCU-JKSUJKDBSA-N 1 1 291.435 3.809 20 10 CHCDMO COC(C)(C)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000770317831 1129944344 /nfs/dbraw/zinc/94/43/44/1129944344.db2.gz LNFWMTFLKHRNQS-UHFFFAOYSA-N 1 1 290.451 3.534 20 10 CHCDMO COc1cccc(O)c1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000770383848 1129945145 /nfs/dbraw/zinc/94/51/45/1129945145.db2.gz KYXRMYQEORWRPI-UHFFFAOYSA-N 1 1 275.392 3.579 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC[C@H](SC)C2)c(O)c1 ZINC000770351669 1129946069 /nfs/dbraw/zinc/94/60/69/1129946069.db2.gz UDOVJFVDOLEOQC-HNNXBMFYSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)c1 ZINC000770349829 1129946119 /nfs/dbraw/zinc/94/61/19/1129946119.db2.gz NLCKDUGRVIICAC-AUUYWEPGSA-N 1 1 297.398 3.525 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000770509099 1129947968 /nfs/dbraw/zinc/94/79/68/1129947968.db2.gz HXZPMWBCUKVVGO-SFHVURJKSA-N 1 1 281.399 3.989 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)[C@@H]2CCCC[C@H]12 ZINC000770510088 1129948021 /nfs/dbraw/zinc/94/80/21/1129948021.db2.gz XHJMBYSYLJYJDF-FVQBIDKESA-N 1 1 259.393 3.793 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000770510120 1129948311 /nfs/dbraw/zinc/94/83/11/1129948311.db2.gz JVGSGRWSVPCAEM-UHFFFAOYSA-N 1 1 285.362 3.738 20 10 CHCDMO C[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886591717 1129974108 /nfs/dbraw/zinc/97/41/08/1129974108.db2.gz ABWWWRCCVCAPCX-YUMQZZPRSA-N 1 1 265.250 3.523 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H](C)O1 ZINC000772599695 1130033915 /nfs/dbraw/zinc/03/39/15/1130033915.db2.gz MIBOMQBSMARCJV-GASCZTMLSA-N 1 1 297.398 3.668 20 10 CHCDMO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(F)cc1O ZINC000903334806 1130160576 /nfs/dbraw/zinc/16/05/76/1130160576.db2.gz GOZXAJLNKYXCQU-APPDUMDISA-N 1 1 286.350 3.728 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(F)cc1O ZINC000903389914 1130170019 /nfs/dbraw/zinc/17/00/19/1130170019.db2.gz RQCORODUZNGCEQ-GOEBONIOSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1cc(C)c([C@@H](C)[NH2+]CCCN2CCCCC2)c(O)c1 ZINC000788508328 1130191795 /nfs/dbraw/zinc/19/17/95/1130191795.db2.gz UVMJINPKMIENPM-MRXNPFEDSA-N 1 1 290.451 3.536 20 10 CHCDMO C[C@H](Cc1cccs1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790948680 1130340180 /nfs/dbraw/zinc/34/01/80/1130340180.db2.gz DGWFQSZEMOKHGY-SECBINFHSA-N 1 1 299.798 3.967 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3cc(C)ccc3C2)c1 ZINC000792178291 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Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC001238058813 1131164782 /nfs/dbraw/zinc/16/47/82/1131164782.db2.gz WKJJRZYLNVCXLT-MRXNPFEDSA-N 1 1 286.350 3.572 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1O ZINC001238066667 1131166904 /nfs/dbraw/zinc/16/69/04/1131166904.db2.gz IPLUKUFCBVFJBP-OKILXGFUSA-N 1 1 297.373 3.926 20 10 CHCDMO CCCC[C@@H](C[NH3+])[NH2+][C@H](CC)c1cccc(Cl)c1[O-] ZINC000817963706 1131192160 /nfs/dbraw/zinc/19/21/60/1131192160.db2.gz XENVGSXPEBFCAN-SMDDNHRTSA-N 1 1 284.831 3.604 20 10 CHCDMO FC1(F)C[C@@]12CC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001118240305 1131216512 /nfs/dbraw/zinc/21/65/12/1131216512.db2.gz QKBVLIDFDIXSGD-MRXNPFEDSA-N 1 1 292.373 3.518 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001137839069 1131421792 /nfs/dbraw/zinc/42/17/92/1131421792.db2.gz QADPKQZEFBXPNW-OLZOCXBDSA-N 1 1 263.356 3.543 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001137839069 1131421796 /nfs/dbraw/zinc/42/17/96/1131421796.db2.gz QADPKQZEFBXPNW-OLZOCXBDSA-N 1 1 263.356 3.543 20 10 CHCDMO CC[N@H+](Cc1cccs1)Cc1c(O)cccc1F ZINC001137839712 1131421805 /nfs/dbraw/zinc/42/18/05/1131421805.db2.gz HNASBHCREQYLNR-UHFFFAOYSA-N 1 1 265.353 3.615 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1c(O)cccc1F ZINC001137839712 1131421807 /nfs/dbraw/zinc/42/18/07/1131421807.db2.gz HNASBHCREQYLNR-UHFFFAOYSA-N 1 1 265.353 3.615 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1csnn1 ZINC000829516029 1131423081 /nfs/dbraw/zinc/42/30/81/1131423081.db2.gz NFBPNNQVKXBLDG-LBPRGKRZSA-N 1 1 291.420 3.607 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1csnn1 ZINC000829516029 1131423083 /nfs/dbraw/zinc/42/30/83/1131423083.db2.gz NFBPNNQVKXBLDG-LBPRGKRZSA-N 1 1 291.420 3.607 20 10 CHCDMO Cc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c(C)n1-c1ccccc1 ZINC001137856212 1131424035 /nfs/dbraw/zinc/42/40/35/1131424035.db2.gz URCMJZQYAAXHCE-WDSOQIARSA-N 1 1 298.405 3.884 20 10 CHCDMO CSCC[N@@H+](C)Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859153 1131425286 /nfs/dbraw/zinc/42/52/86/1131425286.db2.gz LGVYVFOEEAPLSM-UHFFFAOYSA-N 1 1 288.460 3.889 20 10 CHCDMO C[N@H+](CCc1cccc(Cl)c1)Cc1cccc(F)c1O ZINC001138128508 1131469675 /nfs/dbraw/zinc/46/96/75/1131469675.db2.gz OKJPFDHEKCVGKR-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO C[N@@H+](CCc1cccc(Cl)c1)Cc1cccc(F)c1O ZINC001138128508 1131469678 /nfs/dbraw/zinc/46/96/78/1131469678.db2.gz OKJPFDHEKCVGKR-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO CC[N@H+](Cc1cccc(F)c1)Cc1cccc(F)c1O ZINC001138129582 1131470195 /nfs/dbraw/zinc/47/01/95/1131470195.db2.gz LFYNRBLZZLGAFM-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[N@@H+](Cc1cccc(F)c1)Cc1cccc(F)c1O ZINC001138129582 1131470196 /nfs/dbraw/zinc/47/01/96/1131470196.db2.gz LFYNRBLZZLGAFM-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO Cc1c(C[N@@H+]2CCCC[C@H]2C)c2ccccc2n1C ZINC001138252491 1131482558 /nfs/dbraw/zinc/48/25/58/1131482558.db2.gz IWXPTIKCOYZNKE-CYBMUJFWSA-N 1 1 256.393 3.861 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c2ccccc2n1C ZINC001138256910 1131483055 /nfs/dbraw/zinc/48/30/55/1131483055.db2.gz PAWSCUCPMYIYLB-INIZCTEOSA-N 1 1 290.357 3.718 20 10 CHCDMO Cc1ccc2c(C[N@H+]3CCc4cccc(O)c4C3)c[nH]c2c1 ZINC001136975555 1131491095 /nfs/dbraw/zinc/49/10/95/1131491095.db2.gz LYRPRDJFDQXZAQ-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(C)C)c(OC)c1 ZINC001138387504 1131497364 /nfs/dbraw/zinc/49/73/64/1131497364.db2.gz FIRQYPSGWJERGR-UHFFFAOYSA-N 1 1 278.440 3.629 20 10 CHCDMO CCCOc1ccccc1C[N@@H+](C)Cc1ccccc1O ZINC001138999118 1131570028 /nfs/dbraw/zinc/57/00/28/1131570028.db2.gz WXSUVZYCSJIHPU-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000844756318 1131595850 /nfs/dbraw/zinc/59/58/50/1131595850.db2.gz ABFDUQNQGXCRCP-INIZCTEOSA-N 1 1 289.325 3.777 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@]3(CC3(F)F)C1)CCC2 ZINC000844745765 1131596714 /nfs/dbraw/zinc/59/67/14/1131596714.db2.gz GJBKDQBIJNPQGN-INIZCTEOSA-N 1 1 293.357 3.502 20 10 CHCDMO CC[N@@H+](Cc1cc2ccccc2n1C)Cc1ccccc1O ZINC001139872136 1131644521 /nfs/dbraw/zinc/64/45/21/1131644521.db2.gz GUJGVEONFZVERF-UHFFFAOYSA-N 1 1 294.398 3.906 20 10 CHCDMO Oc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)c(O)c1 ZINC001144499155 1131646738 /nfs/dbraw/zinc/64/67/38/1131646738.db2.gz CGMOMXTWAIWRJO-MRXNPFEDSA-N 1 1 299.370 3.531 20 10 CHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CC2CCC1CC2 ZINC001203007088 1131669487 /nfs/dbraw/zinc/66/94/87/1131669487.db2.gz YCPFOCYGALUTIN-ZIULKBFBSA-N 1 1 295.373 3.975 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCC(F)(F)[C@H](F)C2)c1O ZINC001140178642 1131673590 /nfs/dbraw/zinc/67/35/90/1131673590.db2.gz RZICUHXCAKRQGA-CYBMUJFWSA-N 1 1 287.325 3.578 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H](c3ccccn3)C2)c1O ZINC001140182681 1131674276 /nfs/dbraw/zinc/67/42/76/1131674276.db2.gz XFFOWVQVDPOIIR-INIZCTEOSA-N 1 1 296.414 3.784 20 10 CHCDMO Cc1ccc(CC[N@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140182678 1131674624 /nfs/dbraw/zinc/67/46/24/1131674624.db2.gz XBHSGOIAZCJMCQ-UHFFFAOYSA-N 1 1 283.415 3.992 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846108295 1131686518 /nfs/dbraw/zinc/68/65/18/1131686518.db2.gz OHZLJXOEWGRYEP-ZDUSSCGKSA-N 1 1 287.737 3.667 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C(F)F ZINC000834827003 1131707704 /nfs/dbraw/zinc/70/77/04/1131707704.db2.gz HCEFKLXJLZOWAR-OIBJUYFYSA-N 1 1 263.715 3.740 20 10 CHCDMO C[N@@H+](Cc1ccc2scnc2c1)Cc1ccccc1O ZINC001144743679 1131702680 /nfs/dbraw/zinc/70/26/80/1131702680.db2.gz VFXSPFCZCFXYHI-UHFFFAOYSA-N 1 1 284.384 3.634 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc3scnc3c1)CC2 ZINC001144743313 1131703190 /nfs/dbraw/zinc/70/31/90/1131703190.db2.gz IYPAZUNBJYNSBB-UHFFFAOYSA-N 1 1 296.395 3.560 20 10 CHCDMO CC[C@H]([NH2+][C@@H](CC)C(F)F)c1ccc(C)cc1O ZINC000834826106 1131707692 /nfs/dbraw/zinc/70/76/92/1131707692.db2.gz BPMDLTGBZAKNHW-RYUDHWBXSA-N 1 1 257.324 3.785 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C(F)F ZINC000834827726 1131707696 /nfs/dbraw/zinc/70/76/96/1131707696.db2.gz LEPHXYCCZZYRNQ-FKTZTGRPSA-N 1 1 273.298 3.713 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)C(F)F ZINC000834828526 1131708920 /nfs/dbraw/zinc/70/89/20/1131708920.db2.gz VFOYNEYJHHTXLU-CMPLNLGQSA-N 1 1 257.324 3.703 20 10 CHCDMO Cc1csc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)c1 ZINC000834882229 1131716812 /nfs/dbraw/zinc/71/68/12/1131716812.db2.gz GHRFZICYAFRULM-SECBINFHSA-N 1 1 283.343 3.891 20 10 CHCDMO Cc1csc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)c1 ZINC000834882230 1131717123 /nfs/dbraw/zinc/71/71/23/1131717123.db2.gz GHRFZICYAFRULM-VIFPVBQESA-N 1 1 283.343 3.891 20 10 CHCDMO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(F)cc1O ZINC000834909233 1131729725 /nfs/dbraw/zinc/72/97/25/1131729725.db2.gz PRKAUAOPZOWRSA-SECBINFHSA-N 1 1 273.298 3.617 20 10 CHCDMO CCC(C)(C)OCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000834916146 1131733244 /nfs/dbraw/zinc/73/32/44/1131733244.db2.gz VHWJWNNNOMCAGY-SNVBAGLBSA-N 1 1 287.350 3.526 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c([O-])cc(F)cc2F)cc1C ZINC001140585565 1131812537 /nfs/dbraw/zinc/81/25/37/1131812537.db2.gz ODSHTIKJEJUXCY-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001140621362 1131831287 /nfs/dbraw/zinc/83/12/87/1131831287.db2.gz ZBCNAZTWZFUKEK-KRWDZBQOSA-N 1 1 282.387 3.823 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC001140623571 1131832647 /nfs/dbraw/zinc/83/26/47/1131832647.db2.gz WBHCKBQPYTTXCJ-UHFFFAOYSA-N 1 1 269.388 3.895 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+](C)C/C=C/c2ccccc2)c1O ZINC001140749337 1131906750 /nfs/dbraw/zinc/90/67/50/1131906750.db2.gz WALPNIAGBMFRPU-RMKNXTFCSA-N 1 1 283.371 3.551 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1coc3ccccc13)CC2 ZINC001140784961 1131915572 /nfs/dbraw/zinc/91/55/72/1131915572.db2.gz HBPULBPOYPTYFF-UHFFFAOYSA-N 1 1 279.339 3.697 20 10 CHCDMO CN(C)c1ccc(C[NH+]2CCC(F)(F)CC2)c(Cl)c1 ZINC001140921951 1131963301 /nfs/dbraw/zinc/96/33/01/1131963301.db2.gz XJBWFBBSLPWRFL-UHFFFAOYSA-N 1 1 288.769 3.637 20 10 CHCDMO CCC[N@@H+](CC)Cc1ccc(N(C)C)cc1Cl ZINC001140921404 1131963508 /nfs/dbraw/zinc/96/35/08/1131963508.db2.gz DENPSZOTMQEQJX-UHFFFAOYSA-N 1 1 254.805 3.638 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001140950758 1131968909 /nfs/dbraw/zinc/96/89/09/1131968909.db2.gz GXYXMEMOSZYAOJ-UHFFFAOYSA-N 1 1 267.372 3.649 20 10 CHCDMO CCC[N@@H+](CC)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074529 1132005521 /nfs/dbraw/zinc/00/55/21/1132005521.db2.gz KYDJMGUZTXZQNQ-UHFFFAOYSA-N 1 1 272.436 3.617 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141158592 1132030572 /nfs/dbraw/zinc/03/05/72/1132030572.db2.gz FZNYDJVYNLKOQC-UHFFFAOYSA-N 1 1 285.387 3.900 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)CC)cc2)[C@@H](CC)CO1 ZINC001171778862 1132097480 /nfs/dbraw/zinc/09/74/80/1132097480.db2.gz QULLHEQMNXDWPE-WMZOPIPTSA-N 1 1 290.451 3.532 20 10 CHCDMO C[N@H+]1CC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231319766 1132279781 /nfs/dbraw/zinc/27/97/81/1132279781.db2.gz KSZSXXPIHDLLHY-QGZVFWFLSA-N 1 1 297.358 3.891 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(F)cc1O ZINC000840876460 1132298614 /nfs/dbraw/zinc/29/86/14/1132298614.db2.gz QOVCHKKFDFMACC-HZSPNIEDSA-N 1 1 269.335 3.853 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cc(F)cc(F)c1O ZINC000840877215 1132300935 /nfs/dbraw/zinc/30/09/35/1132300935.db2.gz ZARFCCWCPZXOCW-XTWCZFFVSA-N 1 1 273.298 3.602 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1csnn1)c1cc(Cl)ccc1O ZINC000840885719 1132301815 /nfs/dbraw/zinc/30/18/15/1132301815.db2.gz GGMWCYCHIMEIJJ-KCJUWKMLSA-N 1 1 297.811 3.699 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc(F)cc1O ZINC000840891906 1132306222 /nfs/dbraw/zinc/30/62/22/1132306222.db2.gz KOVYKPVSLJWFRA-GFCCVEGCSA-N 1 1 288.366 3.555 20 10 CHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2C)no1 ZINC000840910510 1132308283 /nfs/dbraw/zinc/30/82/83/1132308283.db2.gz ONERFAMQHXNKKQ-GOSISDBHSA-N 1 1 299.418 3.695 20 10 CHCDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cccc(C)c2O)cn1 ZINC001231592096 1132320801 /nfs/dbraw/zinc/32/08/01/1132320801.db2.gz BEQYISHMEWKBJR-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO COc1ccc(CC[N@@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231847277 1132378274 /nfs/dbraw/zinc/37/82/74/1132378274.db2.gz VUBFNTCDWVHPMF-UHFFFAOYSA-N 1 1 299.414 3.692 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)CCOc2ccccc2)c(O)c1 ZINC001231843933 1132378394 /nfs/dbraw/zinc/37/83/94/1132378394.db2.gz DBQZSONHKDOVTF-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001231854228 1132379463 /nfs/dbraw/zinc/37/94/63/1132379463.db2.gz BYJYKHKWFWCPLE-SFHVURJKSA-N 1 1 296.414 3.708 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@@H+](C)CC1CCCCC1 ZINC001231855659 1132379829 /nfs/dbraw/zinc/37/98/29/1132379829.db2.gz YFEDSZJXTBWYGA-UHFFFAOYSA-N 1 1 290.451 3.773 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1Cl ZINC001231871112 1132383421 /nfs/dbraw/zinc/38/34/21/1132383421.db2.gz YKNOIQRRYBBWSE-PWSUYJOCSA-N 1 1 267.800 3.974 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3occc3C2)cc1Cl ZINC001231870187 1132384353 /nfs/dbraw/zinc/38/43/53/1132384353.db2.gz MWYCEDXHBXIHRI-UHFFFAOYSA-N 1 1 277.751 3.505 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc(Cl)cc1O ZINC000841745246 1132388481 /nfs/dbraw/zinc/38/84/81/1132388481.db2.gz OXJUEUWXMNZYDW-LLVKDONJSA-N 1 1 291.778 3.645 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(Cl)cc1O ZINC000841747554 1132389106 /nfs/dbraw/zinc/38/91/06/1132389106.db2.gz CLCOWCLOJCMSSL-JQWIXIFHSA-N 1 1 283.799 3.654 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)C1(C)CC1)c1ccc(Cl)cc1O ZINC000841750482 1132390676 /nfs/dbraw/zinc/39/06/76/1132390676.db2.gz QKIILSDBUVEHFH-NXEZZACHSA-N 1 1 253.773 3.885 20 10 CHCDMO Oc1c(C[N@H+]2CCCC23CC3)ccc2ccccc21 ZINC001231878969 1132390778 /nfs/dbraw/zinc/39/07/78/1132390778.db2.gz WZRRXQRFQUMWJO-UHFFFAOYSA-N 1 1 253.345 3.674 20 10 CHCDMO CC[C@@H](CSC)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752271 1132391716 /nfs/dbraw/zinc/39/17/16/1132391716.db2.gz RZECZPFSEPMZTK-ONGXEEELSA-N 1 1 273.829 3.838 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc2ccccc2c1O)C1CCOCC1 ZINC001231884052 1132391787 /nfs/dbraw/zinc/39/17/87/1132391787.db2.gz UYQVCMWUENNXRQ-UHFFFAOYSA-N 1 1 299.414 3.935 20 10 CHCDMO C[C@]1(F)CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC001231879904 1132392224 /nfs/dbraw/zinc/39/22/24/1132392224.db2.gz VLDMJLURPAWOLT-RDJZCZTQSA-N 1 1 291.341 3.817 20 10 CHCDMO CC(C)C[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841754146 1132392791 /nfs/dbraw/zinc/39/27/91/1132392791.db2.gz HRVGPWAZKKWCBC-QWHCGFSZSA-N 1 1 299.842 3.741 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(Cl)cc1O ZINC000841759266 1132394677 /nfs/dbraw/zinc/39/46/77/1132394677.db2.gz XVENUWGZWFOICG-NWDGAFQWSA-N 1 1 297.826 3.901 20 10 CHCDMO COCCCC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000841894735 1132402179 /nfs/dbraw/zinc/40/21/79/1132402179.db2.gz SMHTYXYYMOOWNL-UHFFFAOYSA-N 1 1 299.414 3.918 20 10 CHCDMO Cc1cccc2c1CC[N@H+](Cc1cc(F)c(F)cc1O)C2 ZINC001142508543 1132403382 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Oc1cccc2c1C[N@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204285279 1133428212 /nfs/dbraw/zinc/42/82/12/1133428212.db2.gz UPWHOGIURFDLRW-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204285279 1133428215 /nfs/dbraw/zinc/42/82/15/1133428215.db2.gz UPWHOGIURFDLRW-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CC1CC([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324071 1133436386 /nfs/dbraw/zinc/43/63/86/1133436386.db2.gz KKOKRSJFRLTLBQ-UHFFFAOYSA-N 1 1 258.409 3.517 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)[C@@H](C)C1 ZINC001204321159 1133436997 /nfs/dbraw/zinc/43/69/97/1133436997.db2.gz HHQZIIRPZPFCKS-HOTGVXAUSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001204961963 1133508154 /nfs/dbraw/zinc/50/81/54/1133508154.db2.gz YFSOGHVOCKUOSA-CWRNSKLLSA-N 1 1 259.393 3.711 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001205489426 1133582822 /nfs/dbraw/zinc/58/28/22/1133582822.db2.gz QGWQXIDOALEZCZ-YOBDTOFLSA-N 1 1 272.436 3.886 20 10 CHCDMO CC[N@H+](Cc1c(O)cc(C)cc1Cl)CC1CCC1 ZINC001205506554 1133584145 /nfs/dbraw/zinc/58/41/45/1133584145.db2.gz ALLHMTPDAHWXRU-UHFFFAOYSA-N 1 1 267.800 3.976 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccccc1 ZINC001206314625 1133688122 /nfs/dbraw/zinc/68/81/22/1133688122.db2.gz RPRYBUIQGFNXPN-HNNXBMFYSA-N 1 1 277.314 3.911 20 10 CHCDMO COc1cc(C)ccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001206783218 1133747988 /nfs/dbraw/zinc/74/79/88/1133747988.db2.gz WWBWPCSUHRBREJ-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO Cc1noc(C)c1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001207137504 1133772658 /nfs/dbraw/zinc/77/26/58/1133772658.db2.gz HGIVQYWGRAFHKV-UHFFFAOYSA-N 1 1 299.418 3.524 20 10 CHCDMO CC[N@@H+](CCc1ccccc1F)Cc1ccccc1O ZINC001207505408 1133810998 /nfs/dbraw/zinc/81/09/98/1133810998.db2.gz ZWTWWFPIJZGQCW-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC001207912328 1133862295 /nfs/dbraw/zinc/86/22/95/1133862295.db2.gz QTTPTJONLGZUNT-MRXNPFEDSA-N 1 1 282.431 3.988 20 10 CHCDMO C[N@@H+](CCCc1ccc(F)cc1)Cc1ccccc1O ZINC001208775659 1133943400 /nfs/dbraw/zinc/94/34/00/1133943400.db2.gz SVPNGNGIXWRXGR-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO COC[C@@H]1CC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209516136 1134031917 /nfs/dbraw/zinc/03/19/17/1134031917.db2.gz ARMINCKOYMCUHP-GOSISDBHSA-N 1 1 298.430 3.562 20 10 CHCDMO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc(F)cc1O ZINC000403489466 1134788595 /nfs/dbraw/zinc/78/85/95/1134788595.db2.gz ANMKSQRQYGYSEF-SMHCIBLRSA-N 1 1 281.396 3.609 20 10 CHCDMO CCC[N@H+](Cc1cc(Cl)ccc1O)CC(C)C ZINC000310092303 1135119807 /nfs/dbraw/zinc/11/98/07/1135119807.db2.gz JXEXQAJZCWGEPS-UHFFFAOYSA-N 1 1 255.789 3.914 20 10 CHCDMO CCC[N@@H+](Cc1cc(Cl)ccc1O)CC(C)C ZINC000310092303 1135119799 /nfs/dbraw/zinc/11/97/99/1135119799.db2.gz JXEXQAJZCWGEPS-UHFFFAOYSA-N 1 1 255.789 3.914 20 10 CHCDMO Cn1cc(-c2[nH+]ccc3c2ccn3C)c(-c2ccccc2)n1 ZINC001222511297 1135246886 /nfs/dbraw/zinc/24/68/86/1135246886.db2.gz BUWOHNPLRSFDGX-UHFFFAOYSA-N 1 1 288.354 3.641 20 10 CHCDMO COCc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000184941850 262035162 /nfs/dbraw/zinc/03/51/62/262035162.db2.gz PKGKLHVIOXWYRG-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO COC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000186034474 262076189 /nfs/dbraw/zinc/07/61/89/262076189.db2.gz HYJCWCFVHQXHNA-MLGOLLRUSA-N 1 1 289.350 3.570 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289890301 263112846 /nfs/dbraw/zinc/11/28/46/263112846.db2.gz SVKJOOKYTFWFMT-OAHLLOKOSA-N 1 1 288.778 3.778 20 10 CHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cs1 ZINC000264960652 328163660 /nfs/dbraw/zinc/16/36/60/328163660.db2.gz NZMKMFMYLDBKMD-SNVBAGLBSA-N 1 1 293.411 3.507 20 10 CHCDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000274273969 328210617 /nfs/dbraw/zinc/21/06/17/328210617.db2.gz XBSCIZOHKHYCDB-HTQZYQBOSA-N 1 1 297.811 3.617 20 10 CHCDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000090339801 327094360 /nfs/dbraw/zinc/09/43/60/327094360.db2.gz ALMSMCNPZWZULZ-NWDGAFQWSA-N 1 1 289.350 3.952 20 10 CHCDMO CCCC[N@@H+](Cc1ccnc(C)c1)Cc1ccccc1O ZINC000527539197 330260818 /nfs/dbraw/zinc/26/08/18/330260818.db2.gz LEYNQANRXZKOES-UHFFFAOYSA-N 1 1 284.403 3.898 20 10 CHCDMO CC[C@H](c1ccc(F)cc1O)[NH+]1CCC(CCOC)CC1 ZINC000527936722 330298097 /nfs/dbraw/zinc/29/80/97/330298097.db2.gz QYCOAYPOZBDYMK-MRXNPFEDSA-N 1 1 295.398 3.731 20 10 CHCDMO CCC[N@@H+](Cc1ccnn1C(C)C)Cc1ccccc1O ZINC000279592632 521692332 /nfs/dbraw/zinc/69/23/32/521692332.db2.gz HUEPYFCXVZMVCU-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)s1 ZINC000062748405 524592528 /nfs/dbraw/zinc/59/25/28/524592528.db2.gz AIKRVMPLVXGLTE-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(F)cc1O ZINC000281109014 525384987 /nfs/dbraw/zinc/38/49/87/525384987.db2.gz LRCVRDUGFOYXHH-VHSXEESVSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]CCC(C)(C)O)c1cc(Cl)c(Cl)cc1O ZINC000278803887 525428419 /nfs/dbraw/zinc/42/84/19/525428419.db2.gz RJKJVDXMPQGJFE-MRVPVSSYSA-N 1 1 292.206 3.511 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(F)cc1O ZINC000062745049 525652137 /nfs/dbraw/zinc/65/21/37/525652137.db2.gz FUEFEOJYKACQHP-BDJLRTHQSA-N 1 1 271.335 3.869 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000129065611 1125472095 /nfs/dbraw/zinc/47/20/95/1125472095.db2.gz LORYEGKHNWUYEZ-DNVCBOLYSA-N 1 1 297.398 3.546 20 10 CHCDMO CCC1CCC(C[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000708558581 1119565747 /nfs/dbraw/zinc/56/57/47/1119565747.db2.gz KCCXMIJPKXGXJL-UHFFFAOYSA-N 1 1 283.362 3.976 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccsc2)cc1C ZINC000111988691 1123472840 /nfs/dbraw/zinc/47/28/40/1123472840.db2.gz SPPNGOBDYFUAAL-UHFFFAOYSA-N 1 1 261.390 3.703 20 10 CHCDMO CC[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000132247455 1125416632 /nfs/dbraw/zinc/41/66/32/1125416632.db2.gz DLBOAIRGEZSWHV-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000132247455 1125416633 /nfs/dbraw/zinc/41/66/33/1125416633.db2.gz DLBOAIRGEZSWHV-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140462211 1131748369 /nfs/dbraw/zinc/74/83/69/1131748369.db2.gz AKXOKRYHFAVDSN-CQSZACIVSA-N 1 1 271.763 3.760 20 10 CHCDMO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841751090 1132389042 /nfs/dbraw/zinc/38/90/42/1132389042.db2.gz KLNGTRADEXMGOS-XHDPSFHLSA-N 1 1 299.842 3.739 20 10 CHCDMO CCOCCCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841745777 1132389922 /nfs/dbraw/zinc/38/99/22/1132389922.db2.gz SXBZQMPYEDVJKM-LLVKDONJSA-N 1 1 271.788 3.513 20 10 CHCDMO CCCC[N@@H+](CC)Cc1cc(Cl)c(OC)cc1O ZINC001232266495 1132447793 /nfs/dbraw/zinc/44/77/93/1132447793.db2.gz VFMFWWWVICEMQN-UHFFFAOYSA-N 1 1 271.788 3.676 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC[C@H](F)C2)c1O ZINC001143110833 1132503168 /nfs/dbraw/zinc/50/31/68/1132503168.db2.gz QMYLELLWARICIE-ZDUSSCGKSA-N 1 1 265.372 3.624 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC001204180112 1133415898 /nfs/dbraw/zinc/41/58/98/1133415898.db2.gz GXWWXILIOWGJJC-GFCCVEGCSA-N 1 1 253.773 3.728 20 10 CHCDMO CN(C)c1cc(F)c(C[N@@H+](C)CC2CCCC2)cc1F ZINC001204421373 1133444266 /nfs/dbraw/zinc/44/42/66/1133444266.db2.gz FJZMFVZMUYMKEP-UHFFFAOYSA-N 1 1 282.378 3.653 20 10 CHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC001204769442 1133483420 /nfs/dbraw/zinc/48/34/20/1133483420.db2.gz UVDDDTFGXJXQDC-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc(Cl)cc1O ZINC000841745524 1125550717 /nfs/dbraw/zinc/55/07/17/1125550717.db2.gz ZNNBZZHTYDNTLB-GFCCVEGCSA-N 1 1 296.842 3.571 20 10 CHCDMO CC(C)[C@H]1CC[N@@H+](Cc2cccc(Br)c2[O-])C1 ZINC000135649002 1125593902 /nfs/dbraw/zinc/59/39/02/1125593902.db2.gz FIKNPDXGNGGTGX-NSHDSACASA-N 1 1 298.224 3.633 20 10 CHCDMO CC(C)[C@H]1CC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000135649002 1125593906 /nfs/dbraw/zinc/59/39/06/1125593906.db2.gz FIKNPDXGNGGTGX-NSHDSACASA-N 1 1 298.224 3.633 20 10 CHCDMO CC(C)[C@H]1CC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000135649002 1125593910 /nfs/dbraw/zinc/59/39/10/1125593910.db2.gz FIKNPDXGNGGTGX-NSHDSACASA-N 1 1 298.224 3.633 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCc2occc21)c1c(O)cccc1F ZINC000886501302 1125681071 /nfs/dbraw/zinc/68/10/71/1125681071.db2.gz FFDGNWLPNCCGPU-GWCFXTLKSA-N 1 1 275.323 3.853 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1F ZINC000886497111 1125681949 /nfs/dbraw/zinc/68/19/49/1125681949.db2.gz SWDXTRVHMTYEIO-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cn1 ZINC000886526882 1125684271 /nfs/dbraw/zinc/68/42/71/1125684271.db2.gz ULNWNUIFMJUYMZ-NEPJUHHUSA-N 1 1 291.370 3.721 20 10 CHCDMO C[C@@H]([NH2+]CCCC(F)(F)F)c1c(O)cccc1F ZINC000886534302 1125685591 /nfs/dbraw/zinc/68/55/91/1125685591.db2.gz FNICDVSSRFRRAX-MRVPVSSYSA-N 1 1 265.250 3.524 20 10 CHCDMO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1c(O)cccc1F ZINC000886558274 1125689843 /nfs/dbraw/zinc/68/98/43/1125689843.db2.gz FTNWUGPIOLKXCX-SECBINFHSA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1c(O)cccc1F ZINC000886619162 1125699828 /nfs/dbraw/zinc/69/98/28/1125699828.db2.gz VGXNAVZDGBQMTC-PRHODGIISA-N 1 1 292.181 3.766 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H]1CCCCO1 ZINC000886634867 1125701047 /nfs/dbraw/zinc/70/10/47/1125701047.db2.gz OSLDHLPNNGFJNI-CORIIIEPSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1c(O)cccc1F ZINC000886647726 1125701916 /nfs/dbraw/zinc/70/19/16/1125701916.db2.gz AEQNZJRNZXSXEW-VIFPVBQESA-N 1 1 275.314 3.863 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCCO1)c1c(O)cccc1F ZINC000886646593 1125702092 /nfs/dbraw/zinc/70/20/92/1125702092.db2.gz NHUOMJUOWFNWKR-XNJJOIOASA-N 1 1 293.382 3.530 20 10 CHCDMO CCCC[N@@H+](Cc1cncs1)Cc1ccccc1O ZINC000282973497 1125745931 /nfs/dbraw/zinc/74/59/31/1125745931.db2.gz IRRCCNXPGSCDGX-UHFFFAOYSA-N 1 1 276.405 3.651 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)CCc2cccs2)c1O ZINC000093685437 1125772813 /nfs/dbraw/zinc/77/28/13/1125772813.db2.gz FSVABNZXJDXNCT-UHFFFAOYSA-N 1 1 291.416 3.527 20 10 CHCDMO C[C@H]([NH2+]C1CC=CC1)c1cccc(C(F)(F)F)c1O ZINC000798181457 1129828132 /nfs/dbraw/zinc/82/81/32/1129828132.db2.gz KJMXBRQHSRLWOP-VIFPVBQESA-N 1 1 271.282 3.780 20 10 CHCDMO CCCC[N@@H+](CCSCC)Cc1ccccc1O ZINC000801595118 1129931303 /nfs/dbraw/zinc/93/13/03/1129931303.db2.gz IIZNUZJTPMURQG-UHFFFAOYSA-N 1 1 267.438 3.747 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000179591846 1126831260 /nfs/dbraw/zinc/83/12/60/1126831260.db2.gz NVOMIVUUHWAQIV-AWEZNQCLSA-N 1 1 289.400 3.799 20 10 CHCDMO Cc1cc(C[N@H+](CC2CC2)C(C)C)ccc1N(C)C ZINC000815063684 1130954357 /nfs/dbraw/zinc/95/43/57/1130954357.db2.gz FQIUEOINZQISIR-UHFFFAOYSA-N 1 1 260.425 3.681 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cscn2)cc1 ZINC000271112405 1127068006 /nfs/dbraw/zinc/06/80/06/1127068006.db2.gz HQOUVYWLEUUSBA-CYBMUJFWSA-N 1 1 289.448 3.840 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cscn1 ZINC000271172207 1127071435 /nfs/dbraw/zinc/07/14/35/1127071435.db2.gz UMVXRUPMQGJPTH-ZDUSSCGKSA-N 1 1 287.432 3.594 20 10 CHCDMO C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236793464 1131009192 /nfs/dbraw/zinc/00/91/92/1131009192.db2.gz KVTWBMPGSATYTP-MRVPVSSYSA-N 1 1 260.164 3.541 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236793464 1131009198 /nfs/dbraw/zinc/00/91/98/1131009198.db2.gz KVTWBMPGSATYTP-MRVPVSSYSA-N 1 1 260.164 3.541 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)C2CCCCC2)c(Cl)c1 ZINC001236802723 1131012726 /nfs/dbraw/zinc/01/27/26/1131012726.db2.gz JKJVWFBEFCGQSV-UHFFFAOYSA-N 1 1 283.799 3.819 20 10 CHCDMO COc1ccc(C[N@@H+]2CCC[C@@H]2C(C)C)c(O)c1Cl ZINC001236805666 1131012870 /nfs/dbraw/zinc/01/28/70/1131012870.db2.gz DPRUHSXTBLWUSM-GFCCVEGCSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2C(C)C)c(O)c1Cl ZINC001236805666 1131012874 /nfs/dbraw/zinc/01/28/74/1131012874.db2.gz DPRUHSXTBLWUSM-GFCCVEGCSA-N 1 1 283.799 3.675 20 10 CHCDMO CCC[N@H+](CC)Cc1c(O)ccc(Cl)c1Cl ZINC001237078023 1131046745 /nfs/dbraw/zinc/04/67/45/1131046745.db2.gz MJPUNQPBWDOULA-UHFFFAOYSA-N 1 1 262.180 3.931 20 10 CHCDMO CCC[N@@H+](CC)Cc1c(O)ccc(Cl)c1Cl ZINC001237078023 1131046750 /nfs/dbraw/zinc/04/67/50/1131046750.db2.gz MJPUNQPBWDOULA-UHFFFAOYSA-N 1 1 262.180 3.931 20 10 CHCDMO C[N@@H+](Cc1ccsc1)Cc1cc(Cl)c(F)cc1O ZINC000816482648 1131099088 /nfs/dbraw/zinc/09/90/88/1131099088.db2.gz NZJUWAWRKZDJFJ-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO CSC[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816516437 1131103304 /nfs/dbraw/zinc/10/33/04/1131103304.db2.gz FRMUNVQRIYZWON-SNVBAGLBSA-N 1 1 289.803 3.512 20 10 CHCDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816516437 1131103306 /nfs/dbraw/zinc/10/33/06/1131103306.db2.gz FRMUNVQRIYZWON-SNVBAGLBSA-N 1 1 289.803 3.512 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)CC1CC(OCC)C1 ZINC000285397179 1127226128 /nfs/dbraw/zinc/22/61/28/1127226128.db2.gz TWWAVAWSWXMUNI-UHFFFAOYSA-N 1 1 291.435 3.809 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])[C@H]1C ZINC001237937068 1131153451 /nfs/dbraw/zinc/15/34/51/1131153451.db2.gz NKHBIQXXYIQTRT-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)[C@H]1C ZINC001237937068 1131153457 /nfs/dbraw/zinc/15/34/57/1131153457.db2.gz NKHBIQXXYIQTRT-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)[C@H]1C ZINC001237937068 1131153460 /nfs/dbraw/zinc/15/34/60/1131153460.db2.gz NKHBIQXXYIQTRT-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(F)cc1O ZINC000285519478 1127235217 /nfs/dbraw/zinc/23/52/17/1127235217.db2.gz DXEHUFSRQBXGIT-IAQYHMDHSA-N 1 1 274.339 3.728 20 10 CHCDMO CC[C@H]([NH2+]CCc1ccncc1C)c1ccc(F)cc1O ZINC000285938793 1127248117 /nfs/dbraw/zinc/24/81/17/1127248117.db2.gz DHLYBQIUBACVGM-INIZCTEOSA-N 1 1 288.366 3.518 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC=C(c3ccco3)C2)c1O ZINC000289120089 1127374055 /nfs/dbraw/zinc/37/40/55/1127374055.db2.gz DKGMNYGLXFBQTJ-UHFFFAOYSA-N 1 1 299.370 3.673 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)CCCOC(C)C)c(Cl)c1 ZINC001308779907 1127470678 /nfs/dbraw/zinc/47/06/78/1127470678.db2.gz WJJMAWIVMJJLCG-UHFFFAOYSA-N 1 1 285.815 3.601 20 10 CHCDMO C[N@@H+](Cc1cc(Br)ccc1O)C1CCCCC1 ZINC000060201645 1127508149 /nfs/dbraw/zinc/50/81/49/1127508149.db2.gz UKCVXKDOWSULRJ-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)c1O ZINC000761225922 1127550128 /nfs/dbraw/zinc/55/01/28/1127550128.db2.gz MYEGECKUAPJDRX-CYBMUJFWSA-N 1 1 277.408 3.659 20 10 CHCDMO CCC[N@@H+](Cc1ccncc1C)Cc1ccccc1O ZINC000295015638 1127614175 /nfs/dbraw/zinc/61/41/75/1127614175.db2.gz ZOYFUJHCTJNYTL-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO Oc1cccc2c1[C@H](Nc1cc(C3CC3)cc[nH+]1)CC2 ZINC000297370774 1127694723 /nfs/dbraw/zinc/69/47/23/1127694723.db2.gz QLSCLOVDRKOBEL-CQSZACIVSA-N 1 1 266.344 3.764 20 10 CHCDMO CC[C@@H]([NH2+]CCC(C)(F)F)c1ccc(F)cc1O ZINC000297379742 1127694771 /nfs/dbraw/zinc/69/47/71/1127694771.db2.gz QYHJYSUPURNYMU-LLVKDONJSA-N 1 1 261.287 3.617 20 10 CHCDMO C[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062745072 1127772411 /nfs/dbraw/zinc/77/24/11/1127772411.db2.gz LMEBTNSMXXWCGZ-QWHCGFSZSA-N 1 1 273.351 3.986 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ncccn1 ZINC000930350970 1128073688 /nfs/dbraw/zinc/07/36/88/1128073688.db2.gz LDLKPRAKWGZLFD-CQSZACIVSA-N 1 1 285.391 3.546 20 10 CHCDMO CC(C)[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)C1CC1 ZINC000324207775 1128160263 /nfs/dbraw/zinc/16/02/63/1128160263.db2.gz CJUROFCSBPOJQB-BMIGLBTASA-N 1 1 251.345 3.617 20 10 CHCDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000777825263 1128288473 /nfs/dbraw/zinc/28/84/73/1128288473.db2.gz RUONYXIEMLTNER-HNNXBMFYSA-N 1 1 269.388 3.764 20 10 CHCDMO Cc1c(C[N@H+]2CCC[C@H](F)CC2)c2ccccc2n1C ZINC001138252868 1128285905 /nfs/dbraw/zinc/28/59/05/1128285905.db2.gz XCXJKHIUHFOYBE-AWEZNQCLSA-N 1 1 274.383 3.811 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000915804488 1128339853 /nfs/dbraw/zinc/33/98/53/1128339853.db2.gz WPMHUYSMDRQARE-UHFFFAOYSA-N 1 1 297.398 3.522 20 10 CHCDMO C[N@H+](Cc1cc2c(cc1O)CCC2)Cc1ccccc1F ZINC000915814311 1128342543 /nfs/dbraw/zinc/34/25/43/1128342543.db2.gz STFAETKMZMQCGU-UHFFFAOYSA-N 1 1 285.362 3.652 20 10 CHCDMO CC[N@@H+](Cc1ccccc1C)Cc1cccc(OC)c1O ZINC000153740700 1128346849 /nfs/dbraw/zinc/34/68/49/1128346849.db2.gz KXEOCQMKRJRHGN-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO Cc1noc(C)c1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917073810 1128473815 /nfs/dbraw/zinc/47/38/15/1128473815.db2.gz BKBCDXKZORTTEW-UHFFFAOYSA-N 1 1 299.418 3.522 20 10 CHCDMO CC(C)=CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074167 1128474199 /nfs/dbraw/zinc/47/41/99/1128474199.db2.gz RRPMKVCVYDLBGG-UHFFFAOYSA-N 1 1 258.409 3.683 20 10 CHCDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585510 1128569022 /nfs/dbraw/zinc/56/90/22/1128569022.db2.gz GOYDXGNFMNBJGY-LIRRHRJNSA-N 1 1 296.414 3.953 20 10 CHCDMO Cc1ccc[nH+]c1NCc1cc(Cl)c2cccnc2c1O ZINC001168524545 1128602844 /nfs/dbraw/zinc/60/28/44/1128602844.db2.gz STBNFXKZCFEXNY-UHFFFAOYSA-N 1 1 299.761 3.909 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1O ZINC000156039588 1128623354 /nfs/dbraw/zinc/62/33/54/1128623354.db2.gz HBAIIESLPVJOEN-ZFWWWQNUSA-N 1 1 275.392 3.555 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000158024513 1128663311 /nfs/dbraw/zinc/66/33/11/1128663311.db2.gz JYRYRQMBLCAZQK-QGZVFWFLSA-N 1 1 267.372 3.820 20 10 CHCDMO CC(C)[C@H](C)[N@@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778988668 1128673797 /nfs/dbraw/zinc/67/37/97/1128673797.db2.gz KFRUNMOBAXHXBT-NSHDSACASA-N 1 1 251.345 3.540 20 10 CHCDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1ccccc1O ZINC000779023634 1128685954 /nfs/dbraw/zinc/68/59/54/1128685954.db2.gz VBNDPCGKZVPGRG-DOTOQJQBSA-N 1 1 281.399 3.845 20 10 CHCDMO CCCC[N@@H+](Cc1cc(OC)c(OC)cc1O)[C@@H](C)CC 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CCC(F)(F)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000858506288 1123658698 /nfs/dbraw/zinc/65/86/98/1123658698.db2.gz FPATVLHCBUJXOT-WPRPVWTQSA-N 1 1 273.298 3.715 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2cc3c(cc2O)CCC3)C[C@H](C)C1(F)F ZINC000863274974 1123857596 /nfs/dbraw/zinc/85/75/96/1123857596.db2.gz OVERCQVXNHPGDK-TXEJJXNPSA-N 1 1 295.373 3.604 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000783593268 1123998399 /nfs/dbraw/zinc/99/83/99/1123998399.db2.gz OVPWXOLRKLXXNO-BPUTZDHNSA-N 1 1 259.393 3.711 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)Cc2ccccc2O)c(C)c1 ZINC000303460209 1124005901 /nfs/dbraw/zinc/00/59/01/1124005901.db2.gz LHHCBOWGIAFVDM-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000840910477 1124016093 /nfs/dbraw/zinc/01/60/93/1124016093.db2.gz NNVKXJULWWUDIL-CQSZACIVSA-N 1 1 272.392 3.847 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cc(F)cc(F)c1O ZINC000866450763 1124066842 /nfs/dbraw/zinc/06/68/42/1124066842.db2.gz 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ZINC000092326842 1129386396 /nfs/dbraw/zinc/38/63/96/1129386396.db2.gz WAYLTOBKRAOHPK-RKDXNWHRSA-N 1 1 278.327 3.548 20 10 CHCDMO Cc1cc(C[N@@H+](C)C[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000738066878 1129390093 /nfs/dbraw/zinc/39/00/93/1129390093.db2.gz POKUFBFXPNLXQI-OAHLLOKOSA-N 1 1 291.435 3.609 20 10 CHCDMO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)C12CCC2 ZINC000248489484 1129419902 /nfs/dbraw/zinc/41/99/02/1129419902.db2.gz HKDASKGAXQDXBM-HFBAOOFYSA-N 1 1 293.382 3.530 20 10 CHCDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093324532 1129421107 /nfs/dbraw/zinc/42/11/07/1129421107.db2.gz UYHOYHMXYNWAJQ-HNNXBMFYSA-N 1 1 298.430 3.521 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2cccc(O)c2)cc1C ZINC000093315579 1129421521 /nfs/dbraw/zinc/42/15/21/1129421521.db2.gz ZTQHIBJDVSZOOC-AWEZNQCLSA-N 1 1 285.387 3.908 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CCC1 ZINC000093475689 1129424567 /nfs/dbraw/zinc/42/45/67/1129424567.db2.gz OSJMERHXTDHTCF-UHFFFAOYSA-N 1 1 258.409 3.661 20 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1129838588 /nfs/dbraw/zinc/83/85/88/1129838588.db2.gz FROVNMGFZLLWOH-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2F)cc1F ZINC000768171459 1129838592 /nfs/dbraw/zinc/83/85/92/1129838592.db2.gz FROVNMGFZLLWOH-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1c(O)cccc1Cl ZINC000768199820 1129839175 /nfs/dbraw/zinc/83/91/75/1129839175.db2.gz ZITJNQYMTMYDNE-OAHLLOKOSA-N 1 1 290.794 3.721 20 10 CHCDMO Cc1ccc(OCC[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768213260 1129844014 /nfs/dbraw/zinc/84/40/14/1129844014.db2.gz PIWZVWLJXZVGIB-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCc3sccc3C2)cc1F ZINC000768234030 1129845883 /nfs/dbraw/zinc/84/58/83/1129845883.db2.gz FVQQEIBQAULWRU-UHFFFAOYSA-N 1 1 290.407 3.512 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCc3sccc3C2)cc1F ZINC000768234030 1129845891 /nfs/dbraw/zinc/84/58/91/1129845891.db2.gz FVQQEIBQAULWRU-UHFFFAOYSA-N 1 1 290.407 3.512 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccc(O)c2)C2CC2)cc1 ZINC000768258898 1129846678 /nfs/dbraw/zinc/84/66/78/1129846678.db2.gz YKUNAPLXGWHKLI-UHFFFAOYSA-N 1 1 296.414 3.623 20 10 CHCDMO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1cc(Cl)ccc1O ZINC000768263519 1129848717 /nfs/dbraw/zinc/84/87/17/1129848717.db2.gz TZGHOKGUNVZVLE-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)CCc2ccccc2)c1O ZINC000768336539 1129852910 /nfs/dbraw/zinc/85/29/10/1129852910.db2.gz VNFQAPAAWJZEKR-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000768361490 1129853649 /nfs/dbraw/zinc/85/36/49/1129853649.db2.gz RMSFYRZKBBLSTC-INIZCTEOSA-N 1 1 297.398 3.780 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000768359958 1129853705 /nfs/dbraw/zinc/85/37/05/1129853705.db2.gz HYHXUFWNCWETFR-HNNXBMFYSA-N 1 1 288.778 3.778 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c(O)cc1C ZINC000768442717 1129857616 /nfs/dbraw/zinc/85/76/16/1129857616.db2.gz ZJYVLOKHWMICPL-DOMZBBRYSA-N 1 1 277.408 3.720 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cc2c(cc1O)CCCC2 ZINC000768461817 1129858807 /nfs/dbraw/zinc/85/88/07/1129858807.db2.gz FQEXXVMPFMFEJR-UHFFFAOYSA-N 1 1 259.393 3.503 20 10 CHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000768541243 1129861599 /nfs/dbraw/zinc/86/15/99/1129861599.db2.gz LWULOXNLXHCYNN-INIZCTEOSA-N 1 1 291.435 3.648 20 10 CHCDMO CC[N@@H+](CCc1ccccn1)Cc1c(O)cccc1Cl ZINC000769039523 1129887790 /nfs/dbraw/zinc/88/77/90/1129887790.db2.gz XCUPOEFOWGJHCK-UHFFFAOYSA-N 1 1 290.794 3.505 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1 ZINC000769398568 1129906061 /nfs/dbraw/zinc/90/60/61/1129906061.db2.gz SWASZPLUUAWYRN-KRWDZBQOSA-N 1 1 298.405 3.881 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000769426328 1129908157 /nfs/dbraw/zinc/90/81/57/1129908157.db2.gz PZLZLTLCTMFVSV-SFHVURJKSA-N 1 1 299.439 3.991 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000769427672 1129908423 /nfs/dbraw/zinc/90/84/23/1129908423.db2.gz TYLQSAZWCXQNIL-UHFFFAOYSA-N 1 1 297.398 3.694 20 10 CHCDMO COc1cccc(C[N@H+]2CCCC[C@H]2CC(C)C)c1O ZINC000769483992 1129909560 /nfs/dbraw/zinc/90/95/60/1129909560.db2.gz BFEZILGBIRTLJZ-HNNXBMFYSA-N 1 1 277.408 3.801 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H]1C ZINC000769487678 1129909900 /nfs/dbraw/zinc/90/99/00/1129909900.db2.gz KVBPPNUHAISCFE-GOEBONIOSA-N 1 1 260.425 3.619 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000769503412 1129913954 /nfs/dbraw/zinc/91/39/54/1129913954.db2.gz KKEGDHFJGAKGBX-LJQANCHMSA-N 1 1 281.399 3.864 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000769498647 1129914081 /nfs/dbraw/zinc/91/40/81/1129914081.db2.gz NTUSHKQWBQQRHK-GDBMZVCRSA-N 1 1 297.398 3.779 20 10 CHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550336 1129917412 /nfs/dbraw/zinc/91/74/12/1129917412.db2.gz RBZKDZDHJWWRNA-IRXDYDNUSA-N 1 1 292.492 3.859 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](C)O1 ZINC000801594586 1129930832 /nfs/dbraw/zinc/93/08/32/1129930832.db2.gz GUKJFJLTGAGNIT-ZBFHGGJFSA-N 1 1 277.408 3.562 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000770283035 1129943075 /nfs/dbraw/zinc/94/30/75/1129943075.db2.gz IEXVWJUGEKJLFR-CVEARBPZSA-N 1 1 272.436 3.907 20 10 CHCDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccccc1O ZINC000770505299 1129947956 /nfs/dbraw/zinc/94/79/56/1129947956.db2.gz NVVMLJHMHIATNF-QGZVFWFLSA-N 1 1 296.414 3.623 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000771937341 1129997340 /nfs/dbraw/zinc/99/73/40/1129997340.db2.gz ASSSDRHKOURLNT-SFHVURJKSA-N 1 1 266.388 3.700 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccc(O)c2)cc1 ZINC000771935306 1129997416 /nfs/dbraw/zinc/99/74/16/1129997416.db2.gz LVDHNNIOQDFAKX-UHFFFAOYSA-N 1 1 298.430 3.870 20 10 CHCDMO C[C@H](Nc1cc[nH+]c2ccsc21)c1ccc(N(C)C)cc1 ZINC000772297914 1130015796 /nfs/dbraw/zinc/01/57/96/1130015796.db2.gz OUBZAWMQURBPGS-LBPRGKRZSA-N 1 1 297.427 3.957 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)C1CCOCC1)c1c(O)cccc1F ZINC000903244448 1130134674 /nfs/dbraw/zinc/13/46/74/1130134674.db2.gz VLCSYLXPRIZAGR-GFCCVEGCSA-N 1 1 295.398 3.635 20 10 CHCDMO Oc1cccc2c1[C@H](Nc1cccc(C3CC3)[nH+]1)CC2 ZINC000903269266 1130141386 /nfs/dbraw/zinc/14/13/86/1130141386.db2.gz QZHRSFKZZJWHRV-CQSZACIVSA-N 1 1 266.344 3.764 20 10 CHCDMO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1c(O)cccc1F ZINC000903274050 1130142950 /nfs/dbraw/zinc/14/29/50/1130142950.db2.gz PJLJRWOEDXBFFD-YEJSDXFRSA-N 1 1 281.396 3.609 20 10 CHCDMO C[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc(Cl)cc1O ZINC000903279833 1130144344 /nfs/dbraw/zinc/14/43/44/1130144344.db2.gz QJTMQIBSDOMJDE-BSROQFBASA-N 1 1 295.810 3.654 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1ccc(F)cc1O ZINC000903284939 1130146168 /nfs/dbraw/zinc/14/61/68/1130146168.db2.gz VEHKCTSGOYJCOD-CMPLNLGQSA-N 1 1 283.412 3.856 20 10 CHCDMO Cc1cc(C)c([C@H](C)NCC[NH+](C(C)C)C(C)C)c(O)c1 ZINC000788506596 1130192014 /nfs/dbraw/zinc/19/20/14/1130192014.db2.gz WSVVJEAXMCPCNM-INIZCTEOSA-N 1 1 292.467 3.778 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1c([O-])ccc(Cl)c1F ZINC001462123240 1130199994 /nfs/dbraw/zinc/19/99/94/1130199994.db2.gz ATGXFJBSBPHUES-BXKDBHETSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC001462123240 1130199997 /nfs/dbraw/zinc/19/99/97/1130199997.db2.gz ATGXFJBSBPHUES-BXKDBHETSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC001462123240 1130200000 /nfs/dbraw/zinc/20/00/00/1130200000.db2.gz ATGXFJBSBPHUES-BXKDBHETSA-N 1 1 271.763 3.805 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)CC1CCCC1 ZINC000789327428 1130243353 /nfs/dbraw/zinc/24/33/53/1130243353.db2.gz OYLKYVDDHUMFEY-KRWDZBQOSA-N 1 1 291.435 3.545 20 10 CHCDMO C[C@]1(C2CC2)C[N@@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000826877324 1130305305 /nfs/dbraw/zinc/30/53/05/1130305305.db2.gz DKHBAEJFAGGMNL-LJQANCHMSA-N 1 1 297.398 3.546 20 10 CHCDMO Cc1ccncc1[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790981500 1130345313 /nfs/dbraw/zinc/34/53/13/1130345313.db2.gz NDJGBXDDQVBSRE-JTQLQIEISA-N 1 1 294.757 3.739 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCCCCC1 ZINC000792156707 1130432549 /nfs/dbraw/zinc/43/25/49/1130432549.db2.gz LPWVIPADTFQOLO-UHFFFAOYSA-N 1 1 257.736 3.561 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)CC(F)(F)F)c1ccc(F)cc1O ZINC000796943592 1130449172 /nfs/dbraw/zinc/44/91/72/1130449172.db2.gz OJMHVUVOYLBVOX-KWQFWETISA-N 1 1 279.277 3.913 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000793569089 1130570324 /nfs/dbraw/zinc/57/03/24/1130570324.db2.gz BPYGZIHOAIEHCL-SFHVURJKSA-N 1 1 296.414 3.987 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c(O)c1 ZINC000811514010 1130620317 /nfs/dbraw/zinc/62/03/17/1130620317.db2.gz ZSNIYCUDKXMZEQ-KRWDZBQOSA-N 1 1 287.403 3.555 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780793149 1130692484 /nfs/dbraw/zinc/69/24/84/1130692484.db2.gz KNCXXURSBXRSDP-YPMHNXCESA-N 1 1 287.325 3.863 20 10 CHCDMO CCO[C@@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999723 1130700873 /nfs/dbraw/zinc/70/08/73/1130700873.db2.gz YGKQWDROVGISJK-QGZVFWFLSA-N 1 1 297.398 3.670 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CC2(C)C)c1 ZINC000781630492 1130732662 /nfs/dbraw/zinc/73/26/62/1130732662.db2.gz UXEVWPOWCYNNCP-NSHDSACASA-N 1 1 298.224 3.599 20 10 CHCDMO Cc1cc(Br)c([O-])c(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c1 ZINC000781907212 1130747076 /nfs/dbraw/zinc/74/70/76/1130747076.db2.gz GMGLBHRTTNLKSR-MNOVXSKESA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@H](C)[C@@H]2C)c1 ZINC000781907212 1130747079 /nfs/dbraw/zinc/74/70/79/1130747079.db2.gz GMGLBHRTTNLKSR-MNOVXSKESA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c1 ZINC000781907212 1130747083 /nfs/dbraw/zinc/74/70/83/1130747083.db2.gz GMGLBHRTTNLKSR-MNOVXSKESA-N 1 1 298.224 3.693 20 10 CHCDMO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccccc1O)[C@H]2C ZINC000781925933 1130748045 /nfs/dbraw/zinc/74/80/45/1130748045.db2.gz CJTVZJDFYBRCEK-KBPBESRZSA-N 1 1 297.398 3.909 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c1O ZINC000781929029 1130750303 /nfs/dbraw/zinc/75/03/03/1130750303.db2.gz OLUABMXWDQCXJK-SUMWQHHRSA-N 1 1 259.393 3.713 20 10 CHCDMO CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H]2CF)c(O)c1 ZINC001235678418 1130768229 /nfs/dbraw/zinc/76/82/29/1130768229.db2.gz BMRACFWGRXMNRH-CQSZACIVSA-N 1 1 265.372 3.624 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N)cc2)cc1 ZINC001235679166 1130768818 /nfs/dbraw/zinc/76/88/18/1130768818.db2.gz PMOHAWAKDQXSPA-SFHVURJKSA-N 1 1 266.388 3.914 20 10 CHCDMO CC(C)[C@@H]1[N@@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000814171904 1130839045 /nfs/dbraw/zinc/83/90/45/1130839045.db2.gz YSTAGRMHAZLSCC-HNNXBMFYSA-N 1 1 263.356 3.542 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@H]12 ZINC000783592152 1130841650 /nfs/dbraw/zinc/84/16/50/1130841650.db2.gz DGEMNQLAZUNGGF-DFBGVHRSSA-N 1 1 263.356 3.542 20 10 CHCDMO COc1cccc(C[N@H+]2CCCC3(CCCC3)C2)c1O ZINC000783743014 1130852278 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CC(C)c1ccc(C[N@H+]2CCc3c(N)cccc3C2)c(O)c1 ZINC001236365658 1130920800 /nfs/dbraw/zinc/92/08/00/1130920800.db2.gz PRRKYUJBDZBSKU-UHFFFAOYSA-N 1 1 296.414 3.656 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccc(F)cc1O ZINC000796778278 1130930743 /nfs/dbraw/zinc/93/07/43/1130930743.db2.gz JEKKVLYQZWECJJ-WBVHZDCISA-N 1 1 297.414 3.759 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)CCSC)c1ccc(F)cc1O ZINC000796770618 1130931509 /nfs/dbraw/zinc/93/15/09/1130931509.db2.gz DWMPDHNVEDXTAI-GWCFXTLKSA-N 1 1 271.401 3.714 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(F)cc1O ZINC000796797539 1130934261 /nfs/dbraw/zinc/93/42/61/1130934261.db2.gz IINYPPKLNRNZRL-LRDDRELGSA-N 1 1 288.366 3.598 20 10 CHCDMO CC[C@H]([NH2+]CCCC1CC1)c1ccc(F)cc1O ZINC000796815126 1130935289 /nfs/dbraw/zinc/93/52/89/1130935289.db2.gz BKKJQMMXQWKYFG-AWEZNQCLSA-N 1 1 251.345 3.762 20 10 CHCDMO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(N)cc1 ZINC001236424025 1130937619 /nfs/dbraw/zinc/93/76/19/1130937619.db2.gz 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CHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817966262 1131193508 /nfs/dbraw/zinc/19/35/08/1131193508.db2.gz JWJQNTROTYSNNT-KUHUBIRLSA-N 1 1 298.430 3.586 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1ccc(F)cc1O ZINC001118427531 1131225986 /nfs/dbraw/zinc/22/59/86/1131225986.db2.gz LXZDWIADAQATGG-PMEZXALUSA-N 1 1 285.309 3.616 20 10 CHCDMO CC(C)C[NH+](Cc1c(O)cccc1F)CC(C)C ZINC001137831991 1131420651 /nfs/dbraw/zinc/42/06/51/1131420651.db2.gz VVPFMNXVCJWSTG-UHFFFAOYSA-N 1 1 253.361 3.645 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001137838448 1131421044 /nfs/dbraw/zinc/42/10/44/1131421044.db2.gz AEQDAAHTDDNVLQ-GFCCVEGCSA-N 1 1 281.346 3.636 20 10 CHCDMO Cc1cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001137855543 1131423919 /nfs/dbraw/zinc/42/39/19/1131423919.db2.gz AXRBQWOIFQVBTR-CALCHBBNSA-N 1 1 266.388 3.546 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC001137859326 1131424951 /nfs/dbraw/zinc/42/49/51/1131424951.db2.gz TYRPVCASDHOTAN-IBGZPJMESA-N 1 1 298.430 3.705 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccno2)c(C)n1-c1ccccc1 ZINC001137859017 1131425393 /nfs/dbraw/zinc/42/53/93/1131425393.db2.gz FHGRQTMNMKAFLM-UHFFFAOYSA-N 1 1 295.386 3.714 20 10 CHCDMO Cc1cc(C[N@@H+](C)Cc2ccno2)c(C)n1-c1ccccc1 ZINC001137859017 1131425396 /nfs/dbraw/zinc/42/53/96/1131425396.db2.gz FHGRQTMNMKAFLM-UHFFFAOYSA-N 1 1 295.386 3.714 20 10 CHCDMO CC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859085 1131425408 /nfs/dbraw/zinc/42/54/08/1131425408.db2.gz IFIOLXFZFLMEBX-IBGZPJMESA-N 1 1 296.414 3.648 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c1O ZINC000830585481 1131461188 /nfs/dbraw/zinc/46/11/88/1131461188.db2.gz FPIUIECFVITILV-WKPIXPDZSA-N 1 1 293.794 3.526 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001138128387 1131470342 /nfs/dbraw/zinc/47/03/42/1131470342.db2.gz GWGMRWVTTIAASH-UHFFFAOYSA-N 1 1 281.346 3.636 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCCC2(CC(F)C2)CC1 ZINC001138128387 1131470345 /nfs/dbraw/zinc/47/03/45/1131470345.db2.gz GWGMRWVTTIAASH-UHFFFAOYSA-N 1 1 281.346 3.636 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1O ZINC000824714730 1131480644 /nfs/dbraw/zinc/48/06/44/1131480644.db2.gz FGGQWGCJNZODJY-YPMHNXCESA-N 1 1 287.325 3.863 20 10 CHCDMO Cc1c(C[N@H+]2CCCC[C@@H](F)C2)c2ccccc2n1C ZINC001138252812 1131482605 /nfs/dbraw/zinc/48/26/05/1131482605.db2.gz VOWOEZLIPWAZDS-CQSZACIVSA-N 1 1 274.383 3.811 20 10 CHCDMO COc1cccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1O ZINC000825103434 1131495818 /nfs/dbraw/zinc/49/58/18/1131495818.db2.gz FGEBBNMPTWMNBS-QGZVFWFLSA-N 1 1 299.370 3.721 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001138675115 1131535925 /nfs/dbraw/zinc/53/59/25/1131535925.db2.gz MOGDXSFHKOCLCD-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001138675115 1131535928 /nfs/dbraw/zinc/53/59/28/1131535928.db2.gz MOGDXSFHKOCLCD-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CC[N@H+](Cc1ccccc1O)Cc1cc(F)cnc1Cl ZINC001138896330 1131558732 /nfs/dbraw/zinc/55/87/32/1131558732.db2.gz YLZIRZWAEDMIBH-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(F)cnc1Cl ZINC001138896330 1131558735 /nfs/dbraw/zinc/55/87/35/1131558735.db2.gz YLZIRZWAEDMIBH-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO Cc1cc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1N(C)C ZINC000844443689 1131566009 /nfs/dbraw/zinc/56/60/09/1131566009.db2.gz KYWQGYVTERAJIC-MRXNPFEDSA-N 1 1 294.389 3.682 20 10 CHCDMO CC[N@@H+](Cc1cccc2c1ccn2C)Cc1ccccc1O ZINC001139160935 1131589141 /nfs/dbraw/zinc/58/91/41/1131589141.db2.gz ARDDQXPOEWITHR-UHFFFAOYSA-N 1 1 294.398 3.906 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1cc(Cl)c(F)cc1F ZINC001144135680 1131589425 /nfs/dbraw/zinc/58/94/25/1131589425.db2.gz YYAIWJNFVQRBHA-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Cl)c(F)cc1F ZINC001144135680 1131589429 /nfs/dbraw/zinc/58/94/29/1131589429.db2.gz YYAIWJNFVQRBHA-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)ccc1N(C)C ZINC001139672320 1131626477 /nfs/dbraw/zinc/62/64/77/1131626477.db2.gz VLUNCWMXBTYENT-ZFWWWQNUSA-N 1 1 260.425 3.681 20 10 CHCDMO Cc1cc(C[N@H+]2CCC23CCCC3)ccc1N(C)C ZINC001139671150 1131626688 /nfs/dbraw/zinc/62/66/88/1131626688.db2.gz SNIVBDXMAOVGNM-UHFFFAOYSA-N 1 1 258.409 3.580 20 10 CHCDMO Cc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)ccc1N(C)C ZINC001139672717 1131627170 /nfs/dbraw/zinc/62/71/70/1131627170.db2.gz CUAYIKDNPQKSMK-FUHWJXTLSA-N 1 1 272.436 3.826 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@H]2C(C)C)ccc1N(C)C ZINC001139673163 1131627565 /nfs/dbraw/zinc/62/75/65/1131627565.db2.gz ATWHQSWPNSPCRZ-INIZCTEOSA-N 1 1 260.425 3.681 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1N(C)C ZINC001139673459 1131627660 /nfs/dbraw/zinc/62/76/60/1131627660.db2.gz RTHAWWWQNACBEJ-OKILXGFUSA-N 1 1 260.425 3.539 20 10 CHCDMO Oc1cccc(Br)c1C[N@@H+](CC1CC1)C1CC1 ZINC001140103594 1131663719 /nfs/dbraw/zinc/66/37/19/1131663719.db2.gz QEDJVFZOKTYHCW-UHFFFAOYSA-N 1 1 296.208 3.529 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCc3ccc(F)cc3C2)c1O ZINC001140182508 1131674084 /nfs/dbraw/zinc/67/40/84/1131674084.db2.gz TULOQKDKZZRUNT-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO F[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000846122513 1131688890 /nfs/dbraw/zinc/68/88/90/1131688890.db2.gz NIODENSVNNBKMV-INIZCTEOSA-N 1 1 276.399 3.611 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)C(F)F ZINC000834828535 1131707672 /nfs/dbraw/zinc/70/76/72/1131707672.db2.gz VFOYNEYJHHTXLU-PWSUYJOCSA-N 1 1 257.324 3.703 20 10 CHCDMO CC[C@@H]([NH2+][C@H](CC)C(F)F)c1ccc(N(C)C)cc1 ZINC000834827075 1131707730 /nfs/dbraw/zinc/70/77/30/1131707730.db2.gz IAOSSEDXGDYHTK-ZIAGYGMSSA-N 1 1 270.367 3.837 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000834909827 1131730408 /nfs/dbraw/zinc/73/04/08/1131730408.db2.gz MHCOOPQOOILOHN-SWLSCSKDSA-N 1 1 295.398 3.777 20 10 CHCDMO CCC(C)(C)OCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000834916145 1131733515 /nfs/dbraw/zinc/73/35/15/1131733515.db2.gz VHWJWNNNOMCAGY-JTQLQIEISA-N 1 1 287.350 3.526 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001140465428 1131750235 /nfs/dbraw/zinc/75/02/35/1131750235.db2.gz NAGBPWHMYKRBBB-FZMZJTMJSA-N 1 1 265.784 3.810 20 10 CHCDMO C[C@@H](c1ccccn1)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835043621 1131762479 /nfs/dbraw/zinc/76/24/79/1131762479.db2.gz ADNRAIJETNOKQX-WAVCKPEOSA-N 1 1 295.430 3.854 20 10 CHCDMO C[C@H]1CC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC000835049787 1131765302 /nfs/dbraw/zinc/76/53/02/1131765302.db2.gz STKOCIBOBBUGLU-RGDDUWESSA-N 1 1 290.476 3.593 20 10 CHCDMO Cc1ccncc1C[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835051085 1131766192 /nfs/dbraw/zinc/76/61/92/1131766192.db2.gz CDOPRNWTPCUROO-WAYWQWQTSA-N 1 1 295.430 3.601 20 10 CHCDMO COc1ccc([N@H+](CC[C@@H]2CCOC2)CC(C)C)cc1 ZINC001171280071 1131791845 /nfs/dbraw/zinc/79/18/45/1131791845.db2.gz ZHJGYRISXDDJDE-OAHLLOKOSA-N 1 1 277.408 3.584 20 10 CHCDMO COc1ccc([N@@H+](CC[C@@H]2CCOC2)CC(C)C)cc1 ZINC001171280071 1131791851 /nfs/dbraw/zinc/79/18/51/1131791851.db2.gz ZHJGYRISXDDJDE-OAHLLOKOSA-N 1 1 277.408 3.584 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](C)[C@H]2C)c(O)c1 ZINC001140855228 1131948154 /nfs/dbraw/zinc/94/81/54/1131948154.db2.gz SKADXVOFYZGION-LSDHHAIUSA-N 1 1 290.451 3.859 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC3(CCC3)C2)c(O)c1 ZINC001140856203 1131949553 /nfs/dbraw/zinc/94/95/53/1131949553.db2.gz TTYJSYOIIQKHFZ-UHFFFAOYSA-N 1 1 288.435 3.614 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1Cl ZINC001140921365 1131962579 /nfs/dbraw/zinc/96/25/79/1131962579.db2.gz CFZNJPOUGOLYIJ-LBPRGKRZSA-N 1 1 266.816 3.780 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(O)c1 ZINC001140950210 1131970127 /nfs/dbraw/zinc/97/01/27/1131970127.db2.gz VRILDJFXBBJDGN-CQSZACIVSA-N 1 1 285.362 3.829 20 10 CHCDMO CCc1ccccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001141229176 1132052361 /nfs/dbraw/zinc/05/23/61/1132052361.db2.gz MAFPCTVUXPQULE-UHFFFAOYSA-N 1 1 282.431 3.947 20 10 CHCDMO C[N@H+]1CC[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001229814324 1132120706 /nfs/dbraw/zinc/12/07/06/1132120706.db2.gz OPXCILYLFJVDKM-AMGRQBIBSA-N 1 1 297.358 3.891 20 10 CHCDMO C[N@@H+](Cc1cccc(Cl)c1[O-])C1CC(C)(C)C1 ZINC000839183763 1132188350 /nfs/dbraw/zinc/18/83/50/1132188350.db2.gz BRCKGYIDBLAFBI-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c1O ZINC000839195705 1132191083 /nfs/dbraw/zinc/19/10/83/1132191083.db2.gz FPIUIECFVITILV-ONERCXAPSA-N 1 1 293.794 3.526 20 10 CHCDMO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000840175240 1132249898 /nfs/dbraw/zinc/24/98/98/1132249898.db2.gz RZBWTIOBUGJEGB-UHFFFAOYSA-N 1 1 295.382 3.727 20 10 CHCDMO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000840175240 1132249902 /nfs/dbraw/zinc/24/99/02/1132249902.db2.gz RZBWTIOBUGJEGB-UHFFFAOYSA-N 1 1 295.382 3.727 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)nc1C ZINC000840782925 1132286292 /nfs/dbraw/zinc/28/62/92/1132286292.db2.gz GFDLZHPCQJASEV-NSHDSACASA-N 1 1 292.329 3.533 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000840912392 1132308319 /nfs/dbraw/zinc/30/83/19/1132308319.db2.gz GGBWVBQGAHHYND-KRWDZBQOSA-N 1 1 298.434 3.511 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000840912392 1132308321 /nfs/dbraw/zinc/30/83/21/1132308321.db2.gz GGBWVBQGAHHYND-KRWDZBQOSA-N 1 1 298.434 3.511 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000840918459 1132310326 /nfs/dbraw/zinc/31/03/26/1132310326.db2.gz UDFFULFFMQBHEE-OAHLLOKOSA-N 1 1 298.430 3.960 20 10 CHCDMO COC[C@H]1CCCC[N@@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840938177 1132310562 /nfs/dbraw/zinc/31/05/62/1132310562.db2.gz LPAAESJIJODXRC-ZDUSSCGKSA-N 1 1 297.826 3.603 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)c1 ZINC000840946859 1132311644 /nfs/dbraw/zinc/31/16/44/1132311644.db2.gz PPSDWZPNIHYAJV-SNVBAGLBSA-N 1 1 289.753 3.831 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)Cc2cnccc2C)c(Cl)c1 ZINC000840941521 1132312177 /nfs/dbraw/zinc/31/21/77/1132312177.db2.gz YRKNGNSQCBYEHB-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2cnccc2C)c(Cl)c1 ZINC000840941521 1132312181 /nfs/dbraw/zinc/31/21/81/1132312181.db2.gz YRKNGNSQCBYEHB-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)CC[C@]1(C)O ZINC001231587457 1132317183 /nfs/dbraw/zinc/31/71/83/1132317183.db2.gz CLLFOENVRJMTDX-KUHUBIRLSA-N 1 1 299.414 3.528 20 10 CHCDMO C[C@@]1(F)CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC001231587626 1132317690 /nfs/dbraw/zinc/31/76/90/1132317690.db2.gz WSISTPCOUCEPBE-IAGOWNOFSA-N 1 1 291.341 3.817 20 10 CHCDMO C[C@@]1(CO)CCC[N@@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231587483 1132318323 /nfs/dbraw/zinc/31/83/23/1132318323.db2.gz CZIVWDIOVFIVQK-LJQANCHMSA-N 1 1 299.414 3.530 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(O)ccc3ccccc32)cn1 ZINC001231589065 1132319723 /nfs/dbraw/zinc/31/97/23/1132319723.db2.gz BZHVIZPDTLNOPF-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](Oc3ccccc3C)C2)c1O ZINC001231593332 1132321879 /nfs/dbraw/zinc/32/18/79/1132321879.db2.gz UMOYMPFOEDIFQB-QGZVFWFLSA-N 1 1 297.398 3.662 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001231843421 1132375815 /nfs/dbraw/zinc/37/58/15/1132375815.db2.gz YQDXIZQFURTVSK-UHFFFAOYSA-N 1 1 267.372 3.833 20 10 CHCDMO COc1ccc2c(c1)CC[N@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231842469 1132375915 /nfs/dbraw/zinc/37/59/15/1132375915.db2.gz NAXDHVMKEYBBTL-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO COc1cccc2c1CC[N@@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231849957 1132377736 /nfs/dbraw/zinc/37/77/36/1132377736.db2.gz XYJWUSDYDQLCIH-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO Cc1cc(C)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC001231849943 1132379041 /nfs/dbraw/zinc/37/90/41/1132379041.db2.gz XFFHRWRUHWFFPQ-HNNXBMFYSA-N 1 1 281.399 3.956 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCOC3(CCCCC3)C2)c(O)c1 ZINC001231850024 1132379958 /nfs/dbraw/zinc/37/99/58/1132379958.db2.gz YVUIOODMZIZNNP-UHFFFAOYSA-N 1 1 289.419 3.544 20 10 CHCDMO COCC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870804 1132383192 /nfs/dbraw/zinc/38/31/92/1132383192.db2.gz UTRSHPHHPWRDPH-AWEZNQCLSA-N 1 1 297.826 3.745 20 10 CHCDMO CC(C)COCCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841744112 1132386833 /nfs/dbraw/zinc/38/68/33/1132386833.db2.gz LZPXLXCJZPPKAJ-GFCCVEGCSA-N 1 1 285.815 3.759 20 10 CHCDMO CCSCCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841750783 1132389908 /nfs/dbraw/zinc/38/99/08/1132389908.db2.gz BEDKSSQVCXHOKY-JTQLQIEISA-N 1 1 273.829 3.839 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)ccc2ccccc21 ZINC001231879348 1132389754 /nfs/dbraw/zinc/38/97/54/1132389754.db2.gz CGPTXAFTCKNZNF-QAPCUYQASA-N 1 1 297.398 3.546 20 10 CHCDMO CSC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841751015 1132389768 /nfs/dbraw/zinc/38/97/68/1132389768.db2.gz DYQQWNCPBGIMJY-VIFPVBQESA-N 1 1 271.813 3.592 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc2ccccc2c1O ZINC001231878779 1132391963 /nfs/dbraw/zinc/39/19/63/1132391963.db2.gz SXFBSPQGZWLCIS-ZDUSSCGKSA-N 1 1 255.361 3.920 20 10 CHCDMO COCCC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841759864 1132394357 /nfs/dbraw/zinc/39/43/57/1132394357.db2.gz QBFFZLKSRHRYBZ-LBPRGKRZSA-N 1 1 297.826 3.903 20 10 CHCDMO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(Cl)cc1O ZINC000841758326 1132395073 /nfs/dbraw/zinc/39/50/73/1132395073.db2.gz LDBHMYCGPAPWDQ-IINYFYTJSA-N 1 1 285.840 3.982 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841758078 1132395149 /nfs/dbraw/zinc/39/51/49/1132395149.db2.gz RYVCPIDMEFWMAN-QWRGUYRKSA-N 1 1 285.840 3.839 20 10 CHCDMO CSCC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841761911 1132396054 /nfs/dbraw/zinc/39/60/54/1132396054.db2.gz HRWJXQBKMDLJPX-VHSXEESVSA-N 1 1 273.829 3.838 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001142508971 1132402750 /nfs/dbraw/zinc/40/27/50/1132402750.db2.gz 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C[C@]1(F)CC[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@@H]1F ZINC001204324782 1133437973 /nfs/dbraw/zinc/43/79/73/1133437973.db2.gz OMZYAQXVCMFDML-IRXDYDNUSA-N 1 1 294.389 3.559 20 10 CHCDMO C[C@]1(F)CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C[C@@H]1F ZINC001204324782 1133437979 /nfs/dbraw/zinc/43/79/79/1133437979.db2.gz OMZYAQXVCMFDML-IRXDYDNUSA-N 1 1 294.389 3.559 20 10 CHCDMO C[C@]1(F)CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325816 1133438415 /nfs/dbraw/zinc/43/84/15/1133438415.db2.gz VPIBSJRKYYAHDU-KRWDZBQOSA-N 1 1 276.399 3.611 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)o1)Cc1ccc(N(C)C)cc1 ZINC001204540284 1133458870 /nfs/dbraw/zinc/45/88/70/1133458870.db2.gz UYOOSOZJNJKGGS-UHFFFAOYSA-N 1 1 286.419 3.985 20 10 CHCDMO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC001204769442 1133483418 /nfs/dbraw/zinc/48/34/18/1133483418.db2.gz UVDDDTFGXJXQDC-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001204887937 1133495923 /nfs/dbraw/zinc/49/59/23/1133495923.db2.gz CRDDQXWSOWFBGJ-CRAIPNDOSA-N 1 1 272.436 3.826 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC2(C)CC2)cc1 ZINC001205032161 1133518333 /nfs/dbraw/zinc/51/83/33/1133518333.db2.gz AQKDARJOJINNPA-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)CCc2ccccn2)c1 ZINC001205366540 1133570465 /nfs/dbraw/zinc/57/04/65/1133570465.db2.gz IHIOBIOOKUFDJO-UHFFFAOYSA-N 1 1 284.403 3.585 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2Cc3cccc(O)c3C2)c1 ZINC001207242347 1133780624 /nfs/dbraw/zinc/78/06/24/1133780624.db2.gz CKEPIECZXQMFGQ-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2Cc3cccc(O)c3C2)c1 ZINC001207242347 1133780627 /nfs/dbraw/zinc/78/06/27/1133780627.db2.gz CKEPIECZXQMFGQ-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+]Cc1cscc1Cl ZINC001207570210 1133821305 /nfs/dbraw/zinc/82/13/05/1133821305.db2.gz OXCYTBGJLDMSQS-UHFFFAOYSA-N 1 1 289.734 3.675 20 10 CHCDMO CC1=C[C@H](C)[C@H](C[N@@H+](C)Cc2ccccc2O)CC1 ZINC001208179759 1133898572 /nfs/dbraw/zinc/89/85/72/1133898572.db2.gz BZTRLSXBPHQPQB-GJZGRUSLSA-N 1 1 259.393 3.816 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCCO[C@@H](C)C2)cc1 ZINC001209519628 1134035304 /nfs/dbraw/zinc/03/53/04/1134035304.db2.gz YZCKUHFEENUZBZ-KRWDZBQOSA-N 1 1 298.430 3.705 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N)cc1 ZINC001218337427 1135089363 /nfs/dbraw/zinc/08/93/63/1135089363.db2.gz YYZFFZJSYLGRKL-DNVCBOLYSA-N 1 1 296.414 3.558 20 10 CHCDMO C[C@@H]([NH2+]CC1(C)CCCC1)c1ccc(F)cc1O ZINC000104444822 186004744 /nfs/dbraw/zinc/00/47/44/186004744.db2.gz TWWZJRYJRKRUEK-LLVKDONJSA-N 1 1 251.345 3.762 20 10 CHCDMO CC[N@@H+](Cc1ccc(N)cc1)Cc1cccc(Cl)c1 ZINC000035361411 172152497 /nfs/dbraw/zinc/15/24/97/172152497.db2.gz NDXVCZROELFDCT-UHFFFAOYSA-N 1 1 274.795 3.944 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C(C)C)c1O ZINC000037328778 173129116 /nfs/dbraw/zinc/12/91/16/173129116.db2.gz FRCWCTLFZFMMQM-JTQLQIEISA-N 1 1 283.799 3.725 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@@H](C)C(C)C)c1O ZINC000037328778 173129119 /nfs/dbraw/zinc/12/91/19/173129119.db2.gz FRCWCTLFZFMMQM-JTQLQIEISA-N 1 1 283.799 3.725 20 10 CHCDMO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000186157603 262082435 /nfs/dbraw/zinc/08/24/35/262082435.db2.gz YJLOKVHBYATIMS-NXEZZACHSA-N 1 1 292.354 3.590 20 10 CHCDMO Cc1csc([C@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000186561865 262098810 /nfs/dbraw/zinc/09/88/10/262098810.db2.gz KFJHPMDAKGYFKS-MWLCHTKSSA-N 1 1 294.395 3.751 20 10 CHCDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000090339799 327094330 /nfs/dbraw/zinc/09/43/30/327094330.db2.gz ALMSMCNPZWZULZ-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO Oc1ccc(C2=CC[N@H+](Cc3cccc(F)c3O)CC2)cc1 ZINC000378497439 329053039 /nfs/dbraw/zinc/05/30/39/329053039.db2.gz PTHRPUBRCJVQJB-UHFFFAOYSA-N 1 1 299.345 3.526 20 10 CHCDMO Oc1ccc(C2=CC[N@@H+](Cc3cccc(F)c3O)CC2)cc1 ZINC000378497439 329053040 /nfs/dbraw/zinc/05/30/40/329053040.db2.gz PTHRPUBRCJVQJB-UHFFFAOYSA-N 1 1 299.345 3.526 20 10 CHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)n1 ZINC000180162921 329218290 /nfs/dbraw/zinc/21/82/90/329218290.db2.gz RKUFFXUZOCJKFJ-INIZCTEOSA-N 1 1 286.350 3.572 20 10 CHCDMO CCOc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062747657 521373081 /nfs/dbraw/zinc/37/30/81/521373081.db2.gz WBDZKXJLZNOFNZ-GFCCVEGCSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc(C)c1O ZINC000290478319 522965689 /nfs/dbraw/zinc/96/56/89/522965689.db2.gz NYDRXSFBMZJPEA-MRXNPFEDSA-N 1 1 270.376 3.679 20 10 CHCDMO Cc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062747668 525169214 /nfs/dbraw/zinc/16/92/14/525169214.db2.gz PTRDXHAFBIYCEO-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc2ccccc2c1[O-] ZINC000045663351 525434917 /nfs/dbraw/zinc/43/49/17/525434917.db2.gz QJBOKJNGVLLYQB-CQSZACIVSA-N 1 1 286.419 3.538 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccc(F)cc1O ZINC000062745433 525681255 /nfs/dbraw/zinc/68/12/55/525681255.db2.gz WRONREOHNYVWBM-YGRLFVJLSA-N 1 1 275.323 3.853 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000280823289 526330664 /nfs/dbraw/zinc/33/06/64/526330664.db2.gz VRFKSIRJNXROHW-SHTZXODSSA-N 1 1 271.335 3.567 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2)cc1 ZINC000773809127 1121864919 /nfs/dbraw/zinc/86/49/19/1121864919.db2.gz NLIGAPVBWKUNTI-ZDUSSCGKSA-N 1 1 286.341 3.527 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccsc1 ZINC001181196488 1122040965 /nfs/dbraw/zinc/04/09/65/1122040965.db2.gz POHHCWLFAHIVPW-MRVPVSSYSA-N 1 1 269.316 3.583 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC001140180131 1131673383 /nfs/dbraw/zinc/67/33/83/1131673383.db2.gz SSYXEWSHOQNZCB-LBPRGKRZSA-N 1 1 287.325 3.783 20 10 CHCDMO CC1(C)CCC[N@@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233415687 1132619040 /nfs/dbraw/zinc/61/90/40/1132619040.db2.gz FRZVUCXCEWKHHS-UHFFFAOYSA-N 1 1 273.298 3.785 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233415687 1132619044 /nfs/dbraw/zinc/61/90/44/1132619044.db2.gz FRZVUCXCEWKHHS-UHFFFAOYSA-N 1 1 273.298 3.785 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](C)CC[C@@H]1C ZINC001204163906 1133412138 /nfs/dbraw/zinc/41/21/38/1133412138.db2.gz VLSLZNYUBQQIGF-ZFWWWQNUSA-N 1 1 260.425 3.681 20 10 CHCDMO CC1(C)CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001204534543 1133459577 /nfs/dbraw/zinc/45/95/77/1133459577.db2.gz SYEMDMUNRRNIMT-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO CCC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C(C)C ZINC001206464714 1133705411 /nfs/dbraw/zinc/70/54/11/1133705411.db2.gz VGNBGRYHCVEBOV-FPLPWBNLSA-N 1 1 260.425 3.886 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000884482665 1125567657 /nfs/dbraw/zinc/56/76/57/1125567657.db2.gz GEDKAKKDTFRYBR-HNAYVOBHSA-N 1 1 297.398 3.546 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134978274 1125572659 /nfs/dbraw/zinc/57/26/59/1125572659.db2.gz ADWULJAFIUERPW-ZDUSSCGKSA-N 1 1 255.361 3.777 20 10 CHCDMO CCOCC(C)(C)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841755531 1125592704 /nfs/dbraw/zinc/59/27/04/1125592704.db2.gz INMDCRFCVQMYLB-LLVKDONJSA-N 1 1 285.815 3.759 20 10 CHCDMO CCOc1cccc(C[N@H+]2[C@@H](C)CC[C@@H]2CC)c1O ZINC000136821611 1125648079 /nfs/dbraw/zinc/64/80/79/1125648079.db2.gz QXRZNKQAVXPVON-JSGCOSHPSA-N 1 1 263.381 3.554 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1c(O)cccc1F ZINC000886501303 1125681218 /nfs/dbraw/zinc/68/12/18/1125681218.db2.gz FFDGNWLPNCCGPU-GXFFZTMASA-N 1 1 275.323 3.853 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1c(O)cccc1F ZINC000886525022 1125684039 /nfs/dbraw/zinc/68/40/39/1125684039.db2.gz VWGFOOSEMSDALR-QMTHXVAHSA-N 1 1 287.334 3.575 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1c(O)cccc1F ZINC000886525020 1125684222 /nfs/dbraw/zinc/68/42/22/1125684222.db2.gz VWGFOOSEMSDALR-HZMBPMFUSA-N 1 1 287.334 3.575 20 10 CHCDMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1c(O)cccc1F)CO2 ZINC000886551849 1125689837 /nfs/dbraw/zinc/68/98/37/1125689837.db2.gz PNKAGUCEVNUQQB-BXUZGUMPSA-N 1 1 287.334 3.624 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1c(O)cccc1F ZINC000886551465 1125689949 /nfs/dbraw/zinc/68/99/49/1125689949.db2.gz IKGHQKDAMHRTTG-OLZOCXBDSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1c(C)noc1C ZINC000886556979 1125690326 /nfs/dbraw/zinc/69/03/26/1125690326.db2.gz OFZQENJGUIMNME-NOZJJQNGSA-N 1 1 292.354 3.938 20 10 CHCDMO Cc1csc([C@H](C)C[NH2+][C@H](C)c2c(O)cccc2F)n1 ZINC000886587924 1125693771 /nfs/dbraw/zinc/69/37/71/1125693771.db2.gz IITCVSVEEOLSSR-MWLCHTKSSA-N 1 1 294.395 3.751 20 10 CHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886589996 1125694365 /nfs/dbraw/zinc/69/43/65/1125694365.db2.gz LIYHFOYGFAFUTQ-DTWKUNHWSA-N 1 1 279.277 3.913 20 10 CHCDMO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1c(O)cccc1F ZINC000886590096 1125695299 /nfs/dbraw/zinc/69/52/99/1125695299.db2.gz NTPONJUCHPPKBD-QWHCGFSZSA-N 1 1 281.371 3.531 20 10 CHCDMO C[N@@H+](C/C=C\c1ccccc1)Cc1ccccc1O ZINC000220114815 1125699199 /nfs/dbraw/zinc/69/91/99/1125699199.db2.gz SAIXOUIWFJLWOV-YFHOEESVSA-N 1 1 253.345 3.537 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H]1CCCCO1 ZINC000886634869 1125700668 /nfs/dbraw/zinc/70/06/68/1125700668.db2.gz OSLDHLPNNGFJNI-WHOFXGATSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1c(O)cccc1F ZINC000886640381 1125701222 /nfs/dbraw/zinc/70/12/22/1125701222.db2.gz XXOMTEZLKCGDHZ-DTWKUNHWSA-N 1 1 292.181 3.766 20 10 CHCDMO CCC[N@@H+](Cc1cccc(Cl)n1)Cc1ccccc1O ZINC000174373336 1126769417 /nfs/dbraw/zinc/76/94/17/1126769417.db2.gz DMOLVFQCHVXIFU-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccccc1O ZINC000177676193 1126803660 /nfs/dbraw/zinc/80/36/60/1126803660.db2.gz PHXHHXZLOBAPGV-LBPRGKRZSA-N 1 1 288.391 3.871 20 10 CHCDMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccccc1O ZINC000177676193 1126803662 /nfs/dbraw/zinc/80/36/62/1126803662.db2.gz PHXHHXZLOBAPGV-LBPRGKRZSA-N 1 1 288.391 3.871 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2cccnc2)cc1C ZINC000183718262 1126890750 /nfs/dbraw/zinc/89/07/50/1126890750.db2.gz XZCNTVCGXXUZGQ-AWEZNQCLSA-N 1 1 270.376 3.597 20 10 CHCDMO CC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192841678 1126964686 /nfs/dbraw/zinc/96/46/86/1126964686.db2.gz GDNKLPMUSLGTEM-ISVAXAHUSA-N 1 1 292.206 3.511 20 10 CHCDMO CC[C@@H]([NH2+]CCOCCC(C)C)c1ccc(F)cc1O ZINC000796723868 1130926223 /nfs/dbraw/zinc/92/62/23/1130926223.db2.gz PPDXYFYAHOHPAA-OAHLLOKOSA-N 1 1 283.387 3.635 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H]1CCCCS1)c1ccc(F)cc1O ZINC000796932815 1130946996 /nfs/dbraw/zinc/94/69/96/1130946996.db2.gz LUZKSJONJACTGS-TZMCWYRMSA-N 1 1 283.412 3.858 20 10 CHCDMO CCC[N@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1O ZINC000270636958 1127059910 /nfs/dbraw/zinc/05/99/10/1127059910.db2.gz RBHBOEQPJFYTOI-UHFFFAOYSA-N 1 1 286.375 3.670 20 10 CHCDMO CCC[N@@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1O ZINC000270636958 1127059913 /nfs/dbraw/zinc/05/99/13/1127059913.db2.gz RBHBOEQPJFYTOI-UHFFFAOYSA-N 1 1 286.375 3.670 20 10 CHCDMO CC(C)[N@@H+](Cc1cncs1)Cc1ccc(N(C)C)cc1 ZINC000271058236 1127067128 /nfs/dbraw/zinc/06/71/28/1127067128.db2.gz FBZOKARZFZOMGV-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO CCC[N@H+](Cc1c(O)cc(OC)cc1Cl)CC(C)C ZINC001236809490 1131010980 /nfs/dbraw/zinc/01/09/80/1131010980.db2.gz WDGIAENSZILBBE-UHFFFAOYSA-N 1 1 285.815 3.922 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1OC(F)(F)F)CC(C)(C)C ZINC001237122247 1131056445 /nfs/dbraw/zinc/05/64/45/1131056445.db2.gz HAIJEDKCLYVZPP-UHFFFAOYSA-N 1 1 291.313 3.769 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808621 1131142664 /nfs/dbraw/zinc/14/26/64/1131142664.db2.gz UYYMUMJHUCTDDX-CQSZACIVSA-N 1 1 289.753 3.899 20 10 CHCDMO CC[C@H]([NH2+]CCc1csc(C)n1)c1ccc(F)cc1O ZINC000285587865 1127238252 /nfs/dbraw/zinc/23/82/52/1127238252.db2.gz JADCSDDKEBNCOT-AWEZNQCLSA-N 1 1 294.395 3.580 20 10 CHCDMO CSC1CC[NH+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237937732 1131153902 /nfs/dbraw/zinc/15/39/02/1131153902.db2.gz UJLPMNBMMFQEBT-UHFFFAOYSA-N 1 1 289.803 3.512 20 10 CHCDMO CC[C@@H]([NH2+]CCc1ccccc1O)c1ccc(F)cc1O ZINC000285958249 1127248866 /nfs/dbraw/zinc/24/88/66/1127248866.db2.gz GMKZMNZIWXLXON-OAHLLOKOSA-N 1 1 289.350 3.520 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817412564 1131159916 /nfs/dbraw/zinc/15/99/16/1131159916.db2.gz MTFNBGUNXVSTKJ-LLVKDONJSA-N 1 1 273.298 3.557 20 10 CHCDMO CCC[N@@H+](Cc1cc(F)cc(C)c1O)[C@@H](C)CC ZINC001238056219 1131165012 /nfs/dbraw/zinc/16/50/12/1131165012.db2.gz FUEJGUPMEQNRRJ-LBPRGKRZSA-N 1 1 253.361 3.850 20 10 CHCDMO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(F)cc2O)o1 ZINC000293646426 1127510548 /nfs/dbraw/zinc/51/05/48/1127510548.db2.gz LAAVSHYBNSDEEL-SNVBAGLBSA-N 1 1 292.354 3.631 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c1 ZINC000294073745 1127547055 /nfs/dbraw/zinc/54/70/55/1127547055.db2.gz YOAGFSHQZAFEDW-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1cnccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000294529722 1127581094 /nfs/dbraw/zinc/58/10/94/1127581094.db2.gz GWNGAHGZDHCNQI-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001237938056 1129221353 /nfs/dbraw/zinc/22/13/53/1129221353.db2.gz XGRBGPAXZAJYIQ-MRVPVSSYSA-N 1 1 293.716 3.662 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001237938056 1129221356 /nfs/dbraw/zinc/22/13/56/1129221356.db2.gz XGRBGPAXZAJYIQ-MRVPVSSYSA-N 1 1 293.716 3.662 20 10 CHCDMO CC[C@@H]([NH2+]CCc1scnc1C)c1ccc(F)cc1O ZINC000296335415 1127668837 /nfs/dbraw/zinc/66/88/37/1127668837.db2.gz HNIAUAIQPMVZIQ-CYBMUJFWSA-N 1 1 294.395 3.580 20 10 CHCDMO C[N@@H+](Cc1cccc(Cl)c1)Cc1ccccc1O ZINC000171926635 1127734813 /nfs/dbraw/zinc/73/48/13/1127734813.db2.gz NDEYOZXGTTXPDQ-UHFFFAOYSA-N 1 1 261.752 3.678 20 10 CHCDMO C[C@@H]([NH2+]CCc1cccc(F)c1)c1ccc(F)cc1O ZINC000062745903 1127772651 /nfs/dbraw/zinc/77/26/51/1127772651.db2.gz OOFGSEOSSDYEMG-LLVKDONJSA-N 1 1 277.314 3.564 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1O ZINC000062744901 1127772672 /nfs/dbraw/zinc/77/26/72/1127772672.db2.gz ZIJYTCJUHNBLMX-SNVBAGLBSA-N 1 1 263.287 3.521 20 10 CHCDMO C[C@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1O ZINC000062744900 1127772489 /nfs/dbraw/zinc/77/24/89/1127772489.db2.gz ZIJYTCJUHNBLMX-JTQLQIEISA-N 1 1 263.287 3.521 20 10 CHCDMO C[C@@H]([NH2+]CCCOC1CCCCC1)c1ccc(F)cc1O ZINC000062745329 1127773079 /nfs/dbraw/zinc/77/30/79/1127773079.db2.gz WXQLZOTTXIXDNR-CYBMUJFWSA-N 1 1 295.398 3.921 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccc(F)cc1O ZINC000062748440 1127774135 /nfs/dbraw/zinc/77/41/35/1127774135.db2.gz DVPLQYDGDYCSFP-WBMJQRKESA-N 1 1 285.362 3.739 20 10 CHCDMO CCC[C@H]1CCCC[N@@H+]1Cc1c(O)ccc(F)c1F ZINC001233334875 1127953588 /nfs/dbraw/zinc/95/35/88/1127953588.db2.gz XKMDKISJGPHUFX-NSHDSACASA-N 1 1 269.335 3.825 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1c(O)ccc(F)c1F ZINC001233334875 1127953591 /nfs/dbraw/zinc/95/35/91/1127953591.db2.gz XKMDKISJGPHUFX-NSHDSACASA-N 1 1 269.335 3.825 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ncccn1 ZINC000930350969 1128072994 /nfs/dbraw/zinc/07/29/94/1128072994.db2.gz LDLKPRAKWGZLFD-AWEZNQCLSA-N 1 1 285.391 3.546 20 10 CHCDMO C[C@H]([N@@H+](C)Cc1c(O)ccc2ccncc21)C(C)(C)C ZINC000914569540 1128211746 /nfs/dbraw/zinc/21/17/46/1128211746.db2.gz XMNNAIPQNKABCT-LBPRGKRZSA-N 1 1 272.392 3.807 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1c(O)cccc1F ZINC000927100880 1128217215 /nfs/dbraw/zinc/21/72/15/1128217215.db2.gz VEYCDXOPPPEORI-NEPJUHHUSA-N 1 1 295.398 3.776 20 10 CHCDMO CCCC[N@@H+](Cc1c(O)ccc2ccncc21)C1CC1 ZINC000914783770 1128242785 /nfs/dbraw/zinc/24/27/85/1128242785.db2.gz FIQSZQOCSFQMDL-UHFFFAOYSA-N 1 1 270.376 3.705 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000915790581 1128338575 /nfs/dbraw/zinc/33/85/75/1128338575.db2.gz WCLQOXGISXLBSS-LBPRGKRZSA-N 1 1 277.408 3.627 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000915794086 1128338976 /nfs/dbraw/zinc/33/89/76/1128338976.db2.gz DPQQYWSKPSIOPD-UHFFFAOYSA-N 1 1 281.399 3.903 20 10 CHCDMO COc1ccc(N2CCC[N@@H+](CCC(C)(C)C)CC2)cc1 ZINC000732982655 1128389829 /nfs/dbraw/zinc/38/98/29/1128389829.db2.gz RMSKOQVPPOUWCJ-UHFFFAOYSA-N 1 1 290.451 3.644 20 10 CHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000763330892 1128391850 /nfs/dbraw/zinc/39/18/50/1128391850.db2.gz FXKWBAGAOUREDF-CYBMUJFWSA-N 1 1 289.419 3.627 20 10 CHCDMO CCCCC[N@@H+](CCCOC)Cc1cccc(C)c1O ZINC000780793513 1128450810 /nfs/dbraw/zinc/45/08/10/1128450810.db2.gz PIMTVLFTVKXNFY-UHFFFAOYSA-N 1 1 279.424 3.729 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000778984582 1128673597 /nfs/dbraw/zinc/67/35/97/1128673597.db2.gz GLPZGPACFUWWIW-UHFFFAOYSA-N 1 1 273.351 3.942 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC000920258687 1128675123 /nfs/dbraw/zinc/67/51/23/1128675123.db2.gz VRMCTBUSPGCPMP-LJQANCHMSA-N 1 1 280.415 3.872 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000778997010 1128675284 /nfs/dbraw/zinc/67/52/84/1128675284.db2.gz YVJVYYVRIIHLDP-UHFFFAOYSA-N 1 1 263.356 3.828 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000779017797 1128680303 /nfs/dbraw/zinc/68/03/03/1128680303.db2.gz XRPZIUQFVIMCCS-GFCCVEGCSA-N 1 1 289.325 3.660 20 10 CHCDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1cc(F)ccc1O ZINC000779020260 1128683230 /nfs/dbraw/zinc/68/32/30/1128683230.db2.gz LBGSTMVPFPJIGN-UKRRQHHQSA-N 1 1 285.362 3.909 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000779019095 1128683527 /nfs/dbraw/zinc/68/35/27/1128683527.db2.gz DSLXUECPAYBSNP-NEPJUHHUSA-N 1 1 251.345 3.542 20 10 CHCDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccccc2O)C1 ZINC000779022976 1128686964 /nfs/dbraw/zinc/68/69/64/1128686964.db2.gz MZWXBEISTRFVAZ-GOSISDBHSA-N 1 1 267.372 3.556 20 10 CHCDMO C[C@H]([NH2+]CCCNc1ccccc1)c1ccc(F)cc1O ZINC000185489392 1117827824 /nfs/dbraw/zinc/82/78/24/1117827824.db2.gz GDAAGMDVZCCAAP-ZDUSSCGKSA-N 1 1 288.366 3.684 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2C2CCC2)cc1C ZINC000728199985 1117869465 /nfs/dbraw/zinc/86/94/65/1117869465.db2.gz OUZUVQLZWMWYBG-INIZCTEOSA-N 1 1 259.393 3.774 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001140058914 1118079594 /nfs/dbraw/zinc/07/95/94/1118079594.db2.gz OJOQMEGIECEIGO-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001140058914 1118079598 /nfs/dbraw/zinc/07/95/98/1118079598.db2.gz OJOQMEGIECEIGO-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC=CCC1 ZINC000779159668 1128760255 /nfs/dbraw/zinc/76/02/55/1128760255.db2.gz PSWVUDMWEFBHMX-UHFFFAOYSA-N 1 1 265.356 3.821 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC001140181946 1118246368 /nfs/dbraw/zinc/24/63/68/1118246368.db2.gz XXUSRHARAXGKIM-HUUCEWRRSA-N 1 1 259.393 3.631 20 10 CHCDMO COc1cccc2c1CC[N@@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140184644 1118255136 /nfs/dbraw/zinc/25/51/36/1118255136.db2.gz CNNMQFGLWOTRCX-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO Oc1ccccc1C[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000179940184 1128767024 /nfs/dbraw/zinc/76/70/24/1128767024.db2.gz ZNPCRBDSUSMKLG-UHFFFAOYSA-N 1 1 296.345 3.571 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000179940184 1128767029 /nfs/dbraw/zinc/76/70/29/1128767029.db2.gz ZNPCRBDSUSMKLG-UHFFFAOYSA-N 1 1 296.345 3.571 20 10 CHCDMO COc1cc(F)cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000186216543 1118361086 /nfs/dbraw/zinc/36/10/86/1118361086.db2.gz JROFTVNXWDTLCJ-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000180330608 1128788103 /nfs/dbraw/zinc/78/81/03/1128788103.db2.gz QOTAWQBBRRIBGD-AWEZNQCLSA-N 1 1 293.407 3.564 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707145859 1118648309 /nfs/dbraw/zinc/64/83/09/1118648309.db2.gz JJWUYTCHYYMASP-PHIMTYICSA-N 1 1 298.224 3.633 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001140466224 1118751687 /nfs/dbraw/zinc/75/16/87/1118751687.db2.gz BUAZNMGEZAUUKW-OAHLLOKOSA-N 1 1 288.778 3.778 20 10 CHCDMO C[N@@H+](Cc1cc2cc(F)ccc2o1)Cc1ccccc1O ZINC000091956500 1118837583 /nfs/dbraw/zinc/83/75/83/1118837583.db2.gz BCXSOIJGFCVLKB-UHFFFAOYSA-N 1 1 285.318 3.910 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176673560 1119091917 /nfs/dbraw/zinc/09/19/17/1119091917.db2.gz KKDDLCSGDOSSES-CQSZACIVSA-N 1 1 255.361 3.975 20 10 CHCDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccccc2O)s1 ZINC000091956519 1119734735 /nfs/dbraw/zinc/73/47/35/1119734735.db2.gz GBUDGBXGDQGVTI-UHFFFAOYSA-N 1 1 276.405 3.604 20 10 CHCDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000179557069 1119751687 /nfs/dbraw/zinc/75/16/87/1119751687.db2.gz BUSWAMKOELKSDA-CQSZACIVSA-N 1 1 255.361 3.894 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+](Cc2ccccc2)C2CC2)c1O ZINC001140747545 1119794242 /nfs/dbraw/zinc/79/42/42/1119794242.db2.gz FHMCAPSWWKEDSP-UHFFFAOYSA-N 1 1 283.371 3.571 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000755922158 1119921230 /nfs/dbraw/zinc/92/12/30/1119921230.db2.gz DXJYYSALNAXWBZ-LBPRGKRZSA-N 1 1 277.408 3.627 20 10 CHCDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(N2CCCCC2)cc1 ZINC000180173552 1119939483 /nfs/dbraw/zinc/93/94/83/1119939483.db2.gz AEYCFMOHMCNWMB-UHFFFAOYSA-N 1 1 283.419 3.637 20 10 CHCDMO COCCCCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000728688790 1120141129 /nfs/dbraw/zinc/14/11/29/1120141129.db2.gz WRNCICCBHLPAJK-UHFFFAOYSA-N 1 1 292.467 3.780 20 10 CHCDMO CCCN1CCC([NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000756363091 1120253853 /nfs/dbraw/zinc/25/38/53/1120253853.db2.gz OYKSKEYLYQSORT-OAHLLOKOSA-N 1 1 290.451 3.534 20 10 CHCDMO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)CC1CC1 ZINC000069797434 1128908119 /nfs/dbraw/zinc/90/81/19/1128908119.db2.gz ZIZFXQLBFOUUTP-UHFFFAOYSA-N 1 1 285.387 3.786 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)c(O)c1 ZINC000185472012 1120378492 /nfs/dbraw/zinc/37/84/92/1120378492.db2.gz SVJLIERDAQNINP-RHSMWYFYSA-N 1 1 292.467 3.718 20 10 CHCDMO CCCC[N@@H+](CCc1ccccn1)Cc1ccccc1O ZINC000282469144 1120697541 /nfs/dbraw/zinc/69/75/41/1120697541.db2.gz NPVKFJFFDMQLII-UHFFFAOYSA-N 1 1 284.403 3.632 20 10 CHCDMO Cc1cc(C[NH2+][C@H](C)c2ncc[nH]2)c(C)n1-c1ccccc1 ZINC000317427161 1121010483 /nfs/dbraw/zinc/01/04/83/1121010483.db2.gz JVLHYMFDAGPCAB-CQSZACIVSA-N 1 1 294.402 3.668 20 10 CHCDMO CO[C@H](C)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000182382081 1128964086 /nfs/dbraw/zinc/96/40/86/1128964086.db2.gz DLCOCQXCHGSMHW-CVEARBPZSA-N 1 1 299.414 3.990 20 10 CHCDMO C[C@@H]([NH2+]CC1CC(C)(C)C1)c1ccc(F)cc1O ZINC000701942924 1121174099 /nfs/dbraw/zinc/17/40/99/1121174099.db2.gz DAVHJKNGVXGVEV-SNVBAGLBSA-N 1 1 251.345 3.618 20 10 CHCDMO CCC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CC1 ZINC000728903282 1121175336 /nfs/dbraw/zinc/17/53/36/1121175336.db2.gz XCVLVMRRFOFMHC-UHFFFAOYSA-N 1 1 277.408 3.770 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120790 1128980560 /nfs/dbraw/zinc/98/05/60/1128980560.db2.gz SCJKSMPALLGNKS-JTQLQIEISA-N 1 1 289.297 3.523 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1[O-])[C@H](C)C(C)C ZINC000706462930 1121429651 /nfs/dbraw/zinc/42/96/51/1121429651.db2.gz ZRFMYNKJUYBLDT-LLVKDONJSA-N 1 1 281.371 3.600 20 10 CHCDMO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H](C)C(C)C ZINC000706462930 1121429655 /nfs/dbraw/zinc/42/96/55/1121429655.db2.gz ZRFMYNKJUYBLDT-LLVKDONJSA-N 1 1 281.371 3.600 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H](C)C(C)C ZINC000706462930 1121429656 /nfs/dbraw/zinc/42/96/56/1121429656.db2.gz ZRFMYNKJUYBLDT-LLVKDONJSA-N 1 1 281.371 3.600 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)Cc1ccc(C)nc1C ZINC000187100342 1121530557 /nfs/dbraw/zinc/53/05/57/1121530557.db2.gz AHBMKPPRGBPYGS-UHFFFAOYSA-N 1 1 284.403 3.816 20 10 CHCDMO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)cc2O)C12CCC2 ZINC000248489486 1121571191 /nfs/dbraw/zinc/57/11/91/1121571191.db2.gz HKDASKGAXQDXBM-XFBWCDHKSA-N 1 1 293.382 3.530 20 10 CHCDMO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccc(F)cc1O ZINC000688501497 1129003923 /nfs/dbraw/zinc/00/39/23/1129003923.db2.gz JPLTWYZSCKYWPT-VIFPVBQESA-N 1 1 273.298 3.760 20 10 CHCDMO CCC[N@@H+](Cc1cccc(F)c1)Cc1ccccc1O ZINC000727831126 1121750940 /nfs/dbraw/zinc/75/09/40/1121750940.db2.gz JGTZWGOERSAZRU-UHFFFAOYSA-N 1 1 273.351 3.944 20 10 CHCDMO CO[C@H]1CCC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000728049601 1121760095 /nfs/dbraw/zinc/76/00/95/1121760095.db2.gz HXVWGDUZJRXARF-HNNXBMFYSA-N 1 1 291.435 3.609 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2C=CCCC2)c1 ZINC001178059783 1121763734 /nfs/dbraw/zinc/76/37/34/1121763734.db2.gz KHLJJNGTMBYCDB-GFCCVEGCSA-N 1 1 296.208 3.661 20 10 CHCDMO CCC[N@H+](Cc1cc(C)c(C)cc1O)C[C@@H]1CCCCO1 ZINC000730255736 1121800577 /nfs/dbraw/zinc/80/05/77/1121800577.db2.gz JKJFTMPVLYSPRR-KRWDZBQOSA-N 1 1 291.435 3.790 20 10 CHCDMO C[C@@]1([NH2+]Cc2c(O)ccc(Cl)c2F)CC=CCC1 ZINC001178930496 1121826693 /nfs/dbraw/zinc/82/66/93/1121826693.db2.gz DBDHVOLZNLRMSU-CQSZACIVSA-N 1 1 269.747 3.773 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)c2cccnc2)cc1 ZINC000773808357 1121862913 /nfs/dbraw/zinc/86/29/13/1121862913.db2.gz KVACVQOXAOSNHO-OAHLLOKOSA-N 1 1 283.419 3.731 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](C)[C@@H]1C ZINC001179858351 1121917310 /nfs/dbraw/zinc/91/73/10/1121917310.db2.gz DBJLRRYTVWTFNH-HIFRSBDPSA-N 1 1 260.425 3.681 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)C[C@H]2C)c(Cl)c1 ZINC001179898774 1121919457 /nfs/dbraw/zinc/91/94/57/1121919457.db2.gz UIQUZOGPDXCUSL-GHMZBOCLSA-N 1 1 253.773 3.584 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001179863577 1121921325 /nfs/dbraw/zinc/92/13/25/1121921325.db2.gz PMPSOVFHVQGDGL-GMNBZTITSA-N 1 1 258.409 3.640 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1C)[C@H](C)C(C)C ZINC001180042769 1121941332 /nfs/dbraw/zinc/94/13/32/1121941332.db2.gz JDACAKCUGZWQJN-OAHLLOKOSA-N 1 1 262.441 3.927 20 10 CHCDMO CCOC[C@H]1CCC[N@@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001180235071 1121967662 /nfs/dbraw/zinc/96/76/62/1121967662.db2.gz VALCMSUQWNKIJK-HNNXBMFYSA-N 1 1 291.435 3.764 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@@H]12 ZINC001180271336 1121972059 /nfs/dbraw/zinc/97/20/59/1121972059.db2.gz ISFPEDDZHKSMQO-UHOFOFEASA-N 1 1 277.383 3.932 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cccc(F)c1O)c1ccc(F)cc1 ZINC001180301153 1121972475 /nfs/dbraw/zinc/97/24/75/1121972475.db2.gz JPALDJJSIJIEIE-OAHLLOKOSA-N 1 1 277.314 3.911 20 10 CHCDMO C[C@H]([NH2+]CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000192645959 1129022360 /nfs/dbraw/zinc/02/23/60/1129022360.db2.gz OXMWJIGZVIYFMF-ZETCQYMHSA-N 1 1 260.164 3.760 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2C)cc1Cl ZINC001180438277 1121987702 /nfs/dbraw/zinc/98/77/02/1121987702.db2.gz XGUHBEVUSHAGPB-LLVKDONJSA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(O)cc2O)cc1 ZINC001204275663 1122000142 /nfs/dbraw/zinc/00/01/42/1122000142.db2.gz XWBQHJLPQFFNKY-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO CCCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975112 1129024548 /nfs/dbraw/zinc/02/45/48/1129024548.db2.gz UQLHMTMMDZESOA-UHFFFAOYSA-N 1 1 259.349 3.788 20 10 CHCDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204278721 1122010831 /nfs/dbraw/zinc/01/08/31/1122010831.db2.gz JBQSHTKHCLOVSN-NSHDSACASA-N 1 1 291.778 3.944 20 10 CHCDMO C[C@@H]1CC[C@H](C[NH2+]Cc2ccc(Cl)cc2O)C1 ZINC001181399747 1122054023 /nfs/dbraw/zinc/05/40/23/1122054023.db2.gz MBYXIZQUTFBDSU-MNOVXSKESA-N 1 1 253.773 3.571 20 10 CHCDMO C[C@H]1CC[C@H](C[NH2+]Cc2ccc(Cl)cc2O)C1 ZINC001181399748 1122054294 /nfs/dbraw/zinc/05/42/94/1122054294.db2.gz MBYXIZQUTFBDSU-QWRGUYRKSA-N 1 1 253.773 3.571 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC000779604352 1129032175 /nfs/dbraw/zinc/03/21/75/1129032175.db2.gz JTSQGFWSNQUBND-AWEZNQCLSA-N 1 1 289.419 3.803 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC001182184596 1122117427 /nfs/dbraw/zinc/11/74/27/1122117427.db2.gz PFSIFHRUXGIXHC-KRWDZBQOSA-N 1 1 272.436 3.681 20 10 CHCDMO c1cc2c(s1)C[N@@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204326276 1122121309 /nfs/dbraw/zinc/12/13/09/1122121309.db2.gz DSLXHONZGMWZNF-UHFFFAOYSA-N 1 1 298.455 3.907 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1O ZINC000774284336 1122153698 /nfs/dbraw/zinc/15/36/98/1122153698.db2.gz FDUOHGNAMGTGBI-SFYZADRCSA-N 1 1 292.206 3.509 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c1 ZINC001182450841 1122160315 /nfs/dbraw/zinc/16/03/15/1122160315.db2.gz AFRZTEZZALITFH-MJBXVCDLSA-N 1 1 261.409 3.992 20 10 CHCDMO CC[N@@H+](CCSC)Cc1c(O)cc(C)cc1Cl ZINC001182742656 1122186731 /nfs/dbraw/zinc/18/67/31/1122186731.db2.gz GBNCJXCMAZDDGO-UHFFFAOYSA-N 1 1 273.829 3.539 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC001182872882 1122192348 /nfs/dbraw/zinc/19/23/48/1122192348.db2.gz HDXIJBIUUJLREI-SFHVURJKSA-N 1 1 289.419 3.518 20 10 CHCDMO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1O ZINC001182874934 1122192899 /nfs/dbraw/zinc/19/28/99/1122192899.db2.gz VOWAEUKUELEYNE-SNVBAGLBSA-N 1 1 255.789 3.960 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)c(C(F)(F)F)c1 ZINC001183012386 1122199719 /nfs/dbraw/zinc/19/97/19/1122199719.db2.gz RQGIJGXGOQITGY-DGCLKSJQSA-N 1 1 298.352 3.613 20 10 CHCDMO C/C=C/C[C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC001183168710 1122211399 /nfs/dbraw/zinc/21/13/99/1122211399.db2.gz AHFYLVADGLGLBD-YWVDXFKGSA-N 1 1 263.356 3.710 20 10 CHCDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC001183168710 1122211403 /nfs/dbraw/zinc/21/14/03/1122211403.db2.gz AHFYLVADGLGLBD-YWVDXFKGSA-N 1 1 263.356 3.710 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC001183842782 1122241222 /nfs/dbraw/zinc/24/12/22/1122241222.db2.gz FRZYZZGITIIAQR-MISXGVKJSA-N 1 1 265.784 3.571 20 10 CHCDMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccc(F)cc1O ZINC000796856720 1122301855 /nfs/dbraw/zinc/30/18/55/1122301855.db2.gz SUVLUDOMSLDBMI-CYBMUJFWSA-N 1 1 260.312 3.798 20 10 CHCDMO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2O)C[C@@H]1C ZINC001205320637 1122307589 /nfs/dbraw/zinc/30/75/89/1122307589.db2.gz LPXRYPJTQWSZQQ-UHIISALHSA-N 1 1 267.800 3.960 20 10 CHCDMO C[C@@]1(F)CCCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203650877 1122415234 /nfs/dbraw/zinc/41/52/34/1122415234.db2.gz FMJDSDNEUMFEPV-CQSZACIVSA-N 1 1 271.763 3.760 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2cc(C)ccc2F)c1 ZINC000775167526 1122465489 /nfs/dbraw/zinc/46/54/89/1122465489.db2.gz JRMLPVFSXBBZSF-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)C2)c1O ZINC000775638221 1122849068 /nfs/dbraw/zinc/84/90/68/1122849068.db2.gz CITFMYRCOGAKES-SNVBAGLBSA-N 1 1 253.773 3.586 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1cccc(Cl)c1[O-] ZINC000775641478 1122850175 /nfs/dbraw/zinc/85/01/75/1122850175.db2.gz AIXXFCQMXWTJMF-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C(C)C)C2CC2)c1O ZINC000775653975 1122865897 /nfs/dbraw/zinc/86/58/97/1122865897.db2.gz PSEYSRYGROAPDF-UHFFFAOYSA-N 1 1 253.773 3.727 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775661789 1122875229 /nfs/dbraw/zinc/87/52/29/1122875229.db2.gz AUNQVWGENYGSDA-ZDUSSCGKSA-N 1 1 253.773 3.728 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775661788 1122876116 /nfs/dbraw/zinc/87/61/16/1122876116.db2.gz AUNQVWGENYGSDA-CYBMUJFWSA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000775724125 1122924521 /nfs/dbraw/zinc/92/45/21/1122924521.db2.gz CVNABQDTEHBYTF-LJQANCHMSA-N 1 1 281.399 3.864 20 10 CHCDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000775732061 1122928732 /nfs/dbraw/zinc/92/87/32/1122928732.db2.gz LORGETNJVBQSEM-XJKSGUPXSA-N 1 1 277.408 3.801 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1O ZINC000775737450 1122928840 /nfs/dbraw/zinc/92/88/40/1122928840.db2.gz HGFXAOBDWUZTNV-OAHLLOKOSA-N 1 1 297.826 3.601 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@]32C)cc1 ZINC001196667341 1122929979 /nfs/dbraw/zinc/92/99/79/1122929979.db2.gz QYERHAUJBFMVJK-WMZOPIPTSA-N 1 1 272.436 3.907 20 10 CHCDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001203936770 1123033145 /nfs/dbraw/zinc/03/31/45/1123033145.db2.gz NDECIFWMWLDQFQ-CZIWCDLHSA-N 1 1 260.425 3.763 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776013184 1123035252 /nfs/dbraw/zinc/03/52/52/1123035252.db2.gz LFDDVBTVWZOCBI-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO CC[C@H](C)C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201511565 1123114005 /nfs/dbraw/zinc/11/40/05/1123114005.db2.gz OGEOOUSICNDMCB-HNNXBMFYSA-N 1 1 260.425 3.765 20 10 CHCDMO Cc1cc(C[N@H+]2CCCO[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854064 1123214098 /nfs/dbraw/zinc/21/40/98/1123214098.db2.gz HBRHKEAAIHVXIK-INIZCTEOSA-N 1 1 298.430 3.705 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cc(F)cc(F)c1O ZINC000850553614 1123289866 /nfs/dbraw/zinc/28/98/66/1123289866.db2.gz ZMNDCSVJXLXHIP-WRWORJQWSA-N 1 1 291.288 3.612 20 10 CHCDMO CC(C)CC1([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000850566332 1123293292 /nfs/dbraw/zinc/29/32/92/1123293292.db2.gz LRFQIJXBNXYPIB-LLVKDONJSA-N 1 1 251.345 3.761 20 10 CHCDMO COc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1C ZINC000850579733 1123296288 /nfs/dbraw/zinc/29/62/88/1123296288.db2.gz ZABZSBCBDJSPSC-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO C[N@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccccc1O ZINC000109771833 1123326665 /nfs/dbraw/zinc/32/66/65/1123326665.db2.gz CXSVBUFAWRDOPZ-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO C[N@@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccccc1O ZINC000109771833 1123326669 /nfs/dbraw/zinc/32/66/69/1123326669.db2.gz CXSVBUFAWRDOPZ-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)C1CC1 ZINC000852554926 1123409166 /nfs/dbraw/zinc/40/91/66/1123409166.db2.gz GBWSYDFYCTVXCS-CQSZACIVSA-N 1 1 281.783 3.526 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848599 1123521528 /nfs/dbraw/zinc/52/15/28/1123521528.db2.gz SEKLUKUBRXQVRZ-YJBOKZPZSA-N 1 1 297.398 3.546 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(Cl)cc1O ZINC000857080854 1123585152 /nfs/dbraw/zinc/58/51/52/1123585152.db2.gz LGMTTZBQSXJGIQ-DTWKUNHWSA-N 1 1 275.726 3.742 20 10 CHCDMO C/C=C\C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000858538327 1123659559 /nfs/dbraw/zinc/65/95/59/1123659559.db2.gz UEBUAMSFGSUXCP-VEMNSZJBSA-N 1 1 288.160 3.521 20 10 CHCDMO C/C=C/C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000858536946 1123660956 /nfs/dbraw/zinc/66/09/56/1123660956.db2.gz LGSJCHDQVJEBDS-CDAZIORVSA-N 1 1 259.271 3.638 20 10 CHCDMO C[C@H]([NH2+]Cc1cocn1)c1ccc(N2CCCCC2)cc1 ZINC000777038260 1123662423 /nfs/dbraw/zinc/66/24/23/1123662423.db2.gz YGHMRETXHXPUHY-AWEZNQCLSA-N 1 1 285.391 3.516 20 10 CHCDMO CC[N@@H+](Cc1cnc(C2CC2)o1)Cc1ccc(N(C)C)cc1 ZINC000862211009 1123792065 /nfs/dbraw/zinc/79/20/65/1123792065.db2.gz AABYZFCTJMIFGM-UHFFFAOYSA-N 1 1 299.418 3.640 20 10 CHCDMO CCc1cccc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1O ZINC000862541226 1123817961 /nfs/dbraw/zinc/81/79/61/1123817961.db2.gz QZCHBXLLHUKVQF-MRXNPFEDSA-N 1 1 297.398 3.650 20 10 CHCDMO CCSCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000119483104 1123872229 /nfs/dbraw/zinc/87/22/29/1123872229.db2.gz TUMPWYSKGPYFKX-UHFFFAOYSA-N 1 1 291.416 3.741 20 10 CHCDMO COc1cc(C[N@@H+](CC2CC2)CC2CCC2)c(O)cc1C ZINC000794710158 1123940017 /nfs/dbraw/zinc/94/00/17/1123940017.db2.gz JIOXZNDQRNSWFW-UHFFFAOYSA-N 1 1 289.419 3.721 20 10 CHCDMO CC[C@H]([NH2+]CCCN1CCCCC1)c1ccc(C)cc1O ZINC000794794185 1123951848 /nfs/dbraw/zinc/95/18/48/1123951848.db2.gz QFXOCGMKZGNBQG-KRWDZBQOSA-N 1 1 290.451 3.617 20 10 CHCDMO Cc1cc(C)c(CSc2nccs2)c(C)[nH+]1 ZINC000865352344 1123973017 /nfs/dbraw/zinc/97/30/17/1123973017.db2.gz HWQSAOLGVXDCMZ-UHFFFAOYSA-N 1 1 250.392 3.756 20 10 CHCDMO CC[C@H]([NH2+]CC[C@H]1CCSC1)c1ccc(F)cc1O ZINC000866405182 1124063543 /nfs/dbraw/zinc/06/35/43/1124063543.db2.gz YODSXFDJFHWYIH-FZMZJTMJSA-N 1 1 283.412 3.715 20 10 CHCDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(N)cc2)C1 ZINC001120370606 1131274359 /nfs/dbraw/zinc/27/43/59/1131274359.db2.gz BXTNPSPYLJKGRN-INIZCTEOSA-N 1 1 266.388 3.567 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1)c1ccc(F)cc1O ZINC000872108386 1124684777 /nfs/dbraw/zinc/68/47/77/1124684777.db2.gz SPRWTHYPTUZOPN-RKHKHNFPSA-N 1 1 293.382 3.530 20 10 CHCDMO CCCOc1ccc(C[NH2+]Cc2csc(C)n2)cc1C ZINC000873016593 1124733759 /nfs/dbraw/zinc/73/37/59/1124733759.db2.gz MHRMJNLBBHFCPE-UHFFFAOYSA-N 1 1 290.432 3.839 20 10 CHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)c1[O-] ZINC000873238692 1124754183 /nfs/dbraw/zinc/75/41/83/1124754183.db2.gz FEAFNIMWGCLFON-OBJOEFQTSA-N 1 1 296.842 3.522 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc2ccccc2c1[O-] ZINC000873240194 1124754568 /nfs/dbraw/zinc/75/45/68/1124754568.db2.gz LIZCUYONHJAFNR-IIAWOOMASA-N 1 1 298.430 3.714 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc2ccccc2c1[O-] ZINC000873271230 1124760000 /nfs/dbraw/zinc/76/00/00/1124760000.db2.gz FXOCVWWSDDCGIQ-KBPBESRZSA-N 1 1 298.430 3.584 20 10 CHCDMO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(C)cc1O ZINC000877494887 1125034803 /nfs/dbraw/zinc/03/48/03/1125034803.db2.gz VOIWQJHQFOVYNK-MRXNPFEDSA-N 1 1 299.418 3.644 20 10 CHCDMO CC1(C)CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211441163 1125306793 /nfs/dbraw/zinc/30/67/93/1125306793.db2.gz MHOYQFVVHJNHIX-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO Cc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)c(C)c1 ZINC000882902336 1125361178 /nfs/dbraw/zinc/36/11/78/1125361178.db2.gz DPYNZCUTXMVMRY-UHFFFAOYSA-N 1 1 277.314 3.577 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000882988457 1125365881 /nfs/dbraw/zinc/36/58/81/1125365881.db2.gz QPNHMVDLCVQHLI-HNNXBMFYSA-N 1 1 293.288 3.587 20 10 CHCDMO CC1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC(F)(F)C1 ZINC000883250192 1125384616 /nfs/dbraw/zinc/38/46/16/1125384616.db2.gz GVJRHDXXRGIALC-UHFFFAOYSA-N 1 1 293.716 3.710 20 10 CHCDMO CCCCC[N@@H+](Cc1cccc(OC)c1O)C(C)C ZINC000133255303 1125440094 /nfs/dbraw/zinc/44/00/94/1125440094.db2.gz OQZHRLFLACXRLD-UHFFFAOYSA-N 1 1 265.397 3.801 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@H](C)CC2)ccc1N(C)C ZINC001139669736 1131356011 /nfs/dbraw/zinc/35/60/11/1131356011.db2.gz KECHHBWXBQMRPL-AWEZNQCLSA-N 1 1 260.425 3.683 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)[C@@H](c2ccco2)C1 ZINC000245611764 1129213693 /nfs/dbraw/zinc/21/36/93/1129213693.db2.gz OCOGKZNCGYAXLV-UKRRQHHQSA-N 1 1 271.360 3.958 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1 ZINC000245839687 1129227636 /nfs/dbraw/zinc/22/76/36/1129227636.db2.gz JLWOCYYTUWMFIG-SCLBCKFNSA-N 1 1 283.371 3.594 20 10 CHCDMO COc1ccccc1/C=C/C[N@@H+](C)Cc1ccccc1O ZINC000091956823 1129375660 /nfs/dbraw/zinc/37/56/60/1129375660.db2.gz ORGBDMBQRRGJNB-JXMROGBWSA-N 1 1 283.371 3.546 20 10 CHCDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056767 1129389427 /nfs/dbraw/zinc/38/94/27/1129389427.db2.gz QCDCZOYKQCPWRK-JSGCOSHPSA-N 1 1 291.391 3.522 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000093149539 1129417770 /nfs/dbraw/zinc/41/77/70/1129417770.db2.gz BWPMWNCJOVFREK-ZDUSSCGKSA-N 1 1 283.371 3.520 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3ccccc3[C@H]2C)c1O ZINC000093149536 1129417998 /nfs/dbraw/zinc/41/79/98/1129417998.db2.gz BWPMWNCJOVFREK-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000248497574 1129420591 /nfs/dbraw/zinc/42/05/91/1129420591.db2.gz LXMQAZPRFXKISJ-JDFRZJQESA-N 1 1 285.362 3.986 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)C[C@@H]3C)c2c1 ZINC000740860580 1129421053 /nfs/dbraw/zinc/42/10/53/1129421053.db2.gz QWHCKEBXBPBETR-STQMWFEESA-N 1 1 285.387 3.784 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](CC)Cc2ccccn2)cc1 ZINC000093338944 1129421436 /nfs/dbraw/zinc/42/14/36/1129421436.db2.gz BRFZPKXUEZHBLB-UHFFFAOYSA-N 1 1 297.446 3.950 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCCCF)C1CCCC1 ZINC000795912083 1129457368 /nfs/dbraw/zinc/45/73/68/1129457368.db2.gz NMMWEAOPDBDLLW-UHFFFAOYSA-N 1 1 265.372 3.887 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2cc(Br)ccc2O)CC1 ZINC000796019199 1129462684 /nfs/dbraw/zinc/46/26/84/1129462684.db2.gz ZPFVXNQOPLXROI-UHFFFAOYSA-N 1 1 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CN(C)c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)c1 ZINC001140921896 1131962513 /nfs/dbraw/zinc/96/25/13/1131962513.db2.gz VCOHZFGNAVTAFS-BETUJISGSA-N 1 1 278.827 3.638 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2C)c(O)c1 ZINC001140949868 1131969795 /nfs/dbraw/zinc/96/97/95/1131969795.db2.gz OAZAQMKVKMMXHC-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c(O)c1 ZINC001140950835 1131970188 /nfs/dbraw/zinc/97/01/88/1131970188.db2.gz KJFOFZQMWYTRBM-KRWDZBQOSA-N 1 1 299.439 3.991 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)c(O)c1 ZINC001140950713 1131970472 /nfs/dbraw/zinc/97/04/72/1131970472.db2.gz FEMHWOKQCIHIBK-CABCVRRESA-N 1 1 259.393 3.713 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001140951120 1131971723 /nfs/dbraw/zinc/97/17/23/1131971723.db2.gz ZOSNWXPCVLPRJK-GOEBONIOSA-N 1 1 259.393 3.855 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001140950922 1131972232 /nfs/dbraw/zinc/97/22/32/1131972232.db2.gz PDVVVGONJHUACG-INIZCTEOSA-N 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283.415 3.992 20 10 CHCDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841751241 1132388973 /nfs/dbraw/zinc/38/89/73/1132388973.db2.gz GILNYKLJBVAPJH-SFYZADRCSA-N 1 1 297.811 3.617 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCC[C@@]1(C)O ZINC001231879573 1132389372 /nfs/dbraw/zinc/38/93/72/1132389372.db2.gz IZCXNJXCKWVHOW-AUUYWEPGSA-N 1 1 299.414 3.528 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2O)[C@@](C)(CO)C1 ZINC001231880000 1132390847 /nfs/dbraw/zinc/39/08/47/1132390847.db2.gz ZXIRGXWVVDDZDW-LJQANCHMSA-N 1 1 299.414 3.528 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@@]3(C2)CCCCO3)ccc2ccccc21 ZINC001231879381 1132391162 /nfs/dbraw/zinc/39/11/62/1132391162.db2.gz DECJKGSGNDSMGP-LJQANCHMSA-N 1 1 297.398 3.690 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Cl)cc1O ZINC000841753072 1132392560 /nfs/dbraw/zinc/39/25/60/1132392560.db2.gz DVDMNYDFUWOUHU-PRHODGIISA-N 1 1 275.726 3.884 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841758077 1132393774 /nfs/dbraw/zinc/39/37/74/1132393774.db2.gz RYVCPIDMEFWMAN-MNOVXSKESA-N 1 1 285.840 3.839 20 10 CHCDMO C[C@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(Cl)cc1O ZINC000841756864 1132394886 /nfs/dbraw/zinc/39/48/86/1132394886.db2.gz KXYUJOXAKSEBLU-RYUDHWBXSA-N 1 1 283.799 3.513 20 10 CHCDMO C[C@@H]([NH2+]CC1CCSCC1)c1ccc(Cl)cc1O ZINC000841763659 1132396481 /nfs/dbraw/zinc/39/64/81/1132396481.db2.gz OFSNZLORYXOSOZ-SNVBAGLBSA-N 1 1 285.840 3.839 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C)CC2)cc1Cl ZINC001232263827 1132444868 /nfs/dbraw/zinc/44/48/68/1132444868.db2.gz APVHAWIFCIGABZ-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C)C[C@@H]2C)cc1Cl ZINC001232270216 1132447462 /nfs/dbraw/zinc/44/74/62/1132447462.db2.gz YQXHUUKFGMTATI-QWRGUYRKSA-N 1 1 283.799 3.675 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(Cl)cc1O ZINC000842927582 1132475982 /nfs/dbraw/zinc/47/59/82/1132475982.db2.gz DMIBLMWTQHTUNN-MRBYEJRBSA-N 1 1 265.784 3.885 20 10 CHCDMO CCSC[C@H](C)[N@@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001173316447 1132477640 /nfs/dbraw/zinc/47/76/40/1132477640.db2.gz XDSHLKUDGXMVFA-AWEZNQCLSA-N 1 1 280.481 3.716 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(F)cc1O ZINC000842929463 1132477764 /nfs/dbraw/zinc/47/77/64/1132477764.db2.gz NHMOXNLWFOOUFC-MEDZGJRSSA-N 1 1 263.356 3.761 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CCc3ncccc3C2)c1O ZINC001143110299 1132504042 /nfs/dbraw/zinc/50/40/42/1132504042.db2.gz BXNTTYXRAYRSIW-UHFFFAOYSA-N 1 1 296.414 3.643 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cccc(C(C)(C)C)c1O ZINC001143112600 1132504185 /nfs/dbraw/zinc/50/41/85/1132504185.db2.gz WPKFLKLTECWGJR-UHFFFAOYSA-N 1 1 261.409 3.922 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027903 1132565559 /nfs/dbraw/zinc/56/55/59/1132565559.db2.gz GBWFQWWHSIJNPF-MRVPVSSYSA-N 1 1 290.176 3.524 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233283483 1132595897 /nfs/dbraw/zinc/59/58/97/1132595897.db2.gz ILPZNIVJYQQJSN-ZDUSSCGKSA-N 1 1 261.409 3.922 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233454248 1132625730 /nfs/dbraw/zinc/62/57/30/1132625730.db2.gz NKRPGPJCFGETBX-UHFFFAOYSA-N 1 1 273.298 3.643 20 10 CHCDMO Oc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)cc1O ZINC001233483171 1132627675 /nfs/dbraw/zinc/62/76/75/1132627675.db2.gz PUGDOGHCSNKXLY-OAHLLOKOSA-N 1 1 299.370 3.531 20 10 CHCDMO CCc1ccc(Nc2cc[nH+]c3ccccc23)c(O)c1 ZINC001174039729 1132704355 /nfs/dbraw/zinc/70/43/55/1132704355.db2.gz ASDBYAVHGLSZDA-UHFFFAOYSA-N 1 1 264.328 3.668 20 10 CHCDMO Cc1[nH]c2nc[nH+]c(NCc3c(C)cc(C)cc3O)c2c1C ZINC001160809945 1132982672 /nfs/dbraw/zinc/98/26/72/1132982672.db2.gz FQCWTUBZENWOTM-UHFFFAOYSA-N 1 1 296.374 3.509 20 10 CHCDMO COc1ccc2c(C)cc(NCc3ccc(N)cc3)[nH+]c2c1 ZINC001162785579 1133112516 /nfs/dbraw/zinc/11/25/16/1133112516.db2.gz IHJSYJKYGBAJQW-UHFFFAOYSA-N 1 1 293.370 3.746 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001203547241 1133338371 /nfs/dbraw/zinc/33/83/71/1133338371.db2.gz JRXGAULADLTPMK-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC001203558465 1133340107 /nfs/dbraw/zinc/34/01/07/1133340107.db2.gz IFYLIIQVFJRSOQ-CYBMUJFWSA-N 1 1 271.360 3.594 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@](C)(F)CC2)c1O ZINC001203602398 1133343916 /nfs/dbraw/zinc/34/39/16/1133343916.db2.gz UJCVQZOYBNRHQX-INIZCTEOSA-N 1 1 281.371 3.505 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@H](c3ccccc3)C2)c(O)c1 ZINC001203629121 1133346233 /nfs/dbraw/zinc/34/62/33/1133346233.db2.gz RFKVANYZUFUVKU-INIZCTEOSA-N 1 1 297.398 3.780 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c(C)c2)c(O)c1 ZINC001203634384 1133346529 /nfs/dbraw/zinc/34/65/29/1133346529.db2.gz CFNJCULITTXVBD-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1O ZINC001203878837 1133377940 /nfs/dbraw/zinc/37/79/40/1133377940.db2.gz DHHVMNLSLIXJEC-OAHLLOKOSA-N 1 1 287.334 3.574 20 10 CHCDMO C[N@@H+](Cc1cccs1)Cc1ccc(N2CCCC2)cc1 ZINC001204015212 1133399568 /nfs/dbraw/zinc/39/95/68/1133399568.db2.gz JYNIBSJINSJMLO-UHFFFAOYSA-N 1 1 286.444 3.980 20 10 CHCDMO C[N@@H+](Cc1ccsc1)Cc1ccc(N2CCCC2)cc1 ZINC001204039252 1133402850 /nfs/dbraw/zinc/40/28/50/1133402850.db2.gz ROPZQHNQVHAPOP-UHFFFAOYSA-N 1 1 286.444 3.980 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3ccccc3C2)cc1Cl ZINC001204145007 1133409989 /nfs/dbraw/zinc/40/99/89/1133409989.db2.gz MBQDDUXTQXGMTL-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO CN(C)c1ccc(C[N@H+](C)Cc2ccon2)c2ccccc21 ZINC001204240144 1133424407 /nfs/dbraw/zinc/42/44/07/1133424407.db2.gz IZAMCQKDUSKSOA-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccon2)c2ccccc21 ZINC001204240144 1133424412 /nfs/dbraw/zinc/42/44/12/1133424412.db2.gz IZAMCQKDUSKSOA-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(O)cc2O)c1 ZINC001204272315 1133426580 /nfs/dbraw/zinc/42/65/80/1133426580.db2.gz NGSMNSHBLITYOQ-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO Cc1cccc(C[N@@H+](Cc2ccc(O)cc2O)C2CC2)c1C ZINC001204277718 1133427349 /nfs/dbraw/zinc/42/73/49/1133427349.db2.gz IXGIQNQMGDHOQV-UHFFFAOYSA-N 1 1 297.398 3.879 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325820 1133438831 /nfs/dbraw/zinc/43/88/31/1133438831.db2.gz VPIBSJRKYYAHDU-QGZVFWFLSA-N 1 1 276.399 3.611 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001204439070 1133447486 /nfs/dbraw/zinc/44/74/86/1133447486.db2.gz NRHQLXPZLYRAEJ-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001204439070 1133447487 /nfs/dbraw/zinc/44/74/87/1133447487.db2.gz NRHQLXPZLYRAEJ-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CC[N@@H+](Cc1ccc(N)cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC001204869676 1133493915 /nfs/dbraw/zinc/49/39/15/1133493915.db2.gz GGBQNIOUCVJYQE-HNNXBMFYSA-N 1 1 298.430 3.731 20 10 CHCDMO CC[N@@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1O ZINC001205298207 1133556485 /nfs/dbraw/zinc/55/64/85/1133556485.db2.gz XIUARAISXKKINQ-UHFFFAOYSA-N 1 1 280.371 3.896 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)Cc2cccnc2)c1 ZINC001205334806 1133564002 /nfs/dbraw/zinc/56/40/02/1133564002.db2.gz MOCSIYSKDKLBCB-UHFFFAOYSA-N 1 1 270.376 3.543 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]1C ZINC001205471621 1133580176 /nfs/dbraw/zinc/58/01/76/1133580176.db2.gz OTMBQXDEVIWDIE-NWDGAFQWSA-N 1 1 282.378 3.651 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(Br)cc2O)[C@H]1C ZINC001205470635 1133580651 /nfs/dbraw/zinc/58/06/51/1133580651.db2.gz BEHYKYJAGMWUDP-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H](CCC1CC1)[NH2+]Cc1ccc(Cl)cc1O ZINC001205498647 1133582691 /nfs/dbraw/zinc/58/26/91/1133582691.db2.gz JZRZMPJFODRYBI-JTQLQIEISA-N 1 1 253.773 3.714 20 10 CHCDMO CCc1cccc(C[N@@H+](CCOC)[C@@H]2CC[C@@H](C)C2)c1O ZINC001205608818 1133593972 /nfs/dbraw/zinc/59/39/72/1133593972.db2.gz KQNCMWZGKHTIMR-RHSMWYFYSA-N 1 1 291.435 3.592 20 10 CHCDMO CCc1cccc(C[N@@H+](CCOC)[C@H]2CC[C@H](C)C2)c1O ZINC001205608820 1133594425 /nfs/dbraw/zinc/59/44/25/1133594425.db2.gz KQNCMWZGKHTIMR-YOEHRIQHSA-N 1 1 291.435 3.592 20 10 CHCDMO CC(C)(C)C1CC([NH2+]Cc2cc(F)c(F)cc2O)C1 ZINC001206016778 1133642249 /nfs/dbraw/zinc/64/22/49/1133642249.db2.gz RBTLXEZWSITRDG-UHFFFAOYSA-N 1 1 269.335 3.585 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCCC2(CC2)CC1 ZINC001206999795 1133758284 /nfs/dbraw/zinc/75/82/84/1133758284.db2.gz OLQMPGZRKVNDRV-UHFFFAOYSA-N 1 1 265.784 3.812 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001207129733 1133770420 /nfs/dbraw/zinc/77/04/20/1133770420.db2.gz QSADCVSTXSLQQF-ZACQAIPSSA-N 1 1 297.373 3.767 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001207129733 1133770424 /nfs/dbraw/zinc/77/04/24/1133770424.db2.gz QSADCVSTXSLQQF-ZACQAIPSSA-N 1 1 297.373 3.767 20 10 CHCDMO C[C@@H](CC[NH2+]Cc1c(O)cccc1F)c1ccccc1 ZINC001207621272 1133833280 /nfs/dbraw/zinc/83/32/80/1133833280.db2.gz CQOGCWBSZDZFMT-ZDUSSCGKSA-N 1 1 273.351 3.815 20 10 CHCDMO CC/C=C\CCC[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001208135282 1133882323 /nfs/dbraw/zinc/88/23/23/1133882323.db2.gz AAPYSTSUFXWRLC-ARJAWSKDSA-N 1 1 275.392 3.592 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CC[C@@H](F)C2)cc1 ZINC001209516355 1134032108 /nfs/dbraw/zinc/03/21/08/1134032108.db2.gz DROUWQLNONASBP-MRXNPFEDSA-N 1 1 272.367 3.638 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3[C@H](CF)[C@H]3C2)cc1 ZINC001209520142 1134034017 /nfs/dbraw/zinc/03/40/17/1134034017.db2.gz ONHSEYGXUXFBLG-LDLYASANSA-N 1 1 298.405 3.741 20 10 CHCDMO c1cc2cc[nH+]cc2c(Nc2ccc3c(c2)OCCN3)c1 ZINC001209766257 1134059865 /nfs/dbraw/zinc/05/98/65/1134059865.db2.gz LDNMYQJSXWGZHJ-UHFFFAOYSA-N 1 1 277.327 3.783 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)[C@H](C)CO1 ZINC000403825820 1134877689 /nfs/dbraw/zinc/87/76/89/1134877689.db2.gz MLRPVNSDAAPNMU-UKRRQHHQSA-N 1 1 285.387 3.545 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)s2)c1O ZINC000162776243 261293840 /nfs/dbraw/zinc/29/38/40/261293840.db2.gz TVSBONJXZPMRQZ-UHFFFAOYSA-N 1 1 297.807 3.748 20 10 CHCDMO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)ccc1F ZINC000184911721 262033106 /nfs/dbraw/zinc/03/31/06/262033106.db2.gz OBMDVRLZZIWLQC-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000186561819 262098889 /nfs/dbraw/zinc/09/88/89/262098889.db2.gz KFJHPMDAKGYFKS-ONGXEEELSA-N 1 1 294.395 3.751 20 10 CHCDMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cs1 ZINC000185425316 327839994 /nfs/dbraw/zinc/83/99/94/327839994.db2.gz RSRSFUPJOHGERH-UWVGGRQHSA-N 1 1 294.395 3.962 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccncc1 ZINC000185540967 327840431 /nfs/dbraw/zinc/84/04/31/327840431.db2.gz MVJKWRSYELLVFW-NHYWBVRUSA-N 1 1 274.339 3.728 20 10 CHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)cs1 ZINC000264960649 328163602 /nfs/dbraw/zinc/16/36/02/328163602.db2.gz NZMKMFMYLDBKMD-JTQLQIEISA-N 1 1 293.411 3.507 20 10 CHCDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000184570434 329260098 /nfs/dbraw/zinc/26/00/98/329260098.db2.gz GVHHDCFXEAUEEC-LRDDRELGSA-N 1 1 286.350 3.509 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(F)cc1O ZINC000528037080 330303056 /nfs/dbraw/zinc/30/30/56/330303056.db2.gz BYZINUZFRYNGTP-HZMBPMFUSA-N 1 1 292.329 3.867 20 10 CHCDMO Cc1ccc(O)c(CNc2cc(C3CC3)cc[nH+]2)c1 ZINC000289924327 525355121 /nfs/dbraw/zinc/35/51/21/525355121.db2.gz VOPWMORPJNWSFR-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000290340323 526513510 /nfs/dbraw/zinc/51/35/10/526513510.db2.gz FJCDBQSYCBLQDD-INIZCTEOSA-N 1 1 299.418 3.849 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)C2CCC(C)CC2)c1O ZINC000133507849 1125464298 /nfs/dbraw/zinc/46/42/98/1125464298.db2.gz VSBBRZDQVDHNNU-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CC[N@@H+](CC[C@H](C)SC)Cc1ccc(N(C)C)cc1 ZINC001208147661 1117826049 /nfs/dbraw/zinc/82/60/49/1117826049.db2.gz KGWKXERVHNMLAG-AWEZNQCLSA-N 1 1 280.481 3.716 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000773766757 1121807165 /nfs/dbraw/zinc/80/71/65/1121807165.db2.gz VHPIIYCYRCELOW-CQSZACIVSA-N 1 1 260.425 3.763 20 10 CHCDMO CO[C@@H](C)[C@H](C)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774376451 1122158173 /nfs/dbraw/zinc/15/81/73/1122158173.db2.gz YGQIEFWNUPGDGJ-YIZRAAEISA-N 1 1 292.206 3.773 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1CCCC1 ZINC001202190844 1123184726 /nfs/dbraw/zinc/18/47/26/1123184726.db2.gz UDGKNSYWPOUKQS-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC1CC1 ZINC000112200273 1123483752 /nfs/dbraw/zinc/48/37/52/1123483752.db2.gz WSEGTGKTDNNDBT-UHFFFAOYSA-N 1 1 277.408 3.627 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1ccc(F)cc1O ZINC000883259373 1125387231 /nfs/dbraw/zinc/38/72/31/1125387231.db2.gz KRTHVHFIGGNNMS-VIFPVBQESA-N 1 1 275.314 3.863 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H](C)C[C@H]2C)ccc1N(C)C ZINC001139672724 1131627753 /nfs/dbraw/zinc/62/77/53/1131627753.db2.gz CZMASXAHFVQDOW-DZGCQCFKSA-N 1 1 260.425 3.681 20 10 CHCDMO CSC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841752173 1132391114 /nfs/dbraw/zinc/39/11/14/1132391114.db2.gz MPLODGKQQMEHTE-SNVBAGLBSA-N 1 1 285.840 3.982 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(Cl)cc1O ZINC000841754619 1132391970 /nfs/dbraw/zinc/39/19/70/1132391970.db2.gz UDKDOMDXEKEIRR-DGCLKSJQSA-N 1 1 283.799 3.655 20 10 CHCDMO C[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841753012 1132392581 /nfs/dbraw/zinc/39/25/81/1132392581.db2.gz DNTIQEFEJZPQSX-MRVPVSSYSA-N 1 1 275.726 3.742 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134978254 1125572131 /nfs/dbraw/zinc/57/21/31/1125572131.db2.gz ADWULJAFIUERPW-CYBMUJFWSA-N 1 1 255.361 3.777 20 10 CHCDMO C[C@H]([NH2+]CC1(CO)CCCCC1)c1ccc(Cl)cc1O ZINC000841747294 1125576627 /nfs/dbraw/zinc/57/66/27/1125576627.db2.gz AEWFZRHUDOKJOR-LBPRGKRZSA-N 1 1 297.826 3.639 20 10 CHCDMO CC(C)[C@@H]1CC[N@@H+](Cc2cccc(Br)c2[O-])C1 ZINC000135648979 1125594243 /nfs/dbraw/zinc/59/42/43/1125594243.db2.gz FIKNPDXGNGGTGX-LLVKDONJSA-N 1 1 298.224 3.633 20 10 CHCDMO CC(C)[C@@H]1CC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000135648979 1125594249 /nfs/dbraw/zinc/59/42/49/1125594249.db2.gz FIKNPDXGNGGTGX-LLVKDONJSA-N 1 1 298.224 3.633 20 10 CHCDMO CC(C)[C@@H]1CC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000135648979 1125594253 /nfs/dbraw/zinc/59/42/53/1125594253.db2.gz FIKNPDXGNGGTGX-LLVKDONJSA-N 1 1 298.224 3.633 20 10 CHCDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(OC)ccc1O ZINC000135749554 1125596597 /nfs/dbraw/zinc/59/65/97/1125596597.db2.gz ZHYNOVLRPHTAEQ-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO C[C@@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758082 1125597793 /nfs/dbraw/zinc/59/77/93/1125597793.db2.gz KKOXPUUMSHHISB-RYUDHWBXSA-N 1 1 290.794 3.722 20 10 CHCDMO Cc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886495012 1125680269 /nfs/dbraw/zinc/68/02/69/1125680269.db2.gz DTLFERJFKNASCX-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886507680 1125681792 /nfs/dbraw/zinc/68/17/92/1125681792.db2.gz VDCIQRXAMHRSAW-NEPJUHHUSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886522249 1125683250 /nfs/dbraw/zinc/68/32/50/1125683250.db2.gz FVYNJCFRNZTCJE-NEPJUHHUSA-N 1 1 289.350 3.519 20 10 CHCDMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)CO2 ZINC000886551852 1125689775 /nfs/dbraw/zinc/68/97/75/1125689775.db2.gz PNKAGUCEVNUQQB-SMDDNHRTSA-N 1 1 287.334 3.624 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1c(O)cccc1F ZINC000886627989 1125699456 /nfs/dbraw/zinc/69/94/56/1125699456.db2.gz CAGFAGYTHGXOFY-NEPJUHHUSA-N 1 1 295.423 3.715 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1c(O)cccc1F ZINC000886627990 1125699483 /nfs/dbraw/zinc/69/94/83/1125699483.db2.gz CAGFAGYTHGXOFY-NWDGAFQWSA-N 1 1 295.423 3.715 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@H]1CCCCO1 ZINC000886634868 1125700432 /nfs/dbraw/zinc/70/04/32/1125700432.db2.gz OSLDHLPNNGFJNI-OSAQELSMSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1c(O)cccc1F ZINC000886638122 1125700851 /nfs/dbraw/zinc/70/08/51/1125700851.db2.gz MMNAIRZLBIBAMI-NOZJJQNGSA-N 1 1 273.298 3.617 20 10 CHCDMO Cc1ncc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)s1 ZINC000886645389 1125702766 /nfs/dbraw/zinc/70/27/66/1125702766.db2.gz XYGNABXSFYEDBZ-DTWKUNHWSA-N 1 1 280.368 3.708 20 10 CHCDMO Oc1c(C[N@H+]2C[C@@H]3CCCC[C@@H]32)ccc2ccccc21 ZINC000826539025 1125755584 /nfs/dbraw/zinc/75/55/84/1125755584.db2.gz NLTWXYABVHDATK-YOEHRIQHSA-N 1 1 267.372 3.920 20 10 CHCDMO C[N@@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccccc1O ZINC000091974545 1125756496 /nfs/dbraw/zinc/75/64/96/1125756496.db2.gz BNOSLWIIINUPHV-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868899 1129428624 /nfs/dbraw/zinc/42/86/24/1129428624.db2.gz PTYRMXCXPXMXPZ-HUUCEWRRSA-N 1 1 279.449 3.807 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1c(O)cccc1F ZINC000903283998 1130146204 /nfs/dbraw/zinc/14/62/04/1130146204.db2.gz UEZKAFYXFHAZLE-GHMZBOCLSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1cc(F)cc(F)c1O ZINC000903311057 1130150548 /nfs/dbraw/zinc/15/05/48/1130150548.db2.gz MLGCMNCWRXWPHO-SFYZADRCSA-N 1 1 284.331 3.539 20 10 CHCDMO CCC[N@@H+](Cc1ccc(Cl)nc1)Cc1ccccc1O ZINC000174373975 1126769402 /nfs/dbraw/zinc/76/94/02/1126769402.db2.gz DGVXODJUIAESIH-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)CC(C)(C)C)c1 ZINC000812794664 1130717681 /nfs/dbraw/zinc/71/76/81/1130717681.db2.gz NWTROLFAKUMXNZ-UHFFFAOYSA-N 1 1 265.397 3.659 20 10 CHCDMO COCCCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192678276 1126962874 /nfs/dbraw/zinc/96/28/74/1126962874.db2.gz ICHVXWNDWLQAEA-VIFPVBQESA-N 1 1 292.206 3.776 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(F)cc1O ZINC000796705200 1130925384 /nfs/dbraw/zinc/92/53/84/1130925384.db2.gz DFSUTOSZBKDLBS-IUODEOHRSA-N 1 1 263.356 3.928 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[NH+]1C2CCC1CC2 ZINC001236795582 1131008736 /nfs/dbraw/zinc/00/87/36/1131008736.db2.gz HALIRWLKNCCWDF-UHFFFAOYSA-N 1 1 272.175 3.826 20 10 CHCDMO CC[C@H]1CCC[N@H+](Cc2ccc(OC)c(Cl)c2O)C1 ZINC001236806965 1131012059 /nfs/dbraw/zinc/01/20/59/1131012059.db2.gz LLDJPRFRDYVILC-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2ccc(OC)c(Cl)c2O)C1 ZINC001236806965 1131012065 /nfs/dbraw/zinc/01/20/65/1131012065.db2.gz LLDJPRFRDYVILC-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO C[C@@]1(CF)CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237076942 1131043131 /nfs/dbraw/zinc/04/31/31/1131043131.db2.gz AXNUZIPNHGQRRU-ZDUSSCGKSA-N 1 1 292.181 3.881 20 10 CHCDMO C[C@@]1(CF)CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237076942 1131043138 /nfs/dbraw/zinc/04/31/38/1131043138.db2.gz AXNUZIPNHGQRRU-ZDUSSCGKSA-N 1 1 292.181 3.881 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC=C(c3ccncc3)C2)cc1C ZINC000285235405 1127219821 /nfs/dbraw/zinc/21/98/21/1127219821.db2.gz VVOOHBXUUQYZMW-UHFFFAOYSA-N 1 1 294.398 3.693 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000286166530 1127262061 /nfs/dbraw/zinc/26/20/61/1127262061.db2.gz PQEXDFHJZTXYSB-OCCSQVGLSA-N 1 1 281.371 3.530 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000057534732 1127263143 /nfs/dbraw/zinc/26/31/43/1127263143.db2.gz AHMPKJJJUNBPLS-UHFFFAOYSA-N 1 1 299.370 3.533 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]3CCC[C@@H]3C2)cc1Cl ZINC001231868394 1127544565 /nfs/dbraw/zinc/54/45/65/1127544565.db2.gz UTBHXSWHKGMAAS-QWHCGFSZSA-N 1 1 279.811 3.976 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC000228631165 1127576324 /nfs/dbraw/zinc/57/63/24/1127576324.db2.gz SKMCTMWNNIIWDB-SMDDNHRTSA-N 1 1 295.810 3.819 20 10 CHCDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785175 1128244490 /nfs/dbraw/zinc/24/44/90/1128244490.db2.gz RIUPUGBZQJNYNI-DYVFJYSZSA-N 1 1 273.420 3.891 20 10 CHCDMO CC[C@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(F)cc1O ZINC000926917210 1128202503 /nfs/dbraw/zinc/20/25/03/1128202503.db2.gz YQWQHKLSTAMEFS-USXIJHARSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(Cl)cc1O ZINC000926948261 1128205410 /nfs/dbraw/zinc/20/54/10/1128205410.db2.gz JUVRLLTZKUXYKN-VHSKPIJISA-N 1 1 293.716 3.895 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC3(CCC3)C[C@H]2C)c1 ZINC000762140264 1128273362 /nfs/dbraw/zinc/27/33/62/1128273362.db2.gz TZBPPGAWULOVNV-CQSZACIVSA-N 1 1 259.393 3.774 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000915810974 1128340577 /nfs/dbraw/zinc/34/05/77/1128340577.db2.gz LZHNTXDMOVBXQZ-UHFFFAOYSA-N 1 1 281.399 3.821 20 10 CHCDMO C[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccccc1O ZINC000931553508 1128369296 /nfs/dbraw/zinc/36/92/96/1128369296.db2.gz DQPBSBGJIYWLNR-NSHDSACASA-N 1 1 274.364 3.529 20 10 CHCDMO Cc1[nH]c(CSc2ncc(-c3ccccc3)n2C)c(C)[nH+]1 ZINC000916203394 1128411730 /nfs/dbraw/zinc/41/17/30/1128411730.db2.gz RDZLSAPCWPOYLT-UHFFFAOYSA-N 1 1 298.415 3.719 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(C)c(C)cc2O)c1 ZINC000917483012 1128501270 /nfs/dbraw/zinc/50/12/70/1128501270.db2.gz MAOOOJZPBLHINM-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO CCCCOCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917972870 1128528793 /nfs/dbraw/zinc/52/87/93/1128528793.db2.gz GHHCXGAUNOTCRP-UHFFFAOYSA-N 1 1 290.451 3.534 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CCCCO2)cc1C(C)C ZINC000918735202 1128569678 /nfs/dbraw/zinc/56/96/78/1128569678.db2.gz HTMDGJXCRCADFD-MRXNPFEDSA-N 1 1 291.435 3.825 20 10 CHCDMO COCc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000155176480 1128661340 /nfs/dbraw/zinc/66/13/40/1128661340.db2.gz ZRKMQGSINHTTRE-UHFFFAOYSA-N 1 1 298.430 3.531 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000778998137 1128675517 /nfs/dbraw/zinc/67/55/17/1128675517.db2.gz IPWXLVCDWLCLNC-KRWDZBQOSA-N 1 1 285.362 3.738 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000778996062 1128675532 /nfs/dbraw/zinc/67/55/32/1128675532.db2.gz LJWNOXWGHDRCFD-UHFFFAOYSA-N 1 1 271.335 3.696 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000779020691 1128683219 /nfs/dbraw/zinc/68/32/19/1128683219.db2.gz OJSUCBWLXGDKEH-UHFFFAOYSA-N 1 1 267.372 3.686 20 10 CHCDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1cc(F)ccc1O ZINC000779020261 1128683568 /nfs/dbraw/zinc/68/35/68/1128683568.db2.gz LBGSTMVPFPJIGN-ZFWWWQNUSA-N 1 1 285.362 3.909 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C1CC1)C1CCC1)c1ccc(F)cc1O ZINC000324775594 1128708930 /nfs/dbraw/zinc/70/89/30/1128708930.db2.gz FCAQGBLUMIHYER-QLJPJBMISA-N 1 1 263.356 3.761 20 10 CHCDMO COCC1=CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000185036213 1117757491 /nfs/dbraw/zinc/75/74/91/1117757491.db2.gz GUCYEKUIHRLENE-UHFFFAOYSA-N 1 1 289.419 3.603 20 10 CHCDMO Cc1ccc(NCc2cc(Cl)c3cccnc3c2O)[nH+]c1 ZINC001168527834 1117791801 /nfs/dbraw/zinc/79/18/01/1117791801.db2.gz MTDQGLACGLVEDX-UHFFFAOYSA-N 1 1 299.761 3.909 20 10 CHCDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)c1 ZINC000185471754 1117826746 /nfs/dbraw/zinc/82/67/46/1117826746.db2.gz JKNSBHUHXYNLIS-RHSMWYFYSA-N 1 1 292.467 3.718 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1c(O)cccc1Cl ZINC000211443467 1118047433 /nfs/dbraw/zinc/04/74/33/1118047433.db2.gz UBYWENFTWGWBIV-LLVKDONJSA-N 1 1 253.773 3.810 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccn2C)cc1C ZINC000179706159 1128755191 /nfs/dbraw/zinc/75/51/91/1128755191.db2.gz MCMUNVKZXWWYQB-QGZVFWFLSA-N 1 1 284.403 3.685 20 10 CHCDMO CCC[N@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CCCCO1 ZINC000769339527 1118099709 /nfs/dbraw/zinc/09/97/09/1118099709.db2.gz RDBWBKXKZBPKIS-HNNXBMFYSA-N 1 1 297.826 3.827 20 10 CHCDMO CC[C@@H](NCC[N@H+](CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626674 1118184717 /nfs/dbraw/zinc/18/47/17/1118184717.db2.gz ALFXXNGAYARNFB-GOSISDBHSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](NCC[N@@H+](CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626674 1118184719 /nfs/dbraw/zinc/18/47/19/1118184719.db2.gz ALFXXNGAYARNFB-GOSISDBHSA-N 1 1 291.483 3.524 20 10 CHCDMO CC(C)OC1CCC([NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000186160155 1118204310 /nfs/dbraw/zinc/20/43/10/1118204310.db2.gz JHNZFNZFLNEBAU-GRTSSRMGSA-N 1 1 295.398 3.918 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H](C)c1ccc(C#N)cc1 ZINC000179937339 1128766927 /nfs/dbraw/zinc/76/69/27/1128766927.db2.gz MAJFWUUSHKCKJV-CYBMUJFWSA-N 1 1 298.361 3.986 20 10 CHCDMO CC[C@H](C)C[N@@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001663672568 1118521595 /nfs/dbraw/zinc/52/15/95/1118521595.db2.gz SYKMXEXBGFPZBV-LBPRGKRZSA-N 1 1 265.397 3.577 20 10 CHCDMO Cc1ccc[nH+]c1NCc1ccc(N2CCCCC2)cc1 ZINC000121261539 1118527086 /nfs/dbraw/zinc/52/70/86/1118527086.db2.gz FQLHUCDKQKBQQM-UHFFFAOYSA-N 1 1 281.403 3.992 20 10 CHCDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707146233 1118648433 /nfs/dbraw/zinc/64/84/33/1118648433.db2.gz KLNFQHYYTWAKHP-GHMZBOCLSA-N 1 1 298.224 3.775 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000782275827 1118734406 /nfs/dbraw/zinc/73/44/06/1118734406.db2.gz IUEHUMKOSNNATG-BPUTZDHNSA-N 1 1 289.419 3.720 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140464594 1118736401 /nfs/dbraw/zinc/73/64/01/1118736401.db2.gz WNUUJYMXRANEAS-CYBMUJFWSA-N 1 1 253.773 3.666 20 10 CHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140466059 1118745762 /nfs/dbraw/zinc/74/57/62/1118745762.db2.gz VRGCEIYQVAELLU-GFCCVEGCSA-N 1 1 287.790 3.992 20 10 CHCDMO CCC[N@@H+](Cc1cnc(F)c(C)c1)Cc1ccccc1O ZINC000891853423 1118804026 /nfs/dbraw/zinc/80/40/26/1118804026.db2.gz LXQSBUBLJYPGOH-UHFFFAOYSA-N 1 1 288.366 3.647 20 10 CHCDMO CC[C@H]([NH2+]CC1(C2CC2)CC1)c1ccc(F)cc1O ZINC000796841096 1119091204 /nfs/dbraw/zinc/09/12/04/1119091204.db2.gz QPFMJPLZUFUINZ-AWEZNQCLSA-N 1 1 263.356 3.762 20 10 CHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1c([O-])cc(F)cc1F ZINC001140582471 1119148337 /nfs/dbraw/zinc/14/83/37/1119148337.db2.gz JFEABVCJXYVCCU-LLVKDONJSA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@@H]1c2ccccc2CCN1Cc1c([O-])cc(F)cc1F ZINC001140582471 1119148341 /nfs/dbraw/zinc/14/83/41/1119148341.db2.gz JFEABVCJXYVCCU-LLVKDONJSA-N 1 1 289.325 3.790 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)c1O ZINC000250520121 1119442101 /nfs/dbraw/zinc/44/21/01/1119442101.db2.gz RTJCURGMCJBNIQ-CABCVRRESA-N 1 1 289.419 3.803 20 10 CHCDMO CC(C)(C)C[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708424111 1119450642 /nfs/dbraw/zinc/45/06/42/1119450642.db2.gz WUASTDNOGNCRAC-NSHDSACASA-N 1 1 283.362 3.929 20 10 CHCDMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000708424111 1119450643 /nfs/dbraw/zinc/45/06/43/1119450643.db2.gz WUASTDNOGNCRAC-NSHDSACASA-N 1 1 283.362 3.929 20 10 CHCDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1O ZINC000179576770 1119751916 /nfs/dbraw/zinc/75/19/16/1119751916.db2.gz YLCRFNSYHOGBER-WMLDXEAASA-N 1 1 267.372 3.770 20 10 CHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000091024535 1120055919 /nfs/dbraw/zinc/05/59/19/1120055919.db2.gz GTEAFTCTSBRZEN-CQSZACIVSA-N 1 1 267.438 3.582 20 10 CHCDMO C[C@H]([NH2+][C@H]1CC2CCC1CC2)c1ccc(F)cc1O ZINC000311847007 1120113257 /nfs/dbraw/zinc/11/32/57/1120113257.db2.gz ILKOZAQZFKUGPM-QZLRTXKQSA-N 1 1 263.356 3.761 20 10 CHCDMO 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CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000773815190 1121882010 /nfs/dbraw/zinc/88/20/10/1121882010.db2.gz YLRIRSPKVPMPOQ-LJQANCHMSA-N 1 1 295.430 3.875 20 10 CHCDMO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ncc(C)s2)cc1 ZINC000773839485 1121940158 /nfs/dbraw/zinc/94/01/58/1121940158.db2.gz NQMIAIKFQJCKOI-ZDUSSCGKSA-N 1 1 289.448 3.758 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1c(C)cc(OC)cc1O ZINC001180108720 1121952089 /nfs/dbraw/zinc/95/20/89/1121952089.db2.gz XPPHIJUFOJYTJP-UHFFFAOYSA-N 1 1 291.416 3.793 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2C)cc1Cl ZINC001180438279 1121986741 /nfs/dbraw/zinc/98/67/41/1121986741.db2.gz XGUHBEVUSHAGPB-NSHDSACASA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1ccc(CNc2c(C)cc([NH+](C)C)cc2C)c(O)c1 ZINC001180602301 1122002650 /nfs/dbraw/zinc/00/26/50/1122002650.db2.gz GZVSHIAFTYMGON-UHFFFAOYSA-N 1 1 284.403 3.996 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)CC2)c1O ZINC000110806793 1122003121 /nfs/dbraw/zinc/00/31/21/1122003121.db2.gz YLOBDYLFXFVYRK-LLVKDONJSA-N 1 1 295.810 3.870 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)CC2)c1O ZINC000110806793 1122003130 /nfs/dbraw/zinc/00/31/30/1122003130.db2.gz YLOBDYLFXFVYRK-LLVKDONJSA-N 1 1 295.810 3.870 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCCC23CCC3)cc1 ZINC000773893726 1122030696 /nfs/dbraw/zinc/03/06/96/1122030696.db2.gz COYIGEKLYLTUAJ-UHFFFAOYSA-N 1 1 258.409 3.661 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000779604089 1129031969 /nfs/dbraw/zinc/03/19/69/1129031969.db2.gz FZJVDMOJJWWKRB-GFCCVEGCSA-N 1 1 263.356 3.543 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c(Cl)c1 ZINC001182453727 1122161559 /nfs/dbraw/zinc/16/15/59/1122161559.db2.gz VREIVDASYNLTSK-QJPTWQEYSA-N 1 1 267.800 3.830 20 10 CHCDMO CC[C@@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)C[C@H](CC)O1 ZINC001182461948 1122165737 /nfs/dbraw/zinc/16/57/37/1122165737.db2.gz MREREULEKOYZOC-CALCHBBNSA-N 1 1 291.435 3.905 20 10 CHCDMO CC(C)[N@@H+](Cc1ccco1)Cc1cc(F)ccc1O ZINC000272318349 1122197742 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C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc2ccccc2c1[O-] ZINC000192925450 1129047616 /nfs/dbraw/zinc/04/76/16/1129047616.db2.gz DDYARYXWQDJSPB-OAHLLOKOSA-N 1 1 298.430 3.682 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC001203650917 1122414951 /nfs/dbraw/zinc/41/49/51/1122414951.db2.gz GGXNRNZVOLMGER-SNVBAGLBSA-N 1 1 289.753 3.913 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccnc2)cc1 ZINC000193144381 1129056401 /nfs/dbraw/zinc/05/64/01/1129056401.db2.gz XJYJFHOVRXSPCI-UHFFFAOYSA-N 1 1 283.419 3.560 20 10 CHCDMO CC[C@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccccc1O ZINC000775545209 1122657057 /nfs/dbraw/zinc/65/70/57/1122657057.db2.gz DGUFFYVNGNZNGT-AWEZNQCLSA-N 1 1 281.359 3.842 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCCc2occc21 ZINC000294315353 1122725567 /nfs/dbraw/zinc/72/55/67/1122725567.db2.gz QTZFTLGNITWQOW-CYBMUJFWSA-N 1 1 295.741 3.945 20 10 CHCDMO COCC[N@@H+](Cc1cccc(C)c1O)[C@@H](C)c1ccccc1 ZINC000775657117 1122871916 /nfs/dbraw/zinc/87/19/16/1122871916.db2.gz UWIAEXDLQSCZRP-INIZCTEOSA-N 1 1 299.414 3.910 20 10 CHCDMO CC[N@@H+](Cc1cc(Cl)cc(C)c1O)C1CCC1 ZINC000775712271 1122918424 /nfs/dbraw/zinc/91/84/24/1122918424.db2.gz OILGUZNWODVHQL-UHFFFAOYSA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)n1 ZINC000775716313 1122922175 /nfs/dbraw/zinc/92/21/75/1122922175.db2.gz TXQCHFDOJBDHNG-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000775724118 1122924606 /nfs/dbraw/zinc/92/46/06/1122924606.db2.gz CVNABQDTEHBYTF-IBGZPJMESA-N 1 1 281.399 3.864 20 10 CHCDMO Cc1cccc(C[N@H+]2CCOC3(C2)CCCCCC3)c1O ZINC000775725621 1122925222 /nfs/dbraw/zinc/92/52/22/1122925222.db2.gz JZRBFJBQUVSBDT-UHFFFAOYSA-N 1 1 289.419 3.626 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000775735565 1122928560 /nfs/dbraw/zinc/92/85/60/1122928560.db2.gz WOYZNCZOUMBWTM-PBHICJAKSA-N 1 1 267.372 3.894 20 10 CHCDMO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccc(N(C)C)cc1 ZINC000775830484 1122984871 /nfs/dbraw/zinc/98/48/71/1122984871.db2.gz KAONJBUKQIHSOM-ZDIKFAODSA-N 1 1 273.207 3.722 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000776013693 1123036097 /nfs/dbraw/zinc/03/60/97/1123036097.db2.gz NLMAAOJOKCYSSO-DGCLKSJQSA-N 1 1 287.325 3.863 20 10 CHCDMO CCc1ccc[nH+]c1NCc1cc(F)c(N(C)C)cc1F ZINC001201586933 1123128554 /nfs/dbraw/zinc/12/85/54/1123128554.db2.gz IVIBCRLDGLZEDC-UHFFFAOYSA-N 1 1 291.345 3.600 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cccc(F)c1O)c1ccccc1 ZINC000158752456 1123205085 /nfs/dbraw/zinc/20/50/85/1123205085.db2.gz BNVDXPNXVKTTRX-OAHLLOKOSA-N 1 1 259.324 3.772 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccc(F)cc1O ZINC000696623620 1123246279 /nfs/dbraw/zinc/24/62/79/1123246279.db2.gz ZETZANKPUFEINF-VIFPVBQESA-N 1 1 275.314 3.863 20 10 CHCDMO C[C@@H]([NH2+]CCCOC(C)(C)C)c1ccc(Cl)cc1O ZINC000850524586 1123280758 /nfs/dbraw/zinc/28/07/58/1123280758.db2.gz COKGCKODLVKMRF-LLVKDONJSA-N 1 1 285.815 3.901 20 10 CHCDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccccc1O ZINC000111236017 1123432424 /nfs/dbraw/zinc/43/24/24/1123432424.db2.gz VAVIKVXSYZLKAC-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@H]([NH2+]CCOC1CCCCC1)c1ccc(F)cc1O ZINC000111636457 1123457627 /nfs/dbraw/zinc/45/76/27/1123457627.db2.gz DLGGLEWWEDXMPE-LBPRGKRZSA-N 1 1 281.371 3.531 20 10 CHCDMO CC1=C[C@@H](C)C[N@H+](Cc2cccc(Br)c2O)C1 ZINC000797605476 1123459976 /nfs/dbraw/zinc/45/99/76/1123459976.db2.gz ROTFLKTXLGVVSG-SNVBAGLBSA-N 1 1 296.208 3.553 20 10 CHCDMO CC1=C[C@@H](C)C[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000797605476 1123459979 /nfs/dbraw/zinc/45/99/79/1123459979.db2.gz ROTFLKTXLGVVSG-SNVBAGLBSA-N 1 1 296.208 3.553 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCc3occc3C2)c1O ZINC001237687389 1129127678 /nfs/dbraw/zinc/12/76/78/1129127678.db2.gz ZWBHXDFWJWZKTP-UHFFFAOYSA-N 1 1 277.751 3.505 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCc3occc3C2)c1O ZINC001237687389 1129127680 /nfs/dbraw/zinc/12/76/80/1129127680.db2.gz ZWBHXDFWJWZKTP-UHFFFAOYSA-N 1 1 277.751 3.505 20 10 CHCDMO 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RERPMMIZYWFNLO-UHFFFAOYSA-N 1 1 295.386 3.681 20 10 CHCDMO CCC[N@@H+](Cc1cccc2c1OCO2)Cc1ccccc1O ZINC000769201508 1129896507 /nfs/dbraw/zinc/89/65/07/1129896507.db2.gz VUJNXABVQZIZFV-UHFFFAOYSA-N 1 1 299.370 3.533 20 10 CHCDMO CCC[N@@H+](Cc1ccc(N(CC)CC)cc1)CC(C)(C)O ZINC000769327338 1129902331 /nfs/dbraw/zinc/90/23/31/1129902331.db2.gz XFJVOBKSSKXALA-UHFFFAOYSA-N 1 1 292.467 3.516 20 10 CHCDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1c(O)cccc1OC ZINC000769428369 1129908279 /nfs/dbraw/zinc/90/82/79/1129908279.db2.gz QSAGFZQVFCETSV-KRWDZBQOSA-N 1 1 297.398 3.910 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000769482346 1129909446 /nfs/dbraw/zinc/90/94/46/1129909446.db2.gz COTJHOYLOWVZJM-UHFFFAOYSA-N 1 1 291.700 3.740 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000769482346 1129909450 /nfs/dbraw/zinc/90/94/50/1129909450.db2.gz COTJHOYLOWVZJM-UHFFFAOYSA-N 1 1 291.700 3.740 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c1 ZINC000769483643 1129909492 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C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000816648339 1131119622 /nfs/dbraw/zinc/11/96/22/1131119622.db2.gz IZCHZJKZDGFWOI-CABCVRRESA-N 1 1 258.409 3.517 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H]1C ZINC000816649340 1131120700 /nfs/dbraw/zinc/12/07/00/1131120700.db2.gz XQGNQJYCKWRUOH-KGLIPLIRSA-N 1 1 267.372 3.899 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H](C)C2)c1O ZINC001237682051 1131126478 /nfs/dbraw/zinc/12/64/78/1131126478.db2.gz VTBCNJJYVWIKHY-LLVKDONJSA-N 1 1 267.800 3.976 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)cn1 ZINC001237688915 1131128152 /nfs/dbraw/zinc/12/81/52/1131128152.db2.gz KKVLYYCOFVZTSS-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237808660 1131142676 /nfs/dbraw/zinc/14/26/76/1131142676.db2.gz VRUSHTJAVUTMFE-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CC[N@@H+](Cc1ccccc1F)Cc1cc(C)ccc1O ZINC001116439446 1131145895 /nfs/dbraw/zinc/14/58/95/1131145895.db2.gz AJNVKRFSWDLUKT-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO C[NH+](C)C1CCC([NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000817413708 1131160008 /nfs/dbraw/zinc/16/00/08/1131160008.db2.gz AHBCDILYCJEJKH-UHFFFAOYSA-N 1 1 298.430 3.508 20 10 CHCDMO Cc1ccc2c(c1)C[N@H+](Cc1cc(F)cc(C)c1O)CC2 ZINC001238057776 1131164708 /nfs/dbraw/zinc/16/47/08/1131164708.db2.gz MUIYHZFJSCEOTF-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2nccs2)c1O ZINC001238071376 1131168116 /nfs/dbraw/zinc/16/81/16/1131168116.db2.gz VXUUTMLBDBJUPE-ZDUSSCGKSA-N 1 1 292.379 3.633 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@H]2c2nccs2)c1O ZINC001238071376 1131168118 /nfs/dbraw/zinc/16/81/18/1131168118.db2.gz VXUUTMLBDBJUPE-ZDUSSCGKSA-N 1 1 292.379 3.633 20 10 CHCDMO C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000817976628 1131194060 /nfs/dbraw/zinc/19/40/60/1131194060.db2.gz PTJJDSYEZBJCEL-ZIAGYGMSSA-N 1 1 286.419 3.714 20 10 CHCDMO CCC[N@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137837861 1131421084 /nfs/dbraw/zinc/42/10/84/1131421084.db2.gz XKBJZHKDMYDUJR-UHFFFAOYSA-N 1 1 273.351 3.944 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137837861 1131421085 /nfs/dbraw/zinc/42/10/85/1131421085.db2.gz XKBJZHKDMYDUJR-UHFFFAOYSA-N 1 1 273.351 3.944 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001137838833 1131421306 /nfs/dbraw/zinc/42/13/06/1131421306.db2.gz LFSBCUXPEVVEKP-SWLSCSKDSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001137838833 1131421308 /nfs/dbraw/zinc/42/13/08/1131421308.db2.gz LFSBCUXPEVVEKP-SWLSCSKDSA-N 1 1 263.356 3.686 20 10 CHCDMO CCC[N@@H+](Cc1cc2cccnc2o1)Cc1ccccc1O ZINC000823424031 1131428152 /nfs/dbraw/zinc/42/81/52/1131428152.db2.gz RIWUNTTXKOUOLO-UHFFFAOYSA-N 1 1 296.370 3.946 20 10 CHCDMO CCCC[N@@H+](Cc1ccncc1C)Cc1ccccc1O ZINC000824344295 1131465049 /nfs/dbraw/zinc/46/50/49/1131465049.db2.gz IUJOGQHLPIXLDS-UHFFFAOYSA-N 1 1 284.403 3.898 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000824472580 1131470535 /nfs/dbraw/zinc/47/05/35/1131470535.db2.gz VLPIONJSEGHCPV-QGZVFWFLSA-N 1 1 273.351 3.869 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000824714729 1131480610 /nfs/dbraw/zinc/48/06/10/1131480610.db2.gz FGGQWGCJNZODJY-WCQYABFASA-N 1 1 287.325 3.863 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@@]3(C2)CCCCO3)c2ccccc2n1C ZINC001138252797 1131482059 /nfs/dbraw/zinc/48/20/59/1131482059.db2.gz VBNLKYPKZNYTEL-LJQANCHMSA-N 1 1 298.430 3.632 20 10 CHCDMO Cc1c(C[N@@H+](C)CCc2ccccn2)c2ccccc2n1C ZINC001138252608 1131482126 /nfs/dbraw/zinc/48/21/26/1131482126.db2.gz NIOIXILWGNDPLU-UHFFFAOYSA-N 1 1 293.414 3.556 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@]3(C2)CCCCO3)c2ccccc2n1C ZINC001138252796 1131482535 /nfs/dbraw/zinc/48/25/35/1131482535.db2.gz VBNLKYPKZNYTEL-IBGZPJMESA-N 1 1 298.430 3.632 20 10 CHCDMO Cc1c(C[N@H+]2CCC[C@H](CF)C2)c2ccccc2n1C ZINC001138257074 1131483353 /nfs/dbraw/zinc/48/33/53/1131483353.db2.gz USRSKNIZKFSAJO-CQSZACIVSA-N 1 1 274.383 3.668 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1CCCC1(F)F ZINC000824800519 1131484942 /nfs/dbraw/zinc/48/49/42/1131484942.db2.gz YQGORBGTFSEQOE-MRVPVSSYSA-N 1 1 293.716 3.710 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCC[C@H](C(F)F)C3)ccc21 ZINC001138358679 1131493559 /nfs/dbraw/zinc/49/35/59/1131493559.db2.gz XKJAKPSTQNHCOX-HNNXBMFYSA-N 1 1 294.389 3.546 20 10 CHCDMO CCC[N@@H+](CC)Cc1ccc(N(CC)CC)cc1OC ZINC001138388622 1131497661 /nfs/dbraw/zinc/49/76/61/1131497661.db2.gz ZNZBODIJTYSMOT-UHFFFAOYSA-N 1 1 278.440 3.773 20 10 CHCDMO CCC[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H](C)CC ZINC001138495625 1131513376 /nfs/dbraw/zinc/51/33/76/1131513376.db2.gz ZWKUDZSAGLWMMQ-MRXNPFEDSA-N 1 1 290.451 3.534 20 10 CHCDMO CC[N@H+](Cc1csc(C(C)C)n1)Cc1ccccc1O ZINC001138887718 1131557643 /nfs/dbraw/zinc/55/76/43/1131557643.db2.gz PLKNZNKEKUHKDC-UHFFFAOYSA-N 1 1 290.432 3.994 20 10 CHCDMO CC[N@@H+](Cc1csc(C(C)C)n1)Cc1ccccc1O ZINC001138887718 1131557645 /nfs/dbraw/zinc/55/76/45/1131557645.db2.gz PLKNZNKEKUHKDC-UHFFFAOYSA-N 1 1 290.432 3.994 20 10 CHCDMO CCn1ccc2c1cccc2C[N@@H+](C)Cc1ccccc1O ZINC001139158120 1131588321 /nfs/dbraw/zinc/58/83/21/1131588321.db2.gz CVXMHEOXWRUUFP-UHFFFAOYSA-N 1 1 294.398 3.999 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1C ZINC000844746394 1131596649 /nfs/dbraw/zinc/59/66/49/1131596649.db2.gz LJFNMARCSIMEMB-HNNXBMFYSA-N 1 1 281.346 3.630 20 10 CHCDMO Cc1cc(C[N@H+]2CCC23CCCCC3)ccc1N(C)C ZINC001139670383 1131626646 /nfs/dbraw/zinc/62/66/46/1131626646.db2.gz LUJSAJWQQOFINP-UHFFFAOYSA-N 1 1 272.436 3.970 20 10 CHCDMO Cc1cc(C[N@@H+](C)C[C@@H]2CC2(C)C)ccc1N(C)C ZINC001139672977 1131627689 /nfs/dbraw/zinc/62/76/89/1131627689.db2.gz MGUDZHFKSPKFNV-HNNXBMFYSA-N 1 1 260.425 3.539 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)cn1 ZINC001140058568 1131659720 /nfs/dbraw/zinc/65/97/20/1131659720.db2.gz HISSIRULGLYZGB-INIZCTEOSA-N 1 1 286.350 3.572 20 10 CHCDMO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1O ZINC001140058454 1131659903 /nfs/dbraw/zinc/65/99/03/1131659903.db2.gz AGFSNIGZOLFVMB-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001140058745 1131660112 /nfs/dbraw/zinc/66/01/12/1131660112.db2.gz KLVWQDCDPTZWIZ-UHFFFAOYSA-N 1 1 283.346 3.821 20 10 CHCDMO C[N@@H+](Cc1cc(F)ccc1O)C(C)(C)Cc1ccccc1 ZINC001140060432 1131660312 /nfs/dbraw/zinc/66/03/12/1131660312.db2.gz VSHPCNVCQUCGRC-UHFFFAOYSA-N 1 1 287.378 3.984 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CCOc2ccccc2)c1O ZINC001140178906 1131673327 /nfs/dbraw/zinc/67/33/27/1131673327.db2.gz BYFHKDQYPMXROJ-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)CC/C=C/c2cccnc2)c1O ZINC001140184446 1131674453 /nfs/dbraw/zinc/67/44/53/1131674453.db2.gz UPJFYVTTWCEEEN-QPJJXVBHSA-N 1 1 296.414 3.939 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC001140182554 1131674597 /nfs/dbraw/zinc/67/45/97/1131674597.db2.gz VDNOVTYOURTYFE-ZBFHGGJFSA-N 1 1 259.393 3.774 20 10 CHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000846014698 1131677912 /nfs/dbraw/zinc/67/79/12/1131677912.db2.gz UMAQKUARENTXCK-QGZVFWFLSA-N 1 1 299.414 3.935 20 10 CHCDMO CC(C)[C@H]1C[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)CCO1 ZINC000834884832 1131717679 /nfs/dbraw/zinc/71/76/79/1131717679.db2.gz DAKWALGPNPEMOD-GDZNZVCISA-N 1 1 295.398 3.633 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1nc(Cl)ccc1C ZINC001140447395 1131741596 /nfs/dbraw/zinc/74/15/96/1131741596.db2.gz VYMBBWPMNDTREH-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001140465266 1131750639 /nfs/dbraw/zinc/75/06/39/1131750639.db2.gz LZSLHUZGJPRPKT-LLVKDONJSA-N 1 1 253.773 3.810 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)cc1O)Cc1ccc(F)cc1F ZINC001140466166 1131751030 /nfs/dbraw/zinc/75/10/30/1131751030.db2.gz ZOAQETYHVLFTEY-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+](C1CCC1)C1CCOCC1 ZINC001140468527 1131754101 /nfs/dbraw/zinc/75/41/01/1131754101.db2.gz NRJZYZONENSQSK-UHFFFAOYSA-N 1 1 295.810 3.579 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+](C1CCC1)C1CCOCC1 ZINC001140468527 1131754110 /nfs/dbraw/zinc/75/41/10/1131754110.db2.gz NRJZYZONENSQSK-UHFFFAOYSA-N 1 1 295.810 3.579 20 10 CHCDMO C[C@@H]1CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000835049785 1131765000 /nfs/dbraw/zinc/76/50/00/1131765000.db2.gz STKOCIBOBBUGLU-FOSCPCJNSA-N 1 1 290.476 3.593 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c1 ZINC001140617481 1131829724 /nfs/dbraw/zinc/82/97/24/1131829724.db2.gz QTOSULVHHTXPKN-GFCCVEGCSA-N 1 1 269.335 3.568 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)c1 ZINC001140623834 1131832679 /nfs/dbraw/zinc/83/26/79/1131832679.db2.gz UEBIBFAVUNQKPH-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@](C)(CF)C2)c(Cl)c1 ZINC001140922550 1131962843 /nfs/dbraw/zinc/96/28/43/1131962843.db2.gz UJIAKWBYNDTIRJ-OAHLLOKOSA-N 1 1 284.806 3.588 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CC2CC2)C2CC2)c(Cl)c1 ZINC001140926381 1131966314 /nfs/dbraw/zinc/96/63/14/1131966314.db2.gz LGTKOLJVNQVQDJ-UHFFFAOYSA-N 1 1 278.827 3.780 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3ccc(C)cc3C2)c(O)c1 ZINC001140948028 1131968749 /nfs/dbraw/zinc/96/87/49/1131968749.db2.gz QCZHARJZXDNLDX-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001140947987 1131969167 /nfs/dbraw/zinc/96/91/67/1131969167.db2.gz OKFVHVPMWVQRPC-MRXNPFEDSA-N 1 1 267.372 3.690 20 10 CHCDMO c1c(C[N@H+]2CCCCC23CC3)cc2c3c1CCCN3CCC2 ZINC001141078509 1132007784 /nfs/dbraw/zinc/00/77/84/1132007784.db2.gz YRUSIGKZPHBOBU-UHFFFAOYSA-N 1 1 296.458 3.904 20 10 CHCDMO CN1CCOc2cc(C[N@@H+](C)CC3CCCCC3)ccc21 ZINC001141143965 1132028097 /nfs/dbraw/zinc/02/80/97/1132028097.db2.gz QDUNYJYXMRCDCD-UHFFFAOYSA-N 1 1 288.435 3.527 20 10 CHCDMO C[N@@H+](Cc1cc(O)ccc1O)C(C)(C)Cc1ccccc1 ZINC001141162662 1132031713 /nfs/dbraw/zinc/03/17/13/1132031713.db2.gz ZEVJTYFFJUEEPT-UHFFFAOYSA-N 1 1 285.387 3.551 20 10 CHCDMO CCC[N@@H+](Cc1ccc2c(n1)CCC2)Cc1ccccc1O ZINC000838810732 1132148957 /nfs/dbraw/zinc/14/89/57/1132148957.db2.gz YPNCGLWFHVHXQA-UHFFFAOYSA-N 1 1 296.414 3.688 20 10 CHCDMO CC1(CC(F)(F)F)C[NH+](Cc2cc(Cl)ccc2O)C1 ZINC000839144579 1132184765 /nfs/dbraw/zinc/18/47/65/1132184765.db2.gz YMLGZUQWUMXXEL-UHFFFAOYSA-N 1 1 293.716 3.820 20 10 CHCDMO CCOCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172428524 1132205560 /nfs/dbraw/zinc/20/55/60/1132205560.db2.gz ITABEQJDBWUYGG-INIZCTEOSA-N 1 1 290.451 3.534 20 10 CHCDMO C[C@H](c1ccccc1)[N@@H+](CCCCO)Cc1ccccc1O ZINC000839532689 1132220993 /nfs/dbraw/zinc/22/09/93/1132220993.db2.gz ZKHFMUSLTKJDRE-MRXNPFEDSA-N 1 1 299.414 3.728 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)CCOCC(C)C ZINC001172485279 1132230591 /nfs/dbraw/zinc/23/05/91/1132230591.db2.gz VRAQFZFIQGKPSE-OAHLLOKOSA-N 1 1 279.424 3.665 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC000840187171 1132249114 /nfs/dbraw/zinc/24/91/14/1132249114.db2.gz ACFOLSZCFIFSGA-HNNXBMFYSA-N 1 1 282.387 3.562 20 10 CHCDMO CC[C@H]([NH2+][C@H]1C[C@H](OC)C12CCC2)c1ccc(F)cc1O ZINC000840807208 1132288718 /nfs/dbraw/zinc/28/87/18/1132288718.db2.gz RGLDLWDNWVKPOD-BPUTZDHNSA-N 1 1 293.382 3.530 20 10 CHCDMO CC[C@@H]([NH2+]C1CCC(COC)CC1)c1ccc(F)cc1O ZINC000840875869 1132301292 /nfs/dbraw/zinc/30/12/92/1132301292.db2.gz JZOQVLIOIRBBAT-LDZOIKDWSA-N 1 1 295.398 3.777 20 10 CHCDMO CCc1nc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cs1 ZINC000840895460 1132305533 /nfs/dbraw/zinc/30/55/33/1132305533.db2.gz NEINDDNWSQTLMO-UHFFFAOYSA-N 1 1 296.823 3.663 20 10 CHCDMO COC1CCC([N@@H+](C)Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840915389 1132308664 /nfs/dbraw/zinc/30/86/64/1132308664.db2.gz QFRJFQHFQAAYDA-UHFFFAOYSA-N 1 1 297.826 3.743 20 10 CHCDMO CCn1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840942282 1132311327 /nfs/dbraw/zinc/31/13/27/1132311327.db2.gz XWLSQGAJYPFBCX-UHFFFAOYSA-N 1 1 285.435 3.514 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000840947033 1132312271 /nfs/dbraw/zinc/31/22/71/1132312271.db2.gz ZPMXARXMJZQBCC-LJQANCHMSA-N 1 1 295.430 3.793 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cccc(Cl)c3C2)c1O ZINC001231594159 1132321782 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COc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001231849412 1132379763 /nfs/dbraw/zinc/37/97/63/1132379763.db2.gz SGSBCSGXVOAHJA-HUUCEWRRSA-N 1 1 290.451 3.629 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C(C)C)C2CCOCC2)cc1Cl ZINC001231870918 1132383544 /nfs/dbraw/zinc/38/35/44/1132383544.db2.gz DLDBNIZLDPURBV-UHFFFAOYSA-N 1 1 297.826 3.743 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCC2CC2)cc1Cl ZINC001231870397 1132385586 /nfs/dbraw/zinc/38/55/86/1132385586.db2.gz YHQVEWKUPWNEJL-UHFFFAOYSA-N 1 1 253.773 3.586 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)C1(C)CC1)c1ccc(Cl)cc1O ZINC000841750483 1132389030 /nfs/dbraw/zinc/38/90/30/1132389030.db2.gz QKIILSDBUVEHFH-UWVGGRQHSA-N 1 1 253.773 3.885 20 10 CHCDMO CCCOC1CCC([N@@H+](C)Cc2ccccc2O)CC1 ZINC001173100497 1132390909 /nfs/dbraw/zinc/39/09/09/1132390909.db2.gz GQWYARGAKJEVLC-UHFFFAOYSA-N 1 1 277.408 3.562 20 10 CHCDMO C[C@@]1(CO)CCC[N@@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001231879587 1132391813 /nfs/dbraw/zinc/39/18/13/1132391813.db2.gz JCLRLWCMZGVFGS-LJQANCHMSA-N 1 1 299.414 3.530 20 10 CHCDMO C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)cc1[O-] ZINC000841757992 1132393627 /nfs/dbraw/zinc/39/36/27/1132393627.db2.gz QXFGYOUZLWNKKE-GFCCVEGCSA-N 1 1 296.842 3.571 20 10 CHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccncc1 ZINC000841760899 1132395863 /nfs/dbraw/zinc/39/58/63/1132395863.db2.gz VSESTFJRCPURRM-RYUDHWBXSA-N 1 1 290.794 3.895 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(Cl)cc1O ZINC000841761580 1132396011 /nfs/dbraw/zinc/39/60/11/1132396011.db2.gz YNZZWDBLYBOWNS-MWLCHTKSSA-N 1 1 271.813 3.592 20 10 CHCDMO CCC[N@H+](Cc1cc(Cl)c(O)cc1O)CC(C)C ZINC001232263870 1132444369 /nfs/dbraw/zinc/44/43/69/1132444369.db2.gz WWNNVVWCMKUYNN-UHFFFAOYSA-N 1 1 271.788 3.619 20 10 CHCDMO C[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)CC(F)F ZINC000842729019 1132455635 /nfs/dbraw/zinc/45/56/35/1132455635.db2.gz LLASKQANSILIOV-SSDOTTSWSA-N 1 1 281.705 3.566 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)c1ccc(Cl)cc1O ZINC000842927583 1132475643 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c1cc(N2CCCC2)ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001204319846 1133437229 /nfs/dbraw/zinc/43/72/29/1133437229.db2.gz HTAFZEACNRAANY-CALCHBBNSA-N 1 1 270.420 3.519 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)C2(CC2)C1 ZINC001204328814 1133438843 /nfs/dbraw/zinc/43/88/43/1133438843.db2.gz OHWBFCGMFCITFI-HNNXBMFYSA-N 1 1 270.420 3.661 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc1C ZINC001204355665 1133439163 /nfs/dbraw/zinc/43/91/63/1133439163.db2.gz RFFRVCWETGDGLC-UHFFFAOYSA-N 1 1 297.398 3.663 20 10 CHCDMO CCc1cccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1O ZINC001204542808 1133461556 /nfs/dbraw/zinc/46/15/56/1133461556.db2.gz IOVUFLHBEHDGKE-CVEARBPZSA-N 1 1 291.460 3.815 20 10 CHCDMO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)CC(C)C ZINC001204880867 1133494998 /nfs/dbraw/zinc/49/49/98/1133494998.db2.gz JJZCKFBBGMDQGX-BQYQJAHWSA-N 1 1 260.425 3.744 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001205082294 1133525363 /nfs/dbraw/zinc/52/53/63/1133525363.db2.gz NPJZAVPJZRIZCY-NWDGAFQWSA-N 1 1 281.346 3.683 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001205082294 1133525367 /nfs/dbraw/zinc/52/53/67/1133525367.db2.gz NPJZAVPJZRIZCY-NWDGAFQWSA-N 1 1 281.346 3.683 20 10 CHCDMO Oc1cc2c(cc1O)C[N@@H+](CCC1CCCCC1)CCC2 ZINC001207261281 1133784375 /nfs/dbraw/zinc/78/43/75/1133784375.db2.gz RIWYDRZDNCUNJW-UHFFFAOYSA-N 1 1 289.419 3.816 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207626753 1133832125 /nfs/dbraw/zinc/83/21/25/1133832125.db2.gz KZSPEFAPBJYXPB-IPMKNSEASA-N 1 1 296.458 3.931 20 10 CHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001207623887 1133833286 /nfs/dbraw/zinc/83/32/86/1133833286.db2.gz YPMRXRMSQOFLMQ-HZSPNIEDSA-N 1 1 277.383 3.980 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H]3CSC[C@@]3(C)C2)c1 ZINC001207739114 1133843249 /nfs/dbraw/zinc/84/32/49/1133843249.db2.gz XQRJKZOZNFKRSX-DOTOQJQBSA-N 1 1 291.460 3.701 20 10 CHCDMO CC[N@@H+](Cc1ccc2cc[nH]c2c1)Cc1ccccc1O ZINC001209515618 1134032696 /nfs/dbraw/zinc/03/26/96/1134032696.db2.gz XDBMVQVCOXVISE-UHFFFAOYSA-N 1 1 280.371 3.896 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cccc(Br)c1O ZINC000136819062 1134414641 /nfs/dbraw/zinc/41/46/41/1134414641.db2.gz UTPMLUXQIYZMQH-PWSUYJOCSA-N 1 1 298.224 3.918 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc(Br)c1O ZINC000136819062 1134414642 /nfs/dbraw/zinc/41/46/42/1134414642.db2.gz UTPMLUXQIYZMQH-PWSUYJOCSA-N 1 1 298.224 3.918 20 10 CHCDMO CCCC[C@@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217701805 1134987862 /nfs/dbraw/zinc/98/78/62/1134987862.db2.gz SCKWGDCYDFUGBC-OAHLLOKOSA-N 1 1 296.374 3.717 20 10 CHCDMO CCc1cnc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000130470782 260397194 /nfs/dbraw/zinc/39/71/94/260397194.db2.gz OMPOKYOLWVFVKU-LBPRGKRZSA-N 1 1 289.448 3.622 20 10 CHCDMO CO[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185101802 262040999 /nfs/dbraw/zinc/04/09/99/262040999.db2.gz MBRWMFRRESYQKM-SJKOYZFVSA-N 1 1 289.350 3.570 20 10 CHCDMO COC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000186034421 262076350 /nfs/dbraw/zinc/07/63/50/262076350.db2.gz HYJCWCFVHQXHNA-LRDDRELGSA-N 1 1 289.350 3.570 20 10 CHCDMO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)s1 ZINC000186766258 262109196 /nfs/dbraw/zinc/10/91/96/262109196.db2.gz AGBZONXJJQWLDU-KOLCDFICSA-N 1 1 294.395 3.751 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCCCCF)C[C@H]1CCCO1 ZINC000284050828 263085416 /nfs/dbraw/zinc/08/54/16/263085416.db2.gz JPNZILVBUKICCR-MRXNPFEDSA-N 1 1 295.398 3.513 20 10 CHCDMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cs1 ZINC000185425297 327839901 /nfs/dbraw/zinc/83/99/01/327839901.db2.gz RSRSFUPJOHGERH-VHSXEESVSA-N 1 1 294.395 3.962 20 10 CHCDMO CCCCN1CCC([NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000037149769 520577911 /nfs/dbraw/zinc/57/79/11/520577911.db2.gz BRYVEQHZYIBCPI-OAHLLOKOSA-N 1 1 290.451 3.616 20 10 CHCDMO CCOc1ccc(O)c(CNc2cc(C3CC3)cc[nH+]2)c1 ZINC000289907590 521155370 /nfs/dbraw/zinc/15/53/70/521155370.db2.gz UNNREPGNLOLWOD-UHFFFAOYSA-N 1 1 284.359 3.675 20 10 CHCDMO CCC[N@@H+](Cc1ccnc(Cl)c1)Cc1ccccc1O ZINC000068973511 521690936 /nfs/dbraw/zinc/69/09/36/521690936.db2.gz BSSIFXBYGQBEEI-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO COCc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062747813 523059851 /nfs/dbraw/zinc/05/98/51/523059851.db2.gz OZAYOJFZBOBDFZ-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062745060 524436488 /nfs/dbraw/zinc/43/64/88/524436488.db2.gz KQNXFGRHZVHRFW-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(F)cc1O ZINC000062745048 525583624 /nfs/dbraw/zinc/58/36/24/525583624.db2.gz FUEFEOJYKACQHP-MEDUHNTESA-N 1 1 271.335 3.869 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062744689 525661049 /nfs/dbraw/zinc/66/10/49/525661049.db2.gz WUQYACQROYVIBZ-VXGBXAGGSA-N 1 1 259.324 3.943 20 10 CHCDMO C[C@@]12CC[N@@H+](Cc3c(O)cccc3Cl)C[C@@H]1C2(F)F ZINC000292751287 525911677 /nfs/dbraw/zinc/91/16/77/525911677.db2.gz IMMCFQGMWZPWAS-QWHCGFSZSA-N 1 1 287.737 3.523 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000129065847 1125471969 /nfs/dbraw/zinc/47/19/69/1125471969.db2.gz LORYEGKHNWUYEZ-BEFAXECRSA-N 1 1 297.398 3.546 20 10 CHCDMO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)cc(F)c2O)C[C@H]1C ZINC000708498053 1119490717 /nfs/dbraw/zinc/49/07/17/1119490717.db2.gz WUNLZKMDWOFPKD-GIPNMCIBSA-N 1 1 269.335 3.585 20 10 CHCDMO CC[N@H+](Cc1scnc1Cl)Cc1ccccc1O ZINC001137823923 1120372606 /nfs/dbraw/zinc/37/26/06/1120372606.db2.gz SRPFNIJHVXOORN-UHFFFAOYSA-N 1 1 282.796 3.524 20 10 CHCDMO CC[N@@H+](Cc1scnc1Cl)Cc1ccccc1O ZINC001137823923 1120372610 /nfs/dbraw/zinc/37/26/10/1120372610.db2.gz SRPFNIJHVXOORN-UHFFFAOYSA-N 1 1 282.796 3.524 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH+]2C[C@H](C)[C@@H](C)C2)c1 ZINC000781908469 1120511110 /nfs/dbraw/zinc/51/11/10/1120511110.db2.gz IYQLNNBFTQMWHQ-QWRGUYRKSA-N 1 1 298.224 3.551 20 10 CHCDMO Cc1ccoc1C[N@H+](C)Cc1cc(Cl)ccc1O ZINC000814174757 1121849322 /nfs/dbraw/zinc/84/93/22/1121849322.db2.gz JHWMCVWJFJMKMM-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1cc(Cl)c(C)cc1O ZINC001179869519 1121921510 /nfs/dbraw/zinc/92/15/10/1121921510.db2.gz XLYSSKHUTJHJOO-UHFFFAOYSA-N 1 1 279.767 3.969 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@@H]2CC2(C)C)c1 ZINC001183085137 1122203487 /nfs/dbraw/zinc/20/34/87/1122203487.db2.gz VPRKMXYSMUQELY-HNNXBMFYSA-N 1 1 261.409 3.994 20 10 CHCDMO CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)c1cc(Cl)ccc1[O-] ZINC000775489395 1122620636 /nfs/dbraw/zinc/62/06/36/1122620636.db2.gz ZBDBDZAWZGFSFL-HNNXBMFYSA-N 1 1 298.858 3.817 20 10 CHCDMO CC[C@H]([NH2+]CCC[N@@H+](C)C(C)C)c1cc(Cl)ccc1[O-] ZINC000775489395 1122620637 /nfs/dbraw/zinc/62/06/37/1122620637.db2.gz ZBDBDZAWZGFSFL-HNNXBMFYSA-N 1 1 298.858 3.817 20 10 CHCDMO C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccc(F)cc1O ZINC000858536150 1123660799 /nfs/dbraw/zinc/66/07/99/1123660799.db2.gz FBZFINFYMLSAOF-LSSIXWDNSA-N 1 1 263.356 3.618 20 10 CHCDMO COCC1(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841755512 1132392399 /nfs/dbraw/zinc/39/23/99/1132392399.db2.gz HZOYDIZPJNVNHR-GFCCVEGCSA-N 1 1 297.826 3.903 20 10 CHCDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2c(O)ccc(F)c2F)CC1 ZINC001233336630 1132603129 /nfs/dbraw/zinc/60/31/29/1132603129.db2.gz TZNSFXUEKSAAIS-XYPYZODXSA-N 1 1 269.335 3.681 20 10 CHCDMO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886554857 1125690291 /nfs/dbraw/zinc/69/02/91/1125690291.db2.gz FBPIZHBJABQGCU-UWVGGRQHSA-N 1 1 292.354 3.590 20 10 CHCDMO Cc1cccnc1CCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886618514 1125697893 /nfs/dbraw/zinc/69/78/93/1125697893.db2.gz CQPRHEZGOSCJCM-ZDUSSCGKSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1c(O)cccc1F ZINC000886607551 1125696861 /nfs/dbraw/zinc/69/68/61/1125696861.db2.gz UIYBLGOWIBWZBY-XJFOESAGSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1c(O)cccc1F ZINC000886627992 1125699377 /nfs/dbraw/zinc/69/93/77/1125699377.db2.gz CAGFAGYTHGXOFY-VXGBXAGGSA-N 1 1 295.423 3.715 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1c(O)cccc1F ZINC000886640383 1125701237 /nfs/dbraw/zinc/70/12/37/1125701237.db2.gz XXOMTEZLKCGDHZ-RKDXNWHRSA-N 1 1 292.181 3.766 20 10 CHCDMO CC(C)OC1(C[NH2+][C@H](C)c2c(O)cccc2F)CCC1 ZINC000886649570 1125703072 /nfs/dbraw/zinc/70/30/72/1125703072.db2.gz DLXFUWQVBKMLJK-GFCCVEGCSA-N 1 1 281.371 3.530 20 10 CHCDMO COc1ccccc1C[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000192468317 1125768797 /nfs/dbraw/zinc/76/87/97/1125768797.db2.gz PXZMBMJQJFVRBB-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)c1cccc(O)c1 ZINC000179560943 1126829249 /nfs/dbraw/zinc/82/92/49/1126829249.db2.gz SJHVDUILQIRPFR-CYBMUJFWSA-N 1 1 271.360 3.681 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000179553517 1126829786 /nfs/dbraw/zinc/82/97/86/1126829786.db2.gz ZDPAQWOQQCQYLZ-ZDUSSCGKSA-N 1 1 259.374 3.791 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2cccs2)c1 ZINC000179713948 1126832848 /nfs/dbraw/zinc/83/28/48/1126832848.db2.gz WRMJEZSBVWIVBW-NSHDSACASA-N 1 1 277.389 3.655 20 10 CHCDMO COCCCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192678289 1126963116 /nfs/dbraw/zinc/96/31/16/1126963116.db2.gz ICHVXWNDWLQAEA-SECBINFHSA-N 1 1 292.206 3.776 20 10 CHCDMO CC[C@@H]([NH2+]CCC=C(C)C)c1ccc(F)cc1O ZINC000796967092 1130950023 /nfs/dbraw/zinc/95/00/23/1130950023.db2.gz NZMRSMVPVJZFHE-CQSZACIVSA-N 1 1 251.345 3.928 20 10 CHCDMO CC[N@@H+](CCc1cccs1)Cc1cccc(OC)c1O ZINC000271094809 1127068704 /nfs/dbraw/zinc/06/87/04/1127068704.db2.gz KPXCRIXGQZHKTD-UHFFFAOYSA-N 1 1 291.416 3.527 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)cc1 ZINC000271436412 1127082020 /nfs/dbraw/zinc/08/20/20/1127082020.db2.gz BQFCUQXAGVXDIE-DYVFJYSZSA-N 1 1 298.434 3.594 20 10 CHCDMO CSC[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000798181867 1131027947 /nfs/dbraw/zinc/02/79/47/1131027947.db2.gz AOUQHIUNKHORJN-DTWKUNHWSA-N 1 1 293.354 3.813 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCCC[C@@H](F)C2)c(O)c1 ZINC001237045003 1131040174 /nfs/dbraw/zinc/04/01/74/1131040174.db2.gz GZIPMQKDAIMAPE-OAHLLOKOSA-N 1 1 265.372 3.840 20 10 CHCDMO C[C@@H]1CCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078524 1131048194 /nfs/dbraw/zinc/04/81/94/1131048194.db2.gz UGTSRYSNWMMFJH-MRVPVSSYSA-N 1 1 260.164 3.683 20 10 CHCDMO C[C@@H]1CCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078524 1131048197 /nfs/dbraw/zinc/04/81/97/1131048197.db2.gz UGTSRYSNWMMFJH-MRVPVSSYSA-N 1 1 260.164 3.683 20 10 CHCDMO [O-]c1cc(Cl)c(F)cc1C[N@H+]1CCC[C@H](F)CC1 ZINC001237933621 1131153601 /nfs/dbraw/zinc/15/36/01/1131153601.db2.gz FBRNRZNDLXCMCP-JTQLQIEISA-N 1 1 275.726 3.509 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@H](F)CC1 ZINC001237933621 1131153606 /nfs/dbraw/zinc/15/36/06/1131153606.db2.gz FBRNRZNDLXCMCP-JTQLQIEISA-N 1 1 275.726 3.509 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@H](F)CC1 ZINC001237933621 1131153607 /nfs/dbraw/zinc/15/36/07/1131153607.db2.gz FBRNRZNDLXCMCP-JTQLQIEISA-N 1 1 275.726 3.509 20 10 CHCDMO C[N@H+](Cc1cc(F)c(Cl)cc1O)CC1CC(F)(F)C1 ZINC001237949953 1131154826 /nfs/dbraw/zinc/15/48/26/1131154826.db2.gz PGDIYZBQYOBHRC-UHFFFAOYSA-N 1 1 293.716 3.662 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccccc1)c1ccc(F)cc1O ZINC000285860707 1127245628 /nfs/dbraw/zinc/24/56/28/1127245628.db2.gz YJKNNTSXHREFKV-HNNXBMFYSA-N 1 1 259.324 3.772 20 10 CHCDMO CC[C@H]([NH2+]CC1(CCO)CCCC1)c1ccc(F)cc1O ZINC000285955921 1127248868 /nfs/dbraw/zinc/24/88/68/1127248868.db2.gz GKIQFEISQIUJGO-HNNXBMFYSA-N 1 1 295.398 3.515 20 10 CHCDMO CC[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000286107472 1127258953 /nfs/dbraw/zinc/25/89/53/1127258953.db2.gz MYRTWMXECQMXCG-HIFRSBDPSA-N 1 1 281.371 3.531 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(F)cc1O ZINC000286290615 1127264691 /nfs/dbraw/zinc/26/46/91/1127264691.db2.gz WMQOTEXNUSGKTN-CQSZACIVSA-N 1 1 294.757 3.821 20 10 CHCDMO C[C@H](c1ccccn1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293558097 1127505457 /nfs/dbraw/zinc/50/54/57/1127505457.db2.gz HTCAVWIIGRCXOP-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293558097 1127505459 /nfs/dbraw/zinc/50/54/59/1127505459.db2.gz HTCAVWIIGRCXOP-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccncc1 ZINC000293630690 1127510027 /nfs/dbraw/zinc/51/00/27/1127510027.db2.gz NDSFJLABPAIYPJ-AWEZNQCLSA-N 1 1 294.757 3.821 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@H](C)c2ccccn2)ccc1N(C)C ZINC000293771702 1127519308 /nfs/dbraw/zinc/51/93/08/1127519308.db2.gz KYWRPFSXLYWHIY-OAHLLOKOSA-N 1 1 283.419 3.649 20 10 CHCDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1O ZINC000295094376 1127619383 /nfs/dbraw/zinc/61/93/83/1127619383.db2.gz UFQDSKBQSVPTJX-ZYHUDNBSSA-N 1 1 273.298 3.555 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121184 1127650929 /nfs/dbraw/zinc/65/09/29/1127650929.db2.gz WEZAQJGVAMVYNT-ZWNOBZJWSA-N 1 1 283.799 3.817 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)C[C@@H]2CC2(C)C)cc1Cl ZINC001232270084 1127653951 /nfs/dbraw/zinc/65/39/51/1127653951.db2.gz SMNDOAHVNJXPEE-NSHDSACASA-N 1 1 283.799 3.532 20 10 CHCDMO Cc1cccnc1CCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000296603990 1127677741 /nfs/dbraw/zinc/67/77/41/1127677741.db2.gz VVEICMVJQPVDSP-CYBMUJFWSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccccc1O ZINC000171926035 1127734254 /nfs/dbraw/zinc/73/42/54/1127734254.db2.gz UXTAPLCSMNYPCO-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@H]([NH2+]CCc1cccc(F)c1)c1ccc(F)cc1O ZINC000062745902 1127772660 /nfs/dbraw/zinc/77/26/60/1127772660.db2.gz OOFGSEOSSDYEMG-NSHDSACASA-N 1 1 277.314 3.564 20 10 CHCDMO Cc1cccc(CC[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062748443 1127773762 /nfs/dbraw/zinc/77/37/62/1127773762.db2.gz UNHNIDFZDMPVHJ-ZDUSSCGKSA-N 1 1 273.351 3.733 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCc2cccs2)cc1C ZINC000173407835 1127828389 /nfs/dbraw/zinc/82/83/89/1127828389.db2.gz UMTBXYDDVXHQQE-UHFFFAOYSA-N 1 1 275.417 3.745 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000373223215 1127829387 /nfs/dbraw/zinc/82/93/87/1127829387.db2.gz HFDOXKRDGIHTHR-OAHLLOKOSA-N 1 1 289.400 3.799 20 10 CHCDMO C[C@@H]1CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934219 1129222154 /nfs/dbraw/zinc/22/21/54/1129222154.db2.gz JBJVKPNBHXDHCY-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934219 1129222156 /nfs/dbraw/zinc/22/21/56/1129222156.db2.gz JBJVKPNBHXDHCY-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCC[C@H]3C)c2c1 ZINC000173528248 1127837569 /nfs/dbraw/zinc/83/75/69/1127837569.db2.gz JVUBXBASRXJYBX-GFCCVEGCSA-N 1 1 271.360 3.538 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(O)(CC)CC)cc1 ZINC000777540089 1128117932 /nfs/dbraw/zinc/11/79/32/1128117932.db2.gz FZCWXJLDBZOTOY-UHFFFAOYSA-N 1 1 292.467 3.516 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000762379062 1128295050 /nfs/dbraw/zinc/29/50/50/1128295050.db2.gz ZNCYJSNANVJVMR-UHFFFAOYSA-N 1 1 258.409 3.660 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1F ZINC000777967749 1128352637 /nfs/dbraw/zinc/35/26/37/1128352637.db2.gz ZAMAMLSNMCDXTO-FZMZJTMJSA-N 1 1 295.398 3.575 20 10 CHCDMO C[N@@H+](CCc1ccccc1Cl)Cc1ccc(N)cc1 ZINC001235839255 1128366244 /nfs/dbraw/zinc/36/62/44/1128366244.db2.gz PLRYOJZCTXRUPI-UHFFFAOYSA-N 1 1 274.795 3.597 20 10 CHCDMO CC(C)[N@@H+](C/C=C\Cl)Cc1ccc(N(C)C)cc1 ZINC000917075052 1128474869 /nfs/dbraw/zinc/47/48/69/1128474869.db2.gz OWUKENIXAKNXNJ-YHYXMXQVSA-N 1 1 266.816 3.716 20 10 CHCDMO CCN(CC)c1ccc(CNc2cc(C)[nH+]c(C)n2)cc1 ZINC000917085328 1128477281 /nfs/dbraw/zinc/47/72/81/1128477281.db2.gz IMSWFUREDXOKHF-UHFFFAOYSA-N 1 1 284.407 3.552 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000245865026 1129230351 /nfs/dbraw/zinc/23/03/51/1129230351.db2.gz PSEQHFQVZRPVKW-XJKCOSOUSA-N 1 1 275.392 3.554 20 10 CHCDMO CC[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccccc1O ZINC000155868751 1128617008 /nfs/dbraw/zinc/61/70/08/1128617008.db2.gz ZELQKZIZXMCOMW-DOTOQJQBSA-N 1 1 292.467 3.799 20 10 CHCDMO CCc1cc(C[N@@H+](C)CCCOC)c(O)c(C(C)(C)C)c1 ZINC000921187392 1128702352 /nfs/dbraw/zinc/70/23/52/1128702352.db2.gz PBTZZYTWCLVGBY-UHFFFAOYSA-N 1 1 293.451 3.720 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCc3ccccc3C2)c1O ZINC000317112007 1117744971 /nfs/dbraw/zinc/74/49/71/1117744971.db2.gz RGEKJNCXEYJDIK-UHFFFAOYSA-N 1 1 297.398 3.739 20 10 CHCDMO CCO[C@@H](CC[NH2+][C@H](C)c1ccc(F)cc1O)C(C)C ZINC000185625468 1117859560 /nfs/dbraw/zinc/85/95/60/1117859560.db2.gz AQTUKKRXSNAEAO-WBMJQRKESA-N 1 1 283.387 3.633 20 10 CHCDMO Cc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)c(F)cc1O ZINC001206855258 1118066077 /nfs/dbraw/zinc/06/60/77/1118066077.db2.gz FSGSKCWJFAMUBJ-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](C)CC(F)F)c1ccc(F)cc1O ZINC000842892330 1118159102 /nfs/dbraw/zinc/15/91/02/1118159102.db2.gz AYRJCWUZAQCUCA-SKDRFNHKSA-N 1 1 275.314 3.863 20 10 CHCDMO CC(C)OC1CCC([NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000186160172 1118204181 /nfs/dbraw/zinc/20/41/81/1118204181.db2.gz JHNZFNZFLNEBAU-LRVUVFPRSA-N 1 1 295.398 3.918 20 10 CHCDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cc(Cl)c(F)cc1[O-] ZINC001652675027 1118274198 /nfs/dbraw/zinc/27/41/98/1118274198.db2.gz WSTHKIPFUVVQQE-SECBINFHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC001652675027 1118274199 /nfs/dbraw/zinc/27/41/99/1118274199.db2.gz WSTHKIPFUVVQQE-SECBINFHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC001652675027 1118274203 /nfs/dbraw/zinc/27/42/03/1118274203.db2.gz WSTHKIPFUVVQQE-SECBINFHSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C(F)F ZINC000834827732 1118576110 /nfs/dbraw/zinc/57/61/10/1118576110.db2.gz LEPHXYCCZZYRNQ-JEZHCXPESA-N 1 1 273.298 3.713 20 10 CHCDMO CC[C@H](C)C[N@H+](CC)Cc1cc(F)cc(C(C)=O)c1O ZINC000093251805 1118593724 /nfs/dbraw/zinc/59/37/24/1118593724.db2.gz WMBHZYMOWUYRKP-NSHDSACASA-N 1 1 281.371 3.602 20 10 CHCDMO CC[C@H](C)C[N@@H+](CC)Cc1cc(F)cc(C(C)=O)c1O ZINC000093251805 1118593725 /nfs/dbraw/zinc/59/37/25/1118593725.db2.gz WMBHZYMOWUYRKP-NSHDSACASA-N 1 1 281.371 3.602 20 10 CHCDMO C[C@H]([NH2+]CCOCC1CCCC1)c1cc(F)cc(F)c1O ZINC000834908238 1118627513 /nfs/dbraw/zinc/62/75/13/1118627513.db2.gz CMDQVNAWLVPIFZ-NSHDSACASA-N 1 1 299.361 3.528 20 10 CHCDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707146234 1118648377 /nfs/dbraw/zinc/64/83/77/1118648377.db2.gz KLNFQHYYTWAKHP-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)c1O ZINC000180531253 1128795581 /nfs/dbraw/zinc/79/55/81/1128795581.db2.gz CDWKZGVMHGSWQV-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)c1O ZINC000180531253 1128795585 /nfs/dbraw/zinc/79/55/85/1128795585.db2.gz CDWKZGVMHGSWQV-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO Cc1cccc2c1C[N@H+](Cc1ccc(Cl)cc1O)C2 ZINC001140460985 1118718894 /nfs/dbraw/zinc/71/88/94/1118718894.db2.gz AHASTUPHCZOHHJ-UHFFFAOYSA-N 1 1 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1121021420 /nfs/dbraw/zinc/02/14/20/1121021420.db2.gz HIINGIUJFWQPMW-MLGOLLRUSA-N 1 1 293.382 3.531 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCSC[C@H]2C(C)(C)C)cc1 ZINC001175697397 1121416861 /nfs/dbraw/zinc/41/68/61/1121416861.db2.gz CKWWOOCLJHQWEZ-INIZCTEOSA-N 1 1 292.492 3.716 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2cccs2)cc1 ZINC000773732497 1121774112 /nfs/dbraw/zinc/77/41/12/1121774112.db2.gz CEMDREQZBKAZBH-UHFFFAOYSA-N 1 1 274.433 3.836 20 10 CHCDMO C[C@H]1CC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001178624225 1121799874 /nfs/dbraw/zinc/79/98/74/1121799874.db2.gz KFDSAQFZNAHIBH-VHSXEESVSA-N 1 1 271.763 3.711 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1F ZINC001203357002 1121806817 /nfs/dbraw/zinc/80/68/17/1121806817.db2.gz CHOOQVDWINRUNH-UHFFFAOYSA-N 1 1 286.394 3.914 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001179863575 1121921914 /nfs/dbraw/zinc/92/19/14/1121921914.db2.gz PMPSOVFHVQGDGL-BIENSFFJSA-N 1 1 258.409 3.640 20 10 CHCDMO C[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC001180198580 1121965408 /nfs/dbraw/zinc/96/54/08/1121965408.db2.gz DWXFECKJFCCYCM-NXEZZACHSA-N 1 1 271.763 3.663 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC001180198580 1121965413 /nfs/dbraw/zinc/96/54/13/1121965413.db2.gz DWXFECKJFCCYCM-NXEZZACHSA-N 1 1 271.763 3.663 20 10 CHCDMO C[C@@H]([NH2+]CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000192645973 1129022683 /nfs/dbraw/zinc/02/26/83/1129022683.db2.gz OXMWJIGZVIYFMF-SSDOTTSWSA-N 1 1 260.164 3.760 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000773856605 1121984435 /nfs/dbraw/zinc/98/44/35/1121984435.db2.gz JKUCNESYNJRRNN-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO Cc1nnc([C@@H](C)[NH2+]Cc2cc(C(C)C)ccc2O)s1 ZINC001180687276 1122008433 /nfs/dbraw/zinc/00/84/33/1122008433.db2.gz OQPWTTGTFMAETJ-SNVBAGLBSA-N 1 1 291.420 3.526 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC001181284488 1122045845 /nfs/dbraw/zinc/04/58/45/1122045845.db2.gz BERBBVLOBQAXTI-UHFFFAOYSA-N 1 1 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ZINC001183455744 1122224757 /nfs/dbraw/zinc/22/47/57/1122224757.db2.gz XQMNDIYQFUJNSN-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(F)cc1O ZINC000273528124 1122237697 /nfs/dbraw/zinc/23/76/97/1122237697.db2.gz VVBMXAJOQJMKTF-NORZTCDRSA-N 1 1 295.398 3.776 20 10 CHCDMO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2c(O)cccc2F)C1 ZINC001183920345 1122248440 /nfs/dbraw/zinc/24/84/40/1122248440.db2.gz XBHPSYVFIZGSJW-CHWSQXEVSA-N 1 1 265.372 3.837 20 10 CHCDMO C[C@@H]([NH2+]CCCF)c1cc(Cl)c(Cl)cc1O ZINC000193027973 1129051710 /nfs/dbraw/zinc/05/17/10/1129051710.db2.gz HOBGZINUEXQETO-SSDOTTSWSA-N 1 1 266.143 3.709 20 10 CHCDMO CCOc1ccc(C[N@@H+](CC2CCC2)C(C)C)c(O)c1 ZINC000775175389 1122466317 /nfs/dbraw/zinc/46/63/17/1122466317.db2.gz FBOVKUSARGJGBP-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC2CCC2)C(C)C)c1 ZINC000775179373 1122467522 /nfs/dbraw/zinc/46/75/22/1122467522.db2.gz YRUZPVTYROWEDJ-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001191068040 1122568474 /nfs/dbraw/zinc/56/84/74/1122568474.db2.gz AIMOLYJGAOLHCH-HUUCEWRRSA-N 1 1 260.425 3.763 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]1C ZINC001193603174 1122705147 /nfs/dbraw/zinc/70/51/47/1122705147.db2.gz AOLPRNGGXBKFML-GDBMZVCRSA-N 1 1 260.425 3.681 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccccc2C)C2CC2)c1 ZINC000775649991 1122864968 /nfs/dbraw/zinc/86/49/68/1122864968.db2.gz VYKSTTAUPXYYGX-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO Cc1cccc(C[N@H+](C)C[C@H](C)c2ccccc2)c1O ZINC000775678175 1122900811 /nfs/dbraw/zinc/90/08/11/1122900811.db2.gz BESDXDMUBUYFSA-HNNXBMFYSA-N 1 1 269.388 3.936 20 10 CHCDMO Cc1cccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1O ZINC000775679295 1122901105 /nfs/dbraw/zinc/90/11/05/1122901105.db2.gz VTBMSPGXHUFOOA-SFHVURJKSA-N 1 1 297.398 3.664 20 10 CHCDMO Cc1cccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c1O ZINC000775698214 1122912110 /nfs/dbraw/zinc/91/21/10/1122912110.db2.gz MBSJRMMZLLUWDH-KRWDZBQOSA-N 1 1 299.439 3.991 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)CCS1 ZINC000775702312 1122914345 /nfs/dbraw/zinc/91/43/45/1122914345.db2.gz OQPYGBGLQUAGIN-ZDUSSCGKSA-N 1 1 285.840 3.681 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1 ZINC000775702330 1122914357 /nfs/dbraw/zinc/91/43/57/1122914357.db2.gz QAIALTXJPQFYDL-GDBMZVCRSA-N 1 1 297.398 3.779 20 10 CHCDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cc(OC)ccc1O ZINC000775732054 1122929183 /nfs/dbraw/zinc/92/91/83/1122929183.db2.gz LORGETNJVBQSEM-CJNGLKHVSA-N 1 1 277.408 3.801 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CCCOC2)cc1C(C)C ZINC000107671978 1123225478 /nfs/dbraw/zinc/22/54/78/1123225478.db2.gz BUIPCDCQXWGIOZ-OAHLLOKOSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(F)cc1O ZINC000850482267 1123273079 /nfs/dbraw/zinc/27/30/79/1123273079.db2.gz NDGYAKIBBMJZKX-IUODEOHRSA-N 1 1 288.366 3.771 20 10 CHCDMO CSCC1(CC[NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000850506101 1123275922 /nfs/dbraw/zinc/27/59/22/1123275922.db2.gz FOOFDYNZIRYZJQ-NSHDSACASA-N 1 1 283.412 3.715 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(F)cc1O ZINC000850511826 1123278291 /nfs/dbraw/zinc/27/82/91/1123278291.db2.gz NYMSIYLOIVXHAS-CABZTGNLSA-N 1 1 280.368 3.790 20 10 CHCDMO CCSC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000850553174 1123290092 /nfs/dbraw/zinc/29/00/92/1123290092.db2.gz TTZYDSHASILIEB-SNVBAGLBSA-N 1 1 285.840 3.982 20 10 CHCDMO C[C@@H]([NH2+]CCCc1ccco1)c1ccc(Cl)cc1O ZINC000850569690 1123293989 /nfs/dbraw/zinc/29/39/89/1123293989.db2.gz MPRCDLDXVRVPFO-LLVKDONJSA-N 1 1 279.767 3.922 20 10 CHCDMO CC[N@@H+](Cc1cc(C2CC2)no1)Cc1ccc(N(C)C)cc1 ZINC000851721712 1123374691 /nfs/dbraw/zinc/37/46/91/1123374691.db2.gz PKESGKAYAQDFMF-UHFFFAOYSA-N 1 1 299.418 3.640 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2ccccc2O)c1Cl ZINC000851841472 1123384324 /nfs/dbraw/zinc/38/43/24/1123384324.db2.gz SQOOHBPQQZYSEM-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[N@@H+](CCSc1ccccc1F)Cc1ccccc1O ZINC000111235745 1123432215 /nfs/dbraw/zinc/43/22/15/1123432215.db2.gz ZKVKSFAVZTVMNB-UHFFFAOYSA-N 1 1 291.391 3.755 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]3C[C@@H]3C2)cc1C(C)C ZINC000853581077 1123444142 /nfs/dbraw/zinc/44/41/42/1123444142.db2.gz RRGYBTXSDXGJGR-ZIAGYGMSSA-N 1 1 259.393 3.666 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848597 1123521471 /nfs/dbraw/zinc/52/14/71/1123521471.db2.gz SEKLUKUBRXQVRZ-QAPCUYQASA-N 1 1 297.398 3.546 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000194155205 1129131072 /nfs/dbraw/zinc/13/10/72/1129131072.db2.gz WFMYSGLJMLICFC-ZDUSSCGKSA-N 1 1 286.341 3.527 20 10 CHCDMO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000857082698 1123585775 /nfs/dbraw/zinc/58/57/75/1123585775.db2.gz XAZKRQQEIJFKAM-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)CC2CCCC2)c1O ZINC000228631248 1123634645 /nfs/dbraw/zinc/63/46/45/1123634645.db2.gz LHMYCYVFXDZCCK-UHFFFAOYSA-N 1 1 283.799 3.676 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CCCC3(CCCC3)C2)c1O ZINC000783543232 1123635782 /nfs/dbraw/zinc/63/57/82/1123635782.db2.gz CKOHBWQAIUWFBF-UHFFFAOYSA-N 1 1 289.419 3.865 20 10 CHCDMO CCC[C@H](C[NH2+][C@H](CC)c1ccc(F)cc1O)OCC ZINC000858451092 1123655339 /nfs/dbraw/zinc/65/53/39/1123655339.db2.gz NBXJVCRWLMTJOY-UKRRQHHQSA-N 1 1 283.387 3.777 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC(F)(F)C[C@H]2C)cc1 ZINC000859837235 1123713464 /nfs/dbraw/zinc/71/34/64/1123713464.db2.gz FLZGINIRRXIGKE-CYBMUJFWSA-N 1 1 282.378 3.762 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCc2c(C)cc(C)cc2C1 ZINC000777219545 1123784439 /nfs/dbraw/zinc/78/44/39/1123784439.db2.gz LPTIWNYACAFNRV-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO CC(C)[N@@H+](Cc1c(O)cccc1Br)C1CC1 ZINC000862223110 1123793391 /nfs/dbraw/zinc/79/33/91/1123793391.db2.gz NZJQJSITYCWSDC-UHFFFAOYSA-N 1 1 284.197 3.528 20 10 CHCDMO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3cncn3c2)c(O)c1 ZINC000840780997 1123796172 /nfs/dbraw/zinc/79/61/72/1123796172.db2.gz XQBDUQGCBUBWEQ-AWEZNQCLSA-N 1 1 295.386 3.508 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC3(CC3)CC2)c1 ZINC000862539286 1123818549 /nfs/dbraw/zinc/81/85/49/1123818549.db2.gz LNWTWFQKZSEYLT-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO C[N@H+](CCCc1c(F)cccc1F)c1ccc(N)cc1 ZINC000863558780 1123875334 /nfs/dbraw/zinc/87/53/34/1123875334.db2.gz XJRQLKVXICHVTO-UHFFFAOYSA-N 1 1 276.330 3.616 20 10 CHCDMO C[N@@H+](CCCc1c(F)cccc1F)c1ccc(N)cc1 ZINC000863558780 1123875336 /nfs/dbraw/zinc/87/53/36/1123875336.db2.gz XJRQLKVXICHVTO-UHFFFAOYSA-N 1 1 276.330 3.616 20 10 CHCDMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccc(C)cc1O ZINC000794819153 1123960504 /nfs/dbraw/zinc/96/05/04/1123960504.db2.gz YAQLFPNLQAXGRD-AWEZNQCLSA-N 1 1 256.349 3.967 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NC[C@@H](C)[NH+](CC)CC)cc1 ZINC000794828566 1123962466 /nfs/dbraw/zinc/96/24/66/1123962466.db2.gz CCHBHNRAXXKJJQ-CVEARBPZSA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000783593273 1123998360 /nfs/dbraw/zinc/99/83/60/1123998360.db2.gz OVPWXOLRKLXXNO-NUEKZKHPSA-N 1 1 259.393 3.711 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCCO1)c1ccc(F)cc1O ZINC000866491203 1124072665 /nfs/dbraw/zinc/07/26/65/1124072665.db2.gz NKJLSIULAKYXNE-YMRXKLBXSA-N 1 1 293.382 3.530 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)CC1(OC)CCC1 ZINC001119234814 1131247586 /nfs/dbraw/zinc/24/75/86/1131247586.db2.gz FVXDCCVKRASZEQ-UHFFFAOYSA-N 1 1 277.408 3.563 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1c[nH]c3c1cccc3F)CC2 ZINC001137059047 1124710014 /nfs/dbraw/zinc/71/00/14/1124710014.db2.gz KJFSCZLZRBQALB-UHFFFAOYSA-N 1 1 296.345 3.571 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(C)cc2O)s1 ZINC000876716325 1124973826 /nfs/dbraw/zinc/97/38/26/1124973826.db2.gz YLYJFSSNHUWSCJ-LBPRGKRZSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c(C)cccc2O)n1 ZINC000876741346 1124975477 /nfs/dbraw/zinc/97/54/77/1124975477.db2.gz SXICKBWIVAUTJJ-KRWDZBQOSA-N 1 1 282.387 3.741 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000877702939 1125066164 /nfs/dbraw/zinc/06/61/64/1125066164.db2.gz KTIPRJGJFWGSKN-UHFFFAOYSA-N 1 1 275.298 3.846 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127366871 1125087122 /nfs/dbraw/zinc/08/71/22/1125087122.db2.gz DWOKBXJRZUDSGC-CQSZACIVSA-N 1 1 276.767 3.711 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000211442694 1125306159 /nfs/dbraw/zinc/30/61/59/1125306159.db2.gz MTUKZRQVZJZBKJ-FZMZJTMJSA-N 1 1 265.784 3.810 20 10 CHCDMO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)o1 ZINC000882903820 1125361279 /nfs/dbraw/zinc/36/12/79/1125361279.db2.gz KKZLPNCKDXWDNS-TVQRCGJNSA-N 1 1 293.313 3.677 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130667425 1125366152 /nfs/dbraw/zinc/36/61/52/1125366152.db2.gz CZCYRQQWZGTWTL-HNAYVOBHSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCc3ccsc3C2)c1 ZINC000132545044 1125419194 /nfs/dbraw/zinc/41/91/94/1125419194.db2.gz FBDNDLBJTVWJAN-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC000132751604 1125421011 /nfs/dbraw/zinc/42/10/11/1125421011.db2.gz ZMLPMQOHLDRREK-DZGCQCFKSA-N 1 1 277.408 3.801 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccc(C)n2)cc1 ZINC000736946181 1129382048 /nfs/dbraw/zinc/38/20/48/1129382048.db2.gz WTRNIQWGGNMBCK-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO CCC[N@@H+](Cc1ccc(COC)cc1)Cc1ccccc1O ZINC000092704986 1129404981 /nfs/dbraw/zinc/40/49/81/1129404981.db2.gz RDAXZPWCLWPXGL-UHFFFAOYSA-N 1 1 299.414 3.951 20 10 CHCDMO CO[C@@H](C)C[N@@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000795752560 1129446825 /nfs/dbraw/zinc/44/68/25/1129446825.db2.gz UGABURQZTGOABX-LBPRGKRZSA-N 1 1 299.370 3.758 20 10 CHCDMO C[N@@H+](Cc1cc(Br)ccc1[O-])C1(C)CCCC1 ZINC000720385561 1129525584 /nfs/dbraw/zinc/52/55/84/1129525584.db2.gz CPDGVTFGGWBVLU-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO C[N@H+](Cc1cc(Br)ccc1O)C1(C)CCCC1 ZINC000720385561 1129525587 /nfs/dbraw/zinc/52/55/87/1129525587.db2.gz CPDGVTFGGWBVLU-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO C[N@@H+](Cc1cc(Br)ccc1O)C1(C)CCCC1 ZINC000720385561 1129525590 /nfs/dbraw/zinc/52/55/90/1129525590.db2.gz CPDGVTFGGWBVLU-UHFFFAOYSA-N 1 1 298.224 3.919 20 10 CHCDMO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc(F)cc1O ZINC000720911724 1129720033 /nfs/dbraw/zinc/72/00/33/1129720033.db2.gz LNIAQJQYOUNYPJ-VIFPVBQESA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]C1CC=CC1)c1cccc(C(F)(F)F)c1O ZINC000798181456 1129827701 /nfs/dbraw/zinc/82/77/01/1129827701.db2.gz KJMXBRQHSRLWOP-SECBINFHSA-N 1 1 271.282 3.780 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)C2CCCCC2)c(O)c1 ZINC000768139631 1129836978 /nfs/dbraw/zinc/83/69/78/1129836978.db2.gz VGOIZLIBKQWLKL-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000768195585 1129843007 /nfs/dbraw/zinc/84/30/07/1129843007.db2.gz NVPACNUIENRQEI-AWEZNQCLSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000768226760 1129843681 /nfs/dbraw/zinc/84/36/81/1129843681.db2.gz CEVHSVFSBRIYCY-INIZCTEOSA-N 1 1 297.398 3.608 20 10 CHCDMO CCOc1ccc(C[N@@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC000768231811 1129845305 /nfs/dbraw/zinc/84/53/05/1129845305.db2.gz YXIFISRCARTMMV-UHFFFAOYSA-N 1 1 297.398 3.956 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1cc(F)cc(F)c1O ZINC000768271543 1129848073 /nfs/dbraw/zinc/84/80/73/1129848073.db2.gz MFBGDYLWUUPTFN-NKWVEPMBSA-N 1 1 283.240 3.662 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000768336965 1129851396 /nfs/dbraw/zinc/85/13/96/1129851396.db2.gz DRTPNNYHTUXCJX-UHFFFAOYSA-N 1 1 259.393 3.998 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(O)cc1C ZINC000768439397 1129856766 /nfs/dbraw/zinc/85/67/66/1129856766.db2.gz LFAQBMQBQMXPTB-MRXNPFEDSA-N 1 1 283.371 3.656 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c(O)cc1C ZINC000768442719 1129857833 /nfs/dbraw/zinc/85/78/33/1129857833.db2.gz ZJYVLOKHWMICPL-IUODEOHRSA-N 1 1 277.408 3.720 20 10 CHCDMO CC(C)C[N@@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000768532920 1129861124 /nfs/dbraw/zinc/86/11/24/1129861124.db2.gz QYWKHCBSXPPXBN-UHFFFAOYSA-N 1 1 264.388 3.512 20 10 CHCDMO COc1ccc(CCC[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768920350 1129881496 /nfs/dbraw/zinc/88/14/96/1129881496.db2.gz LWFPGPUWLSNGDK-UHFFFAOYSA-N 1 1 299.414 3.774 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](CC)C[C@@H]2CCCO2)cc1 ZINC000769027990 1129886640 /nfs/dbraw/zinc/88/66/40/1129886640.db2.gz BXALROVGZJIBDB-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO COc1cccc(C[N@@H+](C)CCC2CCCCC2)c1O ZINC000769245461 1129898855 /nfs/dbraw/zinc/89/88/55/1129898855.db2.gz SKFMIHDXPMBLTE-UHFFFAOYSA-N 1 1 277.408 3.803 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2C(C)(C)C)c1 ZINC000769313471 1129901607 /nfs/dbraw/zinc/90/16/07/1129901607.db2.gz NXNFBIPLJGRMCC-INIZCTEOSA-N 1 1 277.408 3.801 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCc2ccccc2[C@H]1C ZINC000769354020 1129904386 /nfs/dbraw/zinc/90/43/86/1129904386.db2.gz ZCVGPVKLNJTDGO-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000769399096 1129906055 /nfs/dbraw/zinc/90/60/55/1129906055.db2.gz VSRDCUVQPDRLSR-HNNXBMFYSA-N 1 1 285.362 3.829 20 10 CHCDMO CCOc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c(O)c1 ZINC000769403296 1129907099 /nfs/dbraw/zinc/90/70/99/1129907099.db2.gz BUHGTQJVKLJULG-CKEIUWERSA-N 1 1 289.419 3.944 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000769404219 1129907154 /nfs/dbraw/zinc/90/71/54/1129907154.db2.gz KTDDPUSNTSQNNS-IIAWOOMASA-N 1 1 259.393 3.854 20 10 CHCDMO C[C@H]1OCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H]1C ZINC000769422004 1129907309 /nfs/dbraw/zinc/90/73/09/1129907309.db2.gz DZBTYNLANJJTIA-LSDHHAIUSA-N 1 1 297.398 3.668 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1 ZINC000769483817 1129909464 /nfs/dbraw/zinc/90/94/64/1129909464.db2.gz SHMYDLXDEMEXEH-AWEZNQCLSA-N 1 1 297.398 3.738 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@@H]1C ZINC000769487680 1129909783 /nfs/dbraw/zinc/90/97/83/1129909783.db2.gz KVBPPNUHAISCFE-HOCLYGCPSA-N 1 1 260.425 3.619 20 10 CHCDMO C[C@@H]1COCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769458225 1129911859 /nfs/dbraw/zinc/91/18/59/1129911859.db2.gz YXXNXEXMVILISQ-HNNXBMFYSA-N 1 1 297.398 3.528 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC000769497901 1129914239 /nfs/dbraw/zinc/91/42/39/1129914239.db2.gz HKFRSBXKSDUNBY-IAGOWNOFSA-N 1 1 290.476 3.613 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H]2Cc2ccccc2)cc1 ZINC000769506804 1129914674 /nfs/dbraw/zinc/91/46/74/1129914674.db2.gz WTSWNFBXRPGWJN-IBGZPJMESA-N 1 1 280.415 3.570 20 10 CHCDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cccc(OC)c1O ZINC000769537596 1129916513 /nfs/dbraw/zinc/91/65/13/1129916513.db2.gz MSRKAEYMFXUEEJ-DZGCQCFKSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H]1C ZINC000770283060 1129942967 /nfs/dbraw/zinc/94/29/67/1129942967.db2.gz IEXVWJUGEKJLFR-HZPDHXFCSA-N 1 1 272.436 3.907 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1O ZINC000770509821 1129948662 /nfs/dbraw/zinc/94/86/62/1129948662.db2.gz ULQBFMZYIONTJU-UHFFFAOYSA-N 1 1 273.351 3.942 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](OC)c1ccccc1 ZINC000801925279 1129960011 /nfs/dbraw/zinc/96/00/11/1129960011.db2.gz KSMJBOGVZHMORX-IBGZPJMESA-N 1 1 299.414 3.992 20 10 CHCDMO CC[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc(F)cc1O ZINC000903281776 1130145017 /nfs/dbraw/zinc/14/50/17/1130145017.db2.gz IAYSWDWINOGDHE-DJBJLQPQSA-N 1 1 293.382 3.530 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cncs1)c1ccc(F)cc1O ZINC000903309345 1130151147 /nfs/dbraw/zinc/15/11/47/1130151147.db2.gz DQRVRTBBOVQVPS-CABZTGNLSA-N 1 1 280.368 3.790 20 10 CHCDMO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(F)cc1O ZINC000903334808 1130160843 /nfs/dbraw/zinc/16/08/43/1130160843.db2.gz GOZXAJLNKYXCQU-GTNSWQLSSA-N 1 1 286.350 3.728 20 10 CHCDMO C[C@H]1C[C@H]1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444038 1130186935 /nfs/dbraw/zinc/18/69/35/1130186935.db2.gz WOYVJIFKGLJCDY-ZFWWWQNUSA-N 1 1 271.360 3.643 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788806989 1130210117 /nfs/dbraw/zinc/21/01/17/1130210117.db2.gz RAIDYMSIHLKDRC-DTWKUNHWSA-N 1 1 291.338 3.567 20 10 CHCDMO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1cccc(F)c1O ZINC000903948208 1130211896 /nfs/dbraw/zinc/21/18/96/1130211896.db2.gz NKZUJFLVHMYXHC-INIZCTEOSA-N 1 1 286.350 3.566 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CC[C@@H](C)O2)cc1 ZINC000789307254 1130242422 /nfs/dbraw/zinc/24/24/22/1130242422.db2.gz VGIIASMZLPQVJC-CRAIPNDOSA-N 1 1 290.451 3.532 20 10 CHCDMO Cn1ccc2c1cc[nH+]c2-c1ccc(C(F)(F)F)nc1 ZINC001240264114 1130251522 /nfs/dbraw/zinc/25/15/22/1130251522.db2.gz KEAGOLHZKZHSLU-UHFFFAOYSA-N 1 1 277.249 3.654 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCSC(C)(C)CC2)c(O)c1 ZINC000789762934 1130275440 /nfs/dbraw/zinc/27/54/40/1130275440.db2.gz BQCIRQQVFZGPEG-UHFFFAOYSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2cscn2)cc1Cl ZINC000826972638 1130321691 /nfs/dbraw/zinc/32/16/91/1130321691.db2.gz JHFCFAAEFFHLJN-VIFPVBQESA-N 1 1 282.796 3.661 20 10 CHCDMO 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/nfs/dbraw/zinc/87/36/91/1130873691.db2.gz NPTLCPDDHADPTF-KRWDZBQOSA-N 1 1 298.430 3.509 20 10 CHCDMO COc1cccc([C@@H]2CCC[N@@H+](Cc3ccc(N)cc3)C2)c1 ZINC001236335670 1130915478 /nfs/dbraw/zinc/91/54/78/1130915478.db2.gz QTLXQPXAXGUABC-QGZVFWFLSA-N 1 1 296.414 3.657 20 10 CHCDMO CC[C@@H]([NH2+]CCc1cccs1)c1ccc(F)cc1O ZINC000796670210 1130922431 /nfs/dbraw/zinc/92/24/31/1130922431.db2.gz BVIGCNSAXDIPMM-CQSZACIVSA-N 1 1 279.380 3.876 20 10 CHCDMO CC[C@@H]([NH2+]CCc1cccc(F)c1)c1ccc(F)cc1O ZINC000796677855 1130923963 /nfs/dbraw/zinc/92/39/63/1130923963.db2.gz XKLZSTCSVRUFJI-MRXNPFEDSA-N 1 1 291.341 3.954 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc(F)cc1O ZINC000796753828 1130928356 /nfs/dbraw/zinc/92/83/56/1130928356.db2.gz NQXRNLMPDKIALN-WBVHZDCISA-N 1 1 295.398 3.513 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc(F)cc1O ZINC000796744718 1130928392 /nfs/dbraw/zinc/92/83/92/1130928392.db2.gz ASGXKMGAOBGGCP-SUMWQHHRSA-N 1 1 285.362 3.912 20 10 CHCDMO CC[C@@H]([NH2+]CCNc1ccccc1)c1ccc(F)cc1O ZINC000796793590 1130933020 /nfs/dbraw/zinc/93/30/20/1130933020.db2.gz OJDRYSDTAJGKKB-MRXNPFEDSA-N 1 1 288.366 3.684 20 10 CHCDMO CC[C@@H]([NH2+]C1CCC(O)(CC)CC1)c1ccc(F)cc1O ZINC000796796224 1130933138 /nfs/dbraw/zinc/93/31/38/1130933138.db2.gz CGAHWINHOZTPAT-GNHJJJEISA-N 1 1 295.398 3.656 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)c1ccc(F)cc1O)[C@@H]1CCCO1 ZINC000796850403 1130938889 /nfs/dbraw/zinc/93/88/89/1130938889.db2.gz ZNYNRFTUDUBPPV-LZWOXQAQSA-N 1 1 281.371 3.530 20 10 CHCDMO CN(C)c1ccc(CNc2cccc(C3CC3)[nH+]2)cc1 ZINC000815144378 1130966525 /nfs/dbraw/zinc/96/65/25/1130966525.db2.gz YSKDJWAWYBTUEN-UHFFFAOYSA-N 1 1 267.376 3.637 20 10 CHCDMO CCc1ccc(C[N@H+]2CCC[C@@](C)(F)CC2)c(O)c1 ZINC001236784337 1131006005 /nfs/dbraw/zinc/00/60/05/1131006005.db2.gz UYGCCFPFUWBDIX-MRXNPFEDSA-N 1 1 265.372 3.669 20 10 CHCDMO CCc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001236790741 1131007163 /nfs/dbraw/zinc/00/71/63/1131007163.db2.gz 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ZINC001236834813 1131019586 /nfs/dbraw/zinc/01/95/86/1131019586.db2.gz DGWCNCDFPSGIKE-UHFFFAOYSA-N 1 1 299.414 3.936 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001237042043 1131037610 /nfs/dbraw/zinc/03/76/10/1131037610.db2.gz DPWWKKQNAOAYEG-WMLDXEAASA-N 1 1 289.419 3.946 20 10 CHCDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H]2CC2(C)C)c(O)c1 ZINC001237050132 1131041767 /nfs/dbraw/zinc/04/17/67/1131041767.db2.gz YTNFIDLPGGLUPX-HNNXBMFYSA-N 1 1 261.409 3.994 20 10 CHCDMO CC(C)c1ccc(C[N@@H+](CC2CC2)C2CC2)c(O)c1 ZINC001237056308 1131042157 /nfs/dbraw/zinc/04/21/57/1131042157.db2.gz WZHMNZGKMGGZML-UHFFFAOYSA-N 1 1 259.393 3.890 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c(O)c1 ZINC001237051950 1131042227 /nfs/dbraw/zinc/04/22/27/1131042227.db2.gz PNSBNGDZCXIBFF-KSSFIOAISA-N 1 1 289.419 3.517 20 10 CHCDMO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237051558 1131042311 /nfs/dbraw/zinc/04/23/11/1131042311.db2.gz OBRDQWFKTPOAME-MRXNPFEDSA-N 1 1 277.408 3.515 20 10 CHCDMO Cc1ncccc1C[N@H+](C)Cc1ccc(C(C)C)cc1O ZINC001237055338 1131043346 /nfs/dbraw/zinc/04/33/46/1131043346.db2.gz MJQHKODLCNEYMW-UHFFFAOYSA-N 1 1 284.403 3.851 20 10 CHCDMO CC(C)c1ccc(C[N@@H+](C)Cc2cncs2)c(O)c1 ZINC001237055413 1131043652 /nfs/dbraw/zinc/04/36/52/1131043652.db2.gz OGPLGGWFIYBMQE-UHFFFAOYSA-N 1 1 276.405 3.604 20 10 CHCDMO C[N@H+](Cc1cc(C(F)(F)F)ccc1O)C[C@@H]1CC1(C)C ZINC001237140985 1131058402 /nfs/dbraw/zinc/05/84/02/1131058402.db2.gz QCTZZQSNCOJWNB-LBPRGKRZSA-N 1 1 287.325 3.889 20 10 CHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@H]1CCCCO1 ZINC000816495746 1131100239 /nfs/dbraw/zinc/10/02/39/1131100239.db2.gz IGUHHGQBYWKEQO-MRXNPFEDSA-N 1 1 285.387 3.546 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816495130 1131100909 /nfs/dbraw/zinc/10/09/09/1131100909.db2.gz LNXLPWKBPCKNDA-OAHLLOKOSA-N 1 1 255.361 3.920 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816499666 1131101581 /nfs/dbraw/zinc/10/15/81/1131101581.db2.gz WTZIOUREWXFPLK-UHFFFAOYSA-N 1 1 257.736 3.559 20 10 CHCDMO CC1(C)CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816499666 1131101576 /nfs/dbraw/zinc/10/15/76/1131101576.db2.gz WTZIOUREWXFPLK-UHFFFAOYSA-N 1 1 257.736 3.559 20 10 CHCDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816516993 1131104121 /nfs/dbraw/zinc/10/41/21/1131104121.db2.gz ZPMFEQNNKBKNMB-HNNXBMFYSA-N 1 1 287.428 3.873 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(C)cccc2O)cc1C ZINC001237492010 1131104783 /nfs/dbraw/zinc/10/47/83/1131104783.db2.gz NRKGLONPVLOBBK-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1c(C)cccc1O ZINC001237492108 1131104910 /nfs/dbraw/zinc/10/49/10/1131104910.db2.gz OJMUWRSLEHTHIP-HNNXBMFYSA-N 1 1 299.414 3.772 20 10 CHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816594573 1131109817 /nfs/dbraw/zinc/10/98/17/1131109817.db2.gz IVFJQVYRWFOQBS-SFHVURJKSA-N 1 1 285.387 3.546 20 10 CHCDMO C[N@@H+](CCc1ccncc1)Cc1ccc2ccccc2c1O ZINC000816568349 1131113187 /nfs/dbraw/zinc/11/31/87/1131113187.db2.gz DTIUSBMROSHIJV-UHFFFAOYSA-N 1 1 292.382 3.615 20 10 CHCDMO CC1=C(C)C[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816597648 1131114847 /nfs/dbraw/zinc/11/48/47/1131114847.db2.gz AETRTULWBRSXAF-UHFFFAOYSA-N 1 1 269.747 3.727 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816597648 1131114852 /nfs/dbraw/zinc/11/48/52/1131114852.db2.gz AETRTULWBRSXAF-UHFFFAOYSA-N 1 1 269.747 3.727 20 10 CHCDMO C[N@@H+](Cc1ccc(O)cc1)Cc1ccc2ccccc2c1O ZINC000816611014 1131115557 /nfs/dbraw/zinc/11/55/57/1131115557.db2.gz FXUNDYYBILGKNS-UHFFFAOYSA-N 1 1 293.366 3.883 20 10 CHCDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCCO1 ZINC000816674582 1131123765 /nfs/dbraw/zinc/12/37/65/1131123765.db2.gz DNJSOHVBHIKFGX-SFHVURJKSA-N 1 1 299.414 3.792 20 10 CHCDMO COCC[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC001237687914 1131128192 /nfs/dbraw/zinc/12/81/92/1131128192.db2.gz YGFBMKPHAVFYLV-OAHLLOKOSA-N 1 1 297.826 3.745 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])[C@H](C)C1 ZINC001237798438 1131140725 /nfs/dbraw/zinc/14/07/25/1131140725.db2.gz FNHVHSHUHITTEJ-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[N@@H+](Cc1ccoc1)Cc1ccc(N2CCCC2)cc1 ZINC001116442360 1131147013 /nfs/dbraw/zinc/14/70/13/1131147013.db2.gz SSVCGNVQRVOMJP-UHFFFAOYSA-N 1 1 270.376 3.512 20 10 CHCDMO CCCC[N@H+](CC)Cc1cc(F)c(Cl)cc1O ZINC001237940136 1131151770 /nfs/dbraw/zinc/15/17/70/1131151770.db2.gz BVEDAFDSTKPBJE-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO CCCC[N@@H+](CC)Cc1cc(F)c(Cl)cc1O ZINC001237940136 1131151773 /nfs/dbraw/zinc/15/17/73/1131151773.db2.gz BVEDAFDSTKPBJE-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237934564 1131152611 /nfs/dbraw/zinc/15/26/11/1131152611.db2.gz KQHHNAXOCVFAIX-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237934564 1131152613 /nfs/dbraw/zinc/15/26/13/1131152613.db2.gz KQHHNAXOCVFAIX-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237934564 1131152616 /nfs/dbraw/zinc/15/26/16/1131152616.db2.gz KQHHNAXOCVFAIX-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237939395 1131153315 /nfs/dbraw/zinc/15/33/15/1131153315.db2.gz BFYTUDPHSNSKNO-LLVKDONJSA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237939395 1131153319 /nfs/dbraw/zinc/15/33/19/1131153319.db2.gz BFYTUDPHSNSKNO-LLVKDONJSA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237939395 1131153321 /nfs/dbraw/zinc/15/33/21/1131153321.db2.gz BFYTUDPHSNSKNO-LLVKDONJSA-N 1 1 271.763 3.949 20 10 CHCDMO C[N@@H+](Cc1cc(F)c(Cl)cc1O)CC1CC(F)(F)C1 ZINC001237949953 1131154822 /nfs/dbraw/zinc/15/48/22/1131154822.db2.gz PGDIYZBQYOBHRC-UHFFFAOYSA-N 1 1 293.716 3.662 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1cc(F)c(Cl)cc1O ZINC001237950244 1131155101 /nfs/dbraw/zinc/15/51/01/1131155101.db2.gz RFOGCTBAJSLDQQ-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(F)c(Cl)cc1O ZINC001237950244 1131155103 /nfs/dbraw/zinc/15/51/03/1131155103.db2.gz RFOGCTBAJSLDQQ-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO C[N@H+](CCc1ccccc1)Cc1cc(F)c(Cl)cc1O ZINC001237946259 1131155549 /nfs/dbraw/zinc/15/55/49/1131155549.db2.gz IAIRVZABDFBLEF-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO C[N@@H+](CCc1ccccc1)Cc1cc(F)c(Cl)cc1O ZINC001237946259 1131155551 /nfs/dbraw/zinc/15/55/51/1131155551.db2.gz IAIRVZABDFBLEF-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC001238069281 1131167168 /nfs/dbraw/zinc/16/71/68/1131167168.db2.gz IFNOSJCYFPHKKT-CYBMUJFWSA-N 1 1 285.362 3.787 20 10 CHCDMO C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000817976626 1131193692 /nfs/dbraw/zinc/19/36/92/1131193692.db2.gz PTJJDSYEZBJCEL-KGLIPLIRSA-N 1 1 286.419 3.714 20 10 CHCDMO CC1(C)C[N@H+](Cc2cccc(F)c2O)Cc2ccccc21 ZINC001138129674 1131470205 /nfs/dbraw/zinc/47/02/05/1131470205.db2.gz QJTNIEDLCQYZLY-UHFFFAOYSA-N 1 1 285.362 3.825 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cccc(F)c2O)Cc2ccccc21 ZINC001138129674 1131470206 /nfs/dbraw/zinc/47/02/06/1131470206.db2.gz QJTNIEDLCQYZLY-UHFFFAOYSA-N 1 1 285.362 3.825 20 10 CHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000824572514 1131474436 /nfs/dbraw/zinc/47/44/36/1131474436.db2.gz YUBKPTKPLNMRIC-MRXNPFEDSA-N 1 1 271.335 3.603 20 10 CHCDMO Cc1c(C[N@@H+](C)C2CCCC2)c2ccccc2n1C ZINC001138256903 1131483345 /nfs/dbraw/zinc/48/33/45/1131483345.db2.gz OUZWNKUNUWBVHE-UHFFFAOYSA-N 1 1 256.393 3.861 20 10 CHCDMO CCOC[C@H]1CCC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824814968 1131486036 /nfs/dbraw/zinc/48/60/36/1131486036.db2.gz XFAYPEFOLJIEQC-ZDUSSCGKSA-N 1 1 297.826 3.603 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCC34CCCCC4)ccc21 ZINC001138354597 1131493544 /nfs/dbraw/zinc/49/35/44/1131493544.db2.gz OOXKSYOZKOEKJE-UHFFFAOYSA-N 1 1 284.447 3.978 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCc4ccccc4C3)ccc21 ZINC001138354557 1131493587 /nfs/dbraw/zinc/49/35/87/1131493587.db2.gz NCPDTMQDSUPBRX-UHFFFAOYSA-N 1 1 292.426 3.627 20 10 CHCDMO CN1CCCc2cc(C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)ccc21 ZINC001138354685 1131493825 /nfs/dbraw/zinc/49/38/25/1131493825.db2.gz PTVKESFNLJYYMK-HDICACEKSA-N 1 1 284.447 3.691 20 10 CHCDMO CC[N@@H+](Cc1cnc(Cl)c(C)c1)Cc1ccccc1O ZINC001139546695 1131615977 /nfs/dbraw/zinc/61/59/77/1131615977.db2.gz MNWUOZLZNQBILT-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)ccc1N(C)C ZINC001139671509 1131626936 /nfs/dbraw/zinc/62/69/36/1131626936.db2.gz XDKOWSAJNPVEBH-IRXDYDNUSA-N 1 1 272.436 3.683 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)ccc1N(C)C ZINC001139673164 1131627805 /nfs/dbraw/zinc/62/78/05/1131627805.db2.gz ATWHQSWPNSPCRZ-MRXNPFEDSA-N 1 1 260.425 3.681 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2c(O)cccc2Br)C2(CC2)C1 ZINC001140103531 1131664079 /nfs/dbraw/zinc/66/40/79/1131664079.db2.gz NRFUZKIQNSHTLW-SNVBAGLBSA-N 1 1 296.208 3.529 20 10 CHCDMO COc1cccc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)c1O ZINC000846168376 1131693159 /nfs/dbraw/zinc/69/31/59/1131693159.db2.gz AJPAMCSOMHOTNS-NSHDSACASA-N 1 1 284.359 3.846 20 10 CHCDMO Oc1cccc(Cl)c1C[N@@H+](C1CCC1)C1CCOCC1 ZINC001140342327 1131703430 /nfs/dbraw/zinc/70/34/30/1131703430.db2.gz DGEXTHHYMWBWOF-UHFFFAOYSA-N 1 1 295.810 3.579 20 10 CHCDMO CC(C)[C@@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)CCO1 ZINC000834884830 1131717530 /nfs/dbraw/zinc/71/75/30/1131717530.db2.gz DAKWALGPNPEMOD-AHIWAGSCSA-N 1 1 295.398 3.633 20 10 CHCDMO CCc1nc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)co1 ZINC000834899013 1131724071 /nfs/dbraw/zinc/72/40/71/1131724071.db2.gz DTSKRWSISKJPPV-INIZCTEOSA-N 1 1 287.407 3.544 20 10 CHCDMO CCCc1ncc(C[NH2+][C@@H](CC)c2ccc(F)cc2O)o1 ZINC000834901284 1131726114 /nfs/dbraw/zinc/72/61/14/1131726114.db2.gz ZAFYNYPCLYTSJC-AWEZNQCLSA-N 1 1 292.354 3.713 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cnn(CC)c1)c1ccc(F)cc1O ZINC000834906201 1131728934 /nfs/dbraw/zinc/72/89/34/1131728934.db2.gz WKJJMDWRVLWKLU-NHYWBVRUSA-N 1 1 291.370 3.550 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000834909818 1131729993 /nfs/dbraw/zinc/72/99/93/1131729993.db2.gz MHCOOPQOOILOHN-DOMZBBRYSA-N 1 1 295.398 3.777 20 10 CHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)CCOC(C)(C)C)cc1 ZINC000835027326 1131759640 /nfs/dbraw/zinc/75/96/40/1131759640.db2.gz CQJZKHYFRVXWSH-BQYQJAHWSA-N 1 1 290.451 3.513 20 10 CHCDMO CC(C)[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC000835026001 1131760014 /nfs/dbraw/zinc/76/00/14/1131760014.db2.gz PTSXBCFOEUXNBR-AATRIKPKSA-N 1 1 258.409 3.639 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCC1CC(F)(F)C1 ZINC000835060238 1131767666 /nfs/dbraw/zinc/76/76/66/1131767666.db2.gz PPCAHFWOSIDJIP-UHFFFAOYSA-N 1 1 293.716 3.710 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2Cc3cccc(C)c3C2)c1 ZINC001140617704 1131829314 /nfs/dbraw/zinc/82/93/14/1131829314.db2.gz YJBIIGAQFIANGB-UHFFFAOYSA-N 1 1 253.345 3.525 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001140622721 1131830873 /nfs/dbraw/zinc/83/08/73/1131830873.db2.gz DEDRCKLWVIGZLY-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001140622721 1131830877 /nfs/dbraw/zinc/83/08/77/1131830877.db2.gz DEDRCKLWVIGZLY-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)CC/C=C/c2cccnc2)c1 ZINC001140623351 1131833129 /nfs/dbraw/zinc/83/31/29/1131833129.db2.gz MQYYJUJOFBHDDQ-ZZXKWVIFSA-N 1 1 282.387 3.631 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H](C)C2)c(O)c1 ZINC001140850768 1131948120 /nfs/dbraw/zinc/94/81/20/1131948120.db2.gz TVMOFZRQPVMMCW-HNNXBMFYSA-N 1 1 290.451 3.860 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H](F)C2)c(O)c1 ZINC001140851014 1131948170 /nfs/dbraw/zinc/94/81/70/1131948170.db2.gz YJONHSMRHSFGAJ-HNNXBMFYSA-N 1 1 294.414 3.562 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC2CCCC2)c(O)c1 ZINC001140855502 1131948833 /nfs/dbraw/zinc/94/88/33/1131948833.db2.gz BSRTZIBUJIUXMB-UHFFFAOYSA-N 1 1 290.451 3.860 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](F)CC2)c(Cl)c1 ZINC001140921590 1131963816 /nfs/dbraw/zinc/96/38/16/1131963816.db2.gz IYSQFOFRHIKJOT-ZDUSSCGKSA-N 1 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1 298.430 3.562 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cnc(Cl)cc1C ZINC001209633021 1134045721 /nfs/dbraw/zinc/04/57/21/1134045721.db2.gz FFKKYFQTEICXGH-UHFFFAOYSA-N 1 1 290.794 3.771 20 10 CHCDMO C[C@H]([NH2+]CC1(C)CCCC1)c1ccc(F)cc1O ZINC000104444817 186005070 /nfs/dbraw/zinc/00/50/70/186005070.db2.gz TWWZJRYJRKRUEK-NSHDSACASA-N 1 1 251.345 3.762 20 10 CHCDMO CN(C)c1ccc(C[NH2+]Cc2c(F)cccc2Cl)cc1 ZINC000020146111 171031647 /nfs/dbraw/zinc/03/16/47/171031647.db2.gz JIOXPOUMQOHPJN-UHFFFAOYSA-N 1 1 292.785 3.835 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2cccnc2)cc1C ZINC000183718278 261986482 /nfs/dbraw/zinc/98/64/82/261986482.db2.gz XZCNTVCGXXUZGQ-CQSZACIVSA-N 1 1 270.376 3.597 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000183981878 262003536 /nfs/dbraw/zinc/00/35/36/262003536.db2.gz HXOQJUXIYSAZJP-OCCSQVGLSA-N 1 1 281.371 3.531 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1F ZINC000184927645 262034104 /nfs/dbraw/zinc/03/41/04/262034104.db2.gz ONYCCXRMOZXNPX-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO CO[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185101787 262040964 /nfs/dbraw/zinc/04/09/64/262040964.db2.gz MBRWMFRRESYQKM-YVEFUNNKSA-N 1 1 289.350 3.570 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000377016861 268039943 /nfs/dbraw/zinc/03/99/43/268039943.db2.gz YGLWKGIUZZXWGC-KRWDZBQOSA-N 1 1 298.434 3.593 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000377016861 268039944 /nfs/dbraw/zinc/03/99/44/268039944.db2.gz YGLWKGIUZZXWGC-KRWDZBQOSA-N 1 1 298.434 3.593 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000377016862 268040073 /nfs/dbraw/zinc/04/00/73/268040073.db2.gz YGLWKGIUZZXWGC-QGZVFWFLSA-N 1 1 298.434 3.593 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000377016862 268040076 /nfs/dbraw/zinc/04/00/76/268040076.db2.gz YGLWKGIUZZXWGC-QGZVFWFLSA-N 1 1 298.434 3.593 20 10 CHCDMO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185351611 327838253 /nfs/dbraw/zinc/83/82/53/327838253.db2.gz USSFMZHWPPYQME-RYUDHWBXSA-N 1 1 289.350 3.519 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000271843426 328198190 /nfs/dbraw/zinc/19/81/90/328198190.db2.gz UHAJFIKNKHNQDO-CQSZACIVSA-N 1 1 276.767 3.711 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000527926139 330296605 /nfs/dbraw/zinc/29/66/05/330296605.db2.gz OZQZIESUIRKGIC-RYUDHWBXSA-N 1 1 283.799 3.513 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000527926135 330296634 /nfs/dbraw/zinc/29/66/34/330296634.db2.gz OZQZIESUIRKGIC-NWDGAFQWSA-N 1 1 283.799 3.513 20 10 CHCDMO CC1(C)C[N@H+](Cc2cc(F)ccc2O)[C@@H]1c1cccnc1 ZINC000292800196 520475907 /nfs/dbraw/zinc/47/59/07/520475907.db2.gz NMOJVHGMKRCQFB-MRXNPFEDSA-N 1 1 286.350 3.509 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)[C@@H]1c1cccnc1 ZINC000292800196 520475911 /nfs/dbraw/zinc/47/59/11/520475911.db2.gz NMOJVHGMKRCQFB-MRXNPFEDSA-N 1 1 286.350 3.509 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)C2CCC(F)(F)CC2)c1 ZINC000290262285 521141128 /nfs/dbraw/zinc/14/11/28/521141128.db2.gz WUOKCAXMEVGTDX-UHFFFAOYSA-N 1 1 299.361 3.801 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccco2)c1 ZINC000131125370 521144306 /nfs/dbraw/zinc/14/43/06/521144306.db2.gz KFYFXAUVSBQIAW-LBPRGKRZSA-N 1 1 275.348 3.577 20 10 CHCDMO COc1ccc(C[NH2+]C(C)(C)c2nc(C)cs2)cc1C ZINC000265221439 524068649 /nfs/dbraw/zinc/06/86/49/524068649.db2.gz GXHGDNULWZPPFH-UHFFFAOYSA-N 1 1 290.432 3.793 20 10 CHCDMO Cc1cccc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000290222481 524376450 /nfs/dbraw/zinc/37/64/50/524376450.db2.gz RVLCFFUYJTWKCK-UHFFFAOYSA-N 1 1 269.335 3.710 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062744687 525609143 /nfs/dbraw/zinc/60/91/43/525609143.db2.gz WUQYACQROYVIBZ-NEPJUHHUSA-N 1 1 259.324 3.943 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)cccc2Br)[C@@H](C)C1 ZINC000707145799 1118648132 /nfs/dbraw/zinc/64/81/32/1118648132.db2.gz HJJZHDSLWDVUJY-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)CCSCC)c1O ZINC000093870952 1120892376 /nfs/dbraw/zinc/89/23/76/1120892376.db2.gz YHOZVIJTDHBBNO-ZDUSSCGKSA-N 1 1 297.464 3.754 20 10 CHCDMO CC(C)C[C@@H]1CC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001180267614 1121969815 /nfs/dbraw/zinc/96/98/15/1121969815.db2.gz YUTNHOKJHKSNCX-NSHDSACASA-N 1 1 269.335 3.538 20 10 CHCDMO CC[N@@H+](Cc1cc(C)cs1)Cc1ccccc1O ZINC001137158008 1125287578 /nfs/dbraw/zinc/28/75/78/1125287578.db2.gz ACLHQJHHGYFBNB-UHFFFAOYSA-N 1 1 261.390 3.784 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)nc(Cl)c1)Cc1ccccc1O ZINC000109772051 1125362137 /nfs/dbraw/zinc/36/21/37/1125362137.db2.gz PIQMPSQSUVXEDU-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO CN1CCCc2cc(C[N@@H+](C)CC(C)(C)C)ccc21 ZINC001138357516 1131493740 /nfs/dbraw/zinc/49/37/40/1131493740.db2.gz HUJHIJMMJWUGPJ-UHFFFAOYSA-N 1 1 260.425 3.547 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)cc1Cl ZINC001231868666 1132385134 /nfs/dbraw/zinc/38/51/34/1132385134.db2.gz VZFCSVJBRITMFE-KGLIPLIRSA-N 1 1 289.753 3.626 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@](C)(F)C2)cc1Cl ZINC001231867380 1132383132 /nfs/dbraw/zinc/38/31/32/1132383132.db2.gz JVZQMAKZWOXEEY-CQSZACIVSA-N 1 1 271.763 3.678 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC2(CCC2)CC1 ZINC001205729734 1133605671 /nfs/dbraw/zinc/60/56/71/1133605671.db2.gz UPTHZGKMPBFRTK-UHFFFAOYSA-N 1 1 283.774 3.951 20 10 CHCDMO CC[C@@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)N1CCCC1 ZINC000841746227 1125570918 /nfs/dbraw/zinc/57/09/18/1125570918.db2.gz WFZMOZYWQBVEDD-OCCSQVGLSA-N 1 1 296.842 3.571 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886489433 1125680036 /nfs/dbraw/zinc/68/00/36/1125680036.db2.gz IPICTNKGCNBYFF-RYUDHWBXSA-N 1 1 259.324 3.943 20 10 CHCDMO Cc1ccccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886491945 1125680074 /nfs/dbraw/zinc/68/00/74/1125680074.db2.gz XIHWRJIOABDUMV-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO Cc1ccccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886491946 1125680220 /nfs/dbraw/zinc/68/02/20/1125680220.db2.gz XIHWRJIOABDUMV-LBPRGKRZSA-N 1 1 259.324 3.691 20 10 CHCDMO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cn1 ZINC000886526883 1125683864 /nfs/dbraw/zinc/68/38/64/1125683864.db2.gz ULNWNUIFMJUYMZ-NWDGAFQWSA-N 1 1 291.370 3.721 20 10 CHCDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886526542 1125684254 /nfs/dbraw/zinc/68/42/54/1125684254.db2.gz NQMPQDODLARULH-BDAKNGLRSA-N 1 1 278.327 3.548 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(F)c1 ZINC000886552064 1125690492 /nfs/dbraw/zinc/69/04/92/1125690492.db2.gz TUSIEWSVMNWBND-JTQLQIEISA-N 1 1 293.313 3.530 20 10 CHCDMO COc1cc(F)cc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886559931 1125691865 /nfs/dbraw/zinc/69/18/65/1125691865.db2.gz JICMVHNIWXYQRD-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO COC1CCC(CC[NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886587825 1125693875 /nfs/dbraw/zinc/69/38/75/1125693875.db2.gz GMSRYVZTDNOGCZ-IYXRBSQSSA-N 1 1 295.398 3.777 20 10 CHCDMO CSCCCCC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886594777 1125695227 /nfs/dbraw/zinc/69/52/27/1125695227.db2.gz UIAZROYVEMEGRZ-NSHDSACASA-N 1 1 271.401 3.715 20 10 CHCDMO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1c(O)cccc1F ZINC000886626704 1125699980 /nfs/dbraw/zinc/69/99/80/1125699980.db2.gz JCCNHKWGFWGTHL-LBPRGKRZSA-N 1 1 288.366 3.555 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1c(O)cccc1F ZINC000886638123 1125701549 /nfs/dbraw/zinc/70/15/49/1125701549.db2.gz MMNAIRZLBIBAMI-RNCFNFMXSA-N 1 1 273.298 3.617 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000300415979 1125719964 /nfs/dbraw/zinc/71/99/64/1125719964.db2.gz AWPDXFIRAFBXBC-SWLSCSKDSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000769328507 1129902565 /nfs/dbraw/zinc/90/25/65/1129902565.db2.gz JBUIZISCSBMMOK-ZDUSSCGKSA-N 1 1 296.208 3.529 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@H]1C ZINC000769487676 1129909498 /nfs/dbraw/zinc/90/94/98/1129909498.db2.gz KVBPPNUHAISCFE-GDBMZVCRSA-N 1 1 260.425 3.619 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(F)cc2)cc1 ZINC000302741692 1126740815 /nfs/dbraw/zinc/74/08/15/1126740815.db2.gz QSFHACIYCLTDHF-UHFFFAOYSA-N 1 1 272.367 3.524 20 10 CHCDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccccc2O)s1 ZINC000179579021 1126831203 /nfs/dbraw/zinc/83/12/03/1126831203.db2.gz ZPWFWTKPFRQMPP-GFCCVEGCSA-N 1 1 290.432 3.913 20 10 CHCDMO CC(C)c1csc(C[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000185807930 1126903337 /nfs/dbraw/zinc/90/33/37/1126903337.db2.gz KXWWFZWSGUBQHI-SNVBAGLBSA-N 1 1 294.395 3.962 20 10 CHCDMO CCC[N@@H+](Cc1cncc(C)c1)Cc1ccccc1O ZINC000189908189 1126935726 /nfs/dbraw/zinc/93/57/26/1126935726.db2.gz SCXGYBMXCHOXPK-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO COC[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271154576 1127070599 /nfs/dbraw/zinc/07/05/99/1127070599.db2.gz CLUVRJSJXMCSOG-HNNXBMFYSA-N 1 1 297.398 3.528 20 10 CHCDMO COC[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271154579 1127071397 /nfs/dbraw/zinc/07/13/97/1127071397.db2.gz CLUVRJSJXMCSOG-OAHLLOKOSA-N 1 1 297.398 3.528 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1nnc(C)s1 ZINC000283159090 1127124291 /nfs/dbraw/zinc/12/42/91/1127124291.db2.gz OXMPFWIMAPXFQY-LLVKDONJSA-N 1 1 291.420 3.525 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nnc(C)s1 ZINC000283159090 1127124292 /nfs/dbraw/zinc/12/42/92/1127124292.db2.gz OXMPFWIMAPXFQY-LLVKDONJSA-N 1 1 291.420 3.525 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1c(F)cncc1F ZINC000285773605 1127242365 /nfs/dbraw/zinc/24/23/65/1127242365.db2.gz UFBXYZMTMZTAQH-DTWKUNHWSA-N 1 1 296.292 3.616 20 10 CHCDMO CC[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc(F)cc1O ZINC000286002750 1127252692 /nfs/dbraw/zinc/25/26/92/1127252692.db2.gz HRBRAKOTHIYCRK-WWGRRREGSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CCO[C@@H](C)C1)c1ccc(F)cc1O ZINC000286002754 1127253294 /nfs/dbraw/zinc/25/32/94/1127253294.db2.gz HRBRAKOTHIYCRK-ZENOOKHLSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)C)C1)c1ccc(F)cc1O ZINC000286160201 1127261282 /nfs/dbraw/zinc/26/12/82/1127261282.db2.gz PWBHGADTXDQOIC-JLJPHGGASA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1cc[nH+]c(N[C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000005982077 1127502202 /nfs/dbraw/zinc/50/22/02/1127502202.db2.gz BEMRBHWKEUCAQU-JTQLQIEISA-N 1 1 262.740 3.922 20 10 CHCDMO CC1(C)C[N@H+](Cc2cc(F)ccc2O)[C@H]1c1ccncc1 ZINC000293909095 1127532047 /nfs/dbraw/zinc/53/20/47/1127532047.db2.gz LQIWWCGHXIFWCX-INIZCTEOSA-N 1 1 286.350 3.509 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)[C@H]1c1ccncc1 ZINC000293909095 1127532049 /nfs/dbraw/zinc/53/20/49/1127532049.db2.gz LQIWWCGHXIFWCX-INIZCTEOSA-N 1 1 286.350 3.509 20 10 CHCDMO CC[N@H+](Cc1ccncc1)Cc1cc(Cl)c(F)cc1O ZINC000294069407 1127547030 /nfs/dbraw/zinc/54/70/30/1127547030.db2.gz YIDKTXKMEIYHGJ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(Cl)c(F)cc1O ZINC000294069407 1127547031 /nfs/dbraw/zinc/54/70/31/1127547031.db2.gz YIDKTXKMEIYHGJ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000294090124 1127548224 /nfs/dbraw/zinc/54/82/24/1127548224.db2.gz ZOSNLYDERSCPGS-CTYIDZIISA-N 1 1 289.325 3.706 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccc(F)cc1O ZINC000062744887 1127772592 /nfs/dbraw/zinc/77/25/92/1127772592.db2.gz MGNWQENHXXVDPF-SNVBAGLBSA-N 1 1 263.287 3.521 20 10 CHCDMO C[C@H]([NH2+]CCSc1ccccc1)c1ccc(F)cc1O ZINC000062747774 1127773701 /nfs/dbraw/zinc/77/37/01/1127773701.db2.gz GSAVWOAHONCTBX-LBPRGKRZSA-N 1 1 291.391 3.974 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC000230929810 1127784700 /nfs/dbraw/zinc/78/47/00/1127784700.db2.gz SKMCTMWNNIIWDB-RISCZKNCSA-N 1 1 295.810 3.819 20 10 CHCDMO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000925080681 1128120929 /nfs/dbraw/zinc/12/09/29/1128120929.db2.gz OCXIJGFYZJEMIY-INIZCTEOSA-N 1 1 299.418 3.525 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(Cl)cc1O ZINC000926948260 1128205062 /nfs/dbraw/zinc/20/50/62/1128205062.db2.gz JUVRLLTZKUXYKN-DKCNOQQISA-N 1 1 293.716 3.895 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)C(F)F)c1ccc(C)cc1O ZINC000834826104 1128211152 /nfs/dbraw/zinc/21/11/52/1128211152.db2.gz BPMDLTGBZAKNHW-NEPJUHHUSA-N 1 1 257.324 3.785 20 10 CHCDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccccc1O ZINC000777824833 1128288236 /nfs/dbraw/zinc/28/82/36/1128288236.db2.gz HNARFBUSBHDNGF-INIZCTEOSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](C4CC4)C3)c2c1 ZINC000763330283 1128392207 /nfs/dbraw/zinc/39/22/07/1128392207.db2.gz CGFXEVZJZVTYEO-OAHLLOKOSA-N 1 1 297.398 3.786 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C)nc1)Cc1ccccc1O ZINC000153810463 1128402992 /nfs/dbraw/zinc/40/29/92/1128402992.db2.gz LIBWBWRDIHVCGX-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585509 1128569083 /nfs/dbraw/zinc/56/90/83/1128569083.db2.gz GOYDXGNFMNBJGY-KUHUBIRLSA-N 1 1 296.414 3.953 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)c(O)cc1C ZINC000781587665 1128574112 /nfs/dbraw/zinc/57/41/12/1128574112.db2.gz RANHMXZFQDTQKD-UGSOOPFHSA-N 1 1 289.419 3.721 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)s1)Cc1cc(F)ccc1O ZINC000778994374 1128674394 /nfs/dbraw/zinc/67/43/94/1128674394.db2.gz CFRKPZJWQYMFHJ-UHFFFAOYSA-N 1 1 285.771 3.878 20 10 CHCDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000920257179 1128674928 /nfs/dbraw/zinc/67/49/28/1128674928.db2.gz ICTZFCQICHDXMW-ZDUSSCGKSA-N 1 1 286.444 3.933 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2ncc(C)s2)cc1C ZINC000134905627 1128713221 /nfs/dbraw/zinc/71/32/21/1128713221.db2.gz UGHBJNFDDFCKFA-LBPRGKRZSA-N 1 1 276.405 3.619 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)c1ccns1 ZINC000858575530 1117810696 /nfs/dbraw/zinc/81/06/96/1117810696.db2.gz AETKFYDQVOSCMV-HTQZYQBOSA-N 1 1 284.331 3.539 20 10 CHCDMO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C12CCC2 ZINC000185551321 1117845141 /nfs/dbraw/zinc/84/51/41/1117845141.db2.gz HKDASKGAXQDXBM-KNXALSJPSA-N 1 1 293.382 3.530 20 10 CHCDMO CC(C)=CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000072952731 1117852876 /nfs/dbraw/zinc/85/28/76/1117852876.db2.gz LDRKQQUKOLAGKE-UHFFFAOYSA-N 1 1 271.360 3.954 20 10 CHCDMO CC(C)[NH+](CCCN[C@H](C)c1cc(F)ccc1O)C(C)C ZINC000185627034 1117859337 /nfs/dbraw/zinc/85/93/37/1117859337.db2.gz BNPKFMHECBBHJE-CQSZACIVSA-N 1 1 296.430 3.691 20 10 CHCDMO C[C@H]([NH2+]CCc1cc(F)ccc1F)c1ccc(F)cc1O ZINC000185633693 1117860437 /nfs/dbraw/zinc/86/04/37/1117860437.db2.gz SJXQKBCCMAWVJE-JTQLQIEISA-N 1 1 295.304 3.703 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2C2CCC2)cc1C ZINC000728199986 1117868982 /nfs/dbraw/zinc/86/89/82/1117868982.db2.gz OUZUVQLZWMWYBG-MRXNPFEDSA-N 1 1 259.393 3.774 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000705477090 1117973350 /nfs/dbraw/zinc/97/33/50/1117973350.db2.gz LJZWTYPWCPJRRZ-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000179575801 1128747838 /nfs/dbraw/zinc/74/78/38/1128747838.db2.gz MTJPDPXSBOJCMI-QGZVFWFLSA-N 1 1 257.377 3.715 20 10 CHCDMO CC(C)C1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000186099810 1117993344 /nfs/dbraw/zinc/99/33/44/1117993344.db2.gz DGWWIQUWOUVQQB-NSHDSACASA-N 1 1 251.345 3.618 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)[C@H](c2ccco2)C1 ZINC000179582876 1128748569 /nfs/dbraw/zinc/74/85/69/1128748569.db2.gz OCOGKZNCGYAXLV-HIFRSBDPSA-N 1 1 271.360 3.958 20 10 CHCDMO COCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179646626 1128752494 /nfs/dbraw/zinc/75/24/94/1128752494.db2.gz DSALDWSMZQOSCQ-MRXNPFEDSA-N 1 1 299.414 3.992 20 10 CHCDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000211564861 1118074740 /nfs/dbraw/zinc/07/47/40/1118074740.db2.gz DIVBQGAHOYJBMM-WDEREUQCSA-N 1 1 253.773 3.666 20 10 CHCDMO COc1ccccc1C[N@@H+](Cc1cccc(C)c1O)C1CC1 ZINC000179679387 1128754073 /nfs/dbraw/zinc/75/40/73/1128754073.db2.gz YTEYLIFZOXYBOY-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO CC[C@H](NCC[N@H+](CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626675 1118184763 /nfs/dbraw/zinc/18/47/63/1118184763.db2.gz ALFXXNGAYARNFB-SFHVURJKSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H](NCC[N@@H+](CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626675 1118184766 /nfs/dbraw/zinc/18/47/66/1118184766.db2.gz ALFXXNGAYARNFB-SFHVURJKSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)N[C@@H](C)C[NH+](CC)CC)cc1 ZINC000765765573 1118267916 /nfs/dbraw/zinc/26/79/16/1118267916.db2.gz GWVDUNGJCPIVRN-JKSUJKDBSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H](C)c1cccc(O)c1 ZINC000179942740 1128767381 /nfs/dbraw/zinc/76/73/81/1128767381.db2.gz SBZHNAUZWJSCRY-GFCCVEGCSA-N 1 1 289.350 3.820 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(F)ccc1O ZINC000180015990 1128772873 /nfs/dbraw/zinc/77/28/73/1128772873.db2.gz HZSYYVJTEPATRM-UHFFFAOYSA-N 1 1 289.350 3.649 20 10 CHCDMO COc1c(C)cc(C[N@@H+](C)Cc2ccccc2O)cc1C ZINC000091956702 1118515651 /nfs/dbraw/zinc/51/56/51/1118515651.db2.gz PFYMZEMPDJGSPJ-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1c(O)cccc1Br ZINC000707135418 1118641175 /nfs/dbraw/zinc/64/11/75/1118641175.db2.gz SITMCVRUCZPDMH-JTQLQIEISA-N 1 1 284.197 3.529 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1c(O)cccc1Br ZINC000707138796 1118642722 /nfs/dbraw/zinc/64/27/22/1118642722.db2.gz HODGWVMYVMZYHB-GHMZBOCLSA-N 1 1 298.224 3.918 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H]2C2CCCC2)c1O ZINC000754727911 1118648193 /nfs/dbraw/zinc/64/81/93/1118648193.db2.gz SIACTZRIQZTRSY-INIZCTEOSA-N 1 1 289.419 3.864 20 10 CHCDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1c(O)cccc1Br ZINC000707146236 1118648252 /nfs/dbraw/zinc/64/82/52/1118648252.db2.gz KLNFQHYYTWAKHP-WDEREUQCSA-N 1 1 298.224 3.775 20 10 CHCDMO Cc1cccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1O ZINC000180455985 1128792423 /nfs/dbraw/zinc/79/24/23/1128792423.db2.gz XKCNQXUDHWUOIO-KRWDZBQOSA-N 1 1 289.419 3.624 20 10 CHCDMO CC(C)Cc1ccc(C[N@@H+](C)Cc2ccccc2O)cn1 ZINC000891714045 1118749634 /nfs/dbraw/zinc/74/96/34/1118749634.db2.gz PWYDCTWUMHLQNG-UHFFFAOYSA-N 1 1 284.403 3.618 20 10 CHCDMO COc1ccccc1/C=C\C[N@@H+](C)Cc1ccccc1O ZINC000255392321 1118753332 /nfs/dbraw/zinc/75/33/32/1118753332.db2.gz ORGBDMBQRRGJNB-YFHOEESVSA-N 1 1 283.371 3.546 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)c1O ZINC000180638134 1128801462 /nfs/dbraw/zinc/80/14/62/1128801462.db2.gz JNKFNBXGNGMNRL-QGZVFWFLSA-N 1 1 284.403 3.766 20 10 CHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668289 1128801586 /nfs/dbraw/zinc/80/15/86/1128801586.db2.gz ODWQRYCQDXHAOW-HIFRSBDPSA-N 1 1 295.448 3.507 20 10 CHCDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562205 1119157421 /nfs/dbraw/zinc/15/74/21/1119157421.db2.gz AWELTMRVDQJAAH-BXUZGUMPSA-N 1 1 251.345 3.542 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001140623667 1119295361 /nfs/dbraw/zinc/29/53/61/1119295361.db2.gz OQIHJEJMCOSSNT-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO C[C@@H](c1ccco1)[N@@H+](Cc1ccccc1O)C1CC1 ZINC000179563310 1119751248 /nfs/dbraw/zinc/75/12/48/1119751248.db2.gz FEEXUNUJIQECHP-LBPRGKRZSA-N 1 1 257.333 3.711 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000179557369 1119752001 /nfs/dbraw/zinc/75/20/01/1119752001.db2.gz CQJYBRKSIAWKCI-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2ccc(O)c(C)c2O)cc1 ZINC001140747449 1119794160 /nfs/dbraw/zinc/79/41/60/1119794160.db2.gz DOZOCJPOEBVQLN-UHFFFAOYSA-N 1 1 285.387 3.601 20 10 CHCDMO Cc1cncc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000785442682 1120073015 /nfs/dbraw/zinc/07/30/15/1120073015.db2.gz URRPKBAWMFVVLC-UHFFFAOYSA-N 1 1 297.446 3.867 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)c(O)c1 ZINC001140950186 1120133655 /nfs/dbraw/zinc/13/36/55/1120133655.db2.gz UNXSHIBIARMEPN-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)c1O ZINC000181011697 1120286689 /nfs/dbraw/zinc/28/66/89/1120286689.db2.gz CUKSMMUEFANAMN-UHFFFAOYSA-N 1 1 295.304 3.750 20 10 CHCDMO Oc1ccccc1C[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000779401298 1128910130 /nfs/dbraw/zinc/91/01/30/1128910130.db2.gz SUUUBUNWPHOZPM-OAHLLOKOSA-N 1 1 291.341 3.748 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000689880406 1120351648 /nfs/dbraw/zinc/35/16/48/1120351648.db2.gz GNYACUJBCDKFAZ-NSHDSACASA-N 1 1 271.763 3.617 20 10 CHCDMO CC[N@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137831951 1121180204 /nfs/dbraw/zinc/18/02/04/1121180204.db2.gz UHTISJNNMZWGRH-UHFFFAOYSA-N 1 1 259.324 3.553 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137831951 1121180205 /nfs/dbraw/zinc/18/02/05/1121180205.db2.gz UHTISJNNMZWGRH-UHFFFAOYSA-N 1 1 259.324 3.553 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(F)cc1O ZINC000062748429 1121191745 /nfs/dbraw/zinc/19/17/45/1121191745.db2.gz DTAATWVZKHCAOS-VIFPVBQESA-N 1 1 281.277 3.660 20 10 CHCDMO CCC(CC)[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)N(C)C ZINC000062745413 1121192444 /nfs/dbraw/zinc/19/24/44/1121192444.db2.gz LKEZYHLUGSIEKX-WBMJQRKESA-N 1 1 296.430 3.548 20 10 CHCDMO C[N@H+](Cc1c([O-])cccc1F)CC1CCCCC1 ZINC001137838885 1121424273 /nfs/dbraw/zinc/42/42/73/1121424273.db2.gz MCTBJORKFIJEJW-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1F)CC1CCCCC1 ZINC001137838885 1121424276 /nfs/dbraw/zinc/42/42/76/1121424276.db2.gz MCTBJORKFIJEJW-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1F)CC1CCCCC1 ZINC001137838885 1121424279 /nfs/dbraw/zinc/42/42/79/1121424279.db2.gz MCTBJORKFIJEJW-UHFFFAOYSA-N 1 1 251.345 3.543 20 10 CHCDMO Oc1ccc(C(F)(F)F)cc1C[N@H+]1CCC2(CCC2)C1 ZINC001237140997 1128985671 /nfs/dbraw/zinc/98/56/71/1128985671.db2.gz QOQZGHXZAQBUPV-UHFFFAOYSA-N 1 1 285.309 3.787 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cc(C)on2)cc1 ZINC000773733228 1121773892 /nfs/dbraw/zinc/77/38/92/1121773892.db2.gz IGCTWNNWPUOQRL-GOSISDBHSA-N 1 1 299.418 3.776 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2cc(C)on2)cc1 ZINC000773733228 1121773898 /nfs/dbraw/zinc/77/38/98/1121773898.db2.gz IGCTWNNWPUOQRL-GOSISDBHSA-N 1 1 299.418 3.776 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167941402 1121786966 /nfs/dbraw/zinc/78/69/66/1121786966.db2.gz XPIIXQKIILHNKX-ALXJQNPVSA-N 1 1 270.420 3.517 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000773749498 1121794980 /nfs/dbraw/zinc/79/49/80/1121794980.db2.gz WNMCCGGYAHRZSV-KRWDZBQOSA-N 1 1 258.409 3.517 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2scnc2C)cc1 ZINC000773754084 1121798361 /nfs/dbraw/zinc/79/83/61/1121798361.db2.gz COGIUKKBGMGCDF-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)CCN(C)c2ccccc2)cc1C ZINC000730803476 1121826913 /nfs/dbraw/zinc/82/69/13/1121826913.db2.gz KCLQLEMIOAMKSF-UHFFFAOYSA-N 1 1 298.430 3.577 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)c2ccncc2)cc1 ZINC000773805693 1121859955 /nfs/dbraw/zinc/85/99/55/1121859955.db2.gz FVXGYWIJLGUSEX-OAHLLOKOSA-N 1 1 283.419 3.731 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000732184226 1121910956 /nfs/dbraw/zinc/91/09/56/1121910956.db2.gz XSONLRDOIJFQAV-CQSZACIVSA-N 1 1 294.354 3.523 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCC2CC2)c(Cl)c1 ZINC001179925995 1121923247 /nfs/dbraw/zinc/92/32/47/1121923247.db2.gz VIGSIGPSGQYYLO-UHFFFAOYSA-N 1 1 253.773 3.586 20 10 CHCDMO CC(C)C[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC001179983702 1121933271 /nfs/dbraw/zinc/93/32/71/1121933271.db2.gz FDLXYEQLDSSQLZ-AATRIKPKSA-N 1 1 272.436 3.886 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)Cc2cccs2)c1 ZINC001180057432 1121943690 /nfs/dbraw/zinc/94/36/90/1121943690.db2.gz DERLEDZESWQZJU-LBPRGKRZSA-N 1 1 291.416 3.525 20 10 CHCDMO CC[C@]1(C)CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001180080805 1121948904 /nfs/dbraw/zinc/94/89/04/1121948904.db2.gz GHGJQUPIQDWOEN-OAHLLOKOSA-N 1 1 267.800 3.976 20 10 CHCDMO CC(C)C[C@@H]1COCC[N@H+]1Cc1cc(C(C)C)ccc1O ZINC001180267103 1121968787 /nfs/dbraw/zinc/96/87/87/1121968787.db2.gz OEDSCJNAWRTIML-QGZVFWFLSA-N 1 1 291.435 3.763 20 10 CHCDMO CC(C)C[C@@H]1CC[N@@H+](Cc2cc(F)c(F)cc2[O-])C1 ZINC001180267614 1121969802 /nfs/dbraw/zinc/96/98/02/1121969802.db2.gz YUTNHOKJHKSNCX-NSHDSACASA-N 1 1 269.335 3.538 20 10 CHCDMO CC(C)C[C@@H]1CC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001180267614 1121969809 /nfs/dbraw/zinc/96/98/09/1121969809.db2.gz YUTNHOKJHKSNCX-NSHDSACASA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@H]12 ZINC001180271337 1121972514 /nfs/dbraw/zinc/97/25/14/1121972514.db2.gz ISFPEDDZHKSMQO-WQVCFCJDSA-N 1 1 277.383 3.932 20 10 CHCDMO CC[C@@](C)(C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1)OC ZINC001180558792 1121998462 /nfs/dbraw/zinc/99/84/62/1121998462.db2.gz UQTCYZRSRHIFRX-SFHVURJKSA-N 1 1 290.451 3.532 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC001180907535 1122022955 /nfs/dbraw/zinc/02/29/55/1122022955.db2.gz QGORDNOYBPEOOC-ZDUSSCGKSA-N 1 1 287.325 3.863 20 10 CHCDMO C[C@@H]1CCC[C@@H](C[NH2+]Cc2cc(F)c(F)cc2O)[C@H]1C ZINC001181233357 1122043834 /nfs/dbraw/zinc/04/38/34/1122043834.db2.gz AMZCUEKTLDGMSZ-WOPDTQHZSA-N 1 1 283.362 3.832 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCSC[C@@H]2C2CC2)c1 ZINC001181901159 1122094218 /nfs/dbraw/zinc/09/42/18/1122094218.db2.gz QTYJFXWITLAVCK-MRXNPFEDSA-N 1 1 291.460 3.843 20 10 CHCDMO CC[N@H+](Cc1c(O)ccc(Cl)c1F)C(C)(C)C ZINC001182042922 1122106300 /nfs/dbraw/zinc/10/63/00/1122106300.db2.gz FCZHXYKSCKFLLP-UHFFFAOYSA-N 1 1 259.752 3.805 20 10 CHCDMO CC[N@@H+](Cc1c(O)ccc(Cl)c1F)C(C)(C)C ZINC001182042922 1122106303 /nfs/dbraw/zinc/10/63/03/1122106303.db2.gz FCZHXYKSCKFLLP-UHFFFAOYSA-N 1 1 259.752 3.805 20 10 CHCDMO COc1cc(C)c(C[N@@H+](C)Cc2cccc(C)c2C)c(O)c1 ZINC001182008136 1122106331 /nfs/dbraw/zinc/10/63/31/1122106331.db2.gz QZUZEOVVGOIBSE-UHFFFAOYSA-N 1 1 299.414 3.958 20 10 CHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC001182184889 1122117237 /nfs/dbraw/zinc/11/72/37/1122117237.db2.gz USSRUMHXALVURL-AJNOYIKESA-N 1 1 284.447 3.888 20 10 CHCDMO CO[C@H](C)CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774168040 1122137294 /nfs/dbraw/zinc/13/72/94/1122137294.db2.gz FMQJEXFKHCKZNR-BDAKNGLRSA-N 1 1 292.206 3.775 20 10 CHCDMO COC(C)(C)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774222003 1122145582 /nfs/dbraw/zinc/14/55/82/1122145582.db2.gz ATFOTFPMDHAKLR-QMMMGPOBSA-N 1 1 292.206 3.775 20 10 CHCDMO C[C@H](O)C[C@H](C)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774355513 1122159879 /nfs/dbraw/zinc/15/98/79/1122159879.db2.gz TYZWQLPWYBDPQQ-CIUDSAMLSA-N 1 1 292.206 3.509 20 10 CHCDMO COC1CCC([N@@H+](C)Cc2cc(Cl)cc(C)c2O)CC1 ZINC000271898891 1122181422 /nfs/dbraw/zinc/18/14/22/1122181422.db2.gz YUXBJHLBPPIOCR-UHFFFAOYSA-N 1 1 297.826 3.743 20 10 CHCDMO Cc1cccc(CC[C@@H](C)[NH2+]Cc2c(O)cccc2F)c1 ZINC001183919468 1122248750 /nfs/dbraw/zinc/24/87/50/1122248750.db2.gz LICRZQOFTVCDNL-CQSZACIVSA-N 1 1 287.378 3.951 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@H](C2CCCC2)C1 ZINC001184339771 1122271573 /nfs/dbraw/zinc/27/15/73/1122271573.db2.gz SJDLNZIBLGWONC-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@H](C2CCCC2)C1 ZINC001184339771 1122271577 /nfs/dbraw/zinc/27/15/77/1122271577.db2.gz SJDLNZIBLGWONC-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO COc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)ccc1C ZINC000774815208 1122312866 /nfs/dbraw/zinc/31/28/66/1122312866.db2.gz RDDHZLBFFXQNIY-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCC=CO2)cc1 ZINC000774820872 1122316903 /nfs/dbraw/zinc/31/69/03/1122316903.db2.gz IMCQTRRUZUPQCG-GOSISDBHSA-N 1 1 288.435 3.657 20 10 CHCDMO CC(C)COCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC001190437197 1122538133 /nfs/dbraw/zinc/53/81/33/1122538133.db2.gz UPGBSUGSISTHFM-UHFFFAOYSA-N 1 1 292.467 3.636 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC001191085825 1122576284 /nfs/dbraw/zinc/57/62/84/1122576284.db2.gz TWNJBDKKVAYKSF-WMZOPIPTSA-N 1 1 272.436 3.907 20 10 CHCDMO CC[C@@H]([NH2+]CCC[NH+](CC)CC)c1cc(Cl)ccc1[O-] ZINC000775482963 1122615571 /nfs/dbraw/zinc/61/55/71/1122615571.db2.gz JKOYWAQNZJOAPO-OAHLLOKOSA-N 1 1 298.858 3.818 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@H]1C ZINC001193603177 1122705071 /nfs/dbraw/zinc/70/50/71/1122705071.db2.gz AOLPRNGGXBKFML-HOCLYGCPSA-N 1 1 260.425 3.681 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CCC(C)(C)O1 ZINC000775609987 1122799131 /nfs/dbraw/zinc/79/91/31/1122799131.db2.gz HVQLQENBRRPWND-OAHLLOKOSA-N 1 1 277.408 3.562 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)o1 ZINC000775642463 1122851434 /nfs/dbraw/zinc/85/14/34/1122851434.db2.gz KUXHOBYUEJRRNA-UHFFFAOYSA-N 1 1 279.767 3.887 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccc(Cl)s2)c1 ZINC000775645624 1122854197 /nfs/dbraw/zinc/85/41/97/1122854197.db2.gz CEMBGAMHOHBYHB-UHFFFAOYSA-N 1 1 297.807 3.748 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000775648093 1122856507 /nfs/dbraw/zinc/85/65/07/1122856507.db2.gz QPHOARKHUVGIHI-KRWDZBQOSA-N 1 1 297.398 3.608 20 10 CHCDMO Cc1cccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1O ZINC000775657547 1122871316 /nfs/dbraw/zinc/87/13/16/1122871316.db2.gz CVAVDQRQQDIJQQ-AWEZNQCLSA-N 1 1 283.371 3.656 20 10 CHCDMO CCC(C)(C)[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775689339 1122909055 /nfs/dbraw/zinc/90/90/55/1122909055.db2.gz GZTYGHHNNPUBLM-UHFFFAOYSA-N 1 1 255.789 3.974 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1 ZINC000775702331 1122913881 /nfs/dbraw/zinc/91/38/81/1122913881.db2.gz QAIALTXJPQFYDL-GOEBONIOSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCS[C@H](C)[C@H]2C)c1O ZINC000775702382 1122914253 /nfs/dbraw/zinc/91/42/53/1122914253.db2.gz RZDMJBLKPBJJJA-GHMZBOCLSA-N 1 1 285.840 3.680 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c1O ZINC000775726649 1122926919 /nfs/dbraw/zinc/92/69/19/1122926919.db2.gz YTQAHJWSAGHSCM-INIZCTEOSA-N 1 1 271.335 3.787 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1O ZINC000775735572 1122929023 /nfs/dbraw/zinc/92/90/23/1122929023.db2.gz WOYZNCZOUMBWTM-WMLDXEAASA-N 1 1 267.372 3.894 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C/C=C/c2ccccc2)cc1 ZINC001203937862 1123033680 /nfs/dbraw/zinc/03/36/80/1123033680.db2.gz WBMPQNBGYZYRMV-JXMROGBWSA-N 1 1 280.415 3.898 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(F)cc1O ZINC000850482265 1123273656 /nfs/dbraw/zinc/27/36/56/1123273656.db2.gz NDGYAKIBBMJZKX-DOMZBBRYSA-N 1 1 288.366 3.771 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cscn1 ZINC000850511996 1123278924 /nfs/dbraw/zinc/27/89/24/1123278924.db2.gz SUAQUMIXMYOSGL-DTWKUNHWSA-N 1 1 282.796 3.914 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CCC[C@H](C)O1)c1ccc(F)cc1O ZINC000850535693 1123286671 /nfs/dbraw/zinc/28/66/71/1123286671.db2.gz ZJKJLVBCAYZLHI-LNSITVRQSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@H]([NH2+]CCCc1ccco1)c1ccc(Cl)cc1O ZINC000850569691 1123294227 /nfs/dbraw/zinc/29/42/27/1123294227.db2.gz MPRCDLDXVRVPFO-NSHDSACASA-N 1 1 279.767 3.922 20 10 CHCDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccccc1O ZINC000109769176 1123326608 /nfs/dbraw/zinc/32/66/08/1123326608.db2.gz YCBBDYVNTFBWNC-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1ccccc1O ZINC000109773824 1123326770 /nfs/dbraw/zinc/32/67/70/1123326770.db2.gz DEQVJTDEPKFVFL-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1cscn1)C1CCCC1 ZINC000113506126 1123529802 /nfs/dbraw/zinc/52/98/02/1123529802.db2.gz IIQNYSWJFHLLLR-UHFFFAOYSA-N 1 1 288.416 3.794 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(Cl)cc1O ZINC000857080853 1123585142 /nfs/dbraw/zinc/58/51/42/1123585142.db2.gz LGMTTZBQSXJGIQ-BDAKNGLRSA-N 1 1 275.726 3.742 20 10 CHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1C1CC1 ZINC000862239194 1123794257 /nfs/dbraw/zinc/79/42/57/1123794257.db2.gz YRSKCCXCBCZWBM-ZDUSSCGKSA-N 1 1 296.208 3.529 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cc1C ZINC000862444485 1123810756 /nfs/dbraw/zinc/81/07/56/1123810756.db2.gz XGDYLZWKZDRFCD-BETUJISGSA-N 1 1 283.362 3.732 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1C ZINC000862540818 1123817820 /nfs/dbraw/zinc/81/78/20/1123817820.db2.gz KOJWCEPTDBEEHW-INIZCTEOSA-N 1 1 297.398 3.704 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000119376066 1123857323 /nfs/dbraw/zinc/85/73/23/1123857323.db2.gz GRXBMXHLNWVJHJ-AWEZNQCLSA-N 1 1 285.387 3.984 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC3(CCC3)C[C@@H]2C)c1O ZINC000763644827 1129150865 /nfs/dbraw/zinc/15/08/65/1129150865.db2.gz ADRZVTADAVHPDK-NSHDSACASA-N 1 1 295.810 3.819 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC3(CCC3)C[C@@H]2C)c(O)c1 ZINC000763645536 1129153551 /nfs/dbraw/zinc/15/35/51/1129153551.db2.gz HQHWAQLPKPULPW-ZDUSSCGKSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](CC2CC2)CC2CCC2)c1O ZINC000794711437 1123941992 /nfs/dbraw/zinc/94/19/92/1123941992.db2.gz RWUUYYATFHMIPS-UHFFFAOYSA-N 1 1 289.419 3.721 20 10 CHCDMO CCCN1CCC([NH2+][C@@H](CC)c2ccc(C)cc2O)CC1 ZINC000794789884 1123948824 /nfs/dbraw/zinc/94/88/24/1123948824.db2.gz AVBDMQNRTNNGCQ-KRWDZBQOSA-N 1 1 290.451 3.616 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1 ZINC000783592787 1124001693 /nfs/dbraw/zinc/00/16/93/1124001693.db2.gz KLDRFSWRTMLTFV-RRQGHBQHSA-N 1 1 289.419 3.801 20 10 CHCDMO CN(C)c1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1 ZINC000865823059 1124017769 /nfs/dbraw/zinc/01/77/69/1124017769.db2.gz REECPPPNAPGGDE-QGZVFWFLSA-N 1 1 290.357 3.692 20 10 CHCDMO CC(C)[N@@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000121320292 1124024973 /nfs/dbraw/zinc/02/49/73/1124024973.db2.gz GMRWAHBRESXVKT-UHFFFAOYSA-N 1 1 284.197 3.528 20 10 CHCDMO C[C@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866622557 1124091487 /nfs/dbraw/zinc/09/14/87/1124091487.db2.gz GVRUKCPRKPCPCP-LRDDRELGSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc(N)cc1 ZINC001120370825 1131274600 /nfs/dbraw/zinc/27/46/00/1131274600.db2.gz GOGFBAGOKGDEHO-RDTXWAMCSA-N 1 1 266.388 3.647 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c(O)c1 ZINC000872259658 1124699251 /nfs/dbraw/zinc/69/92/51/1124699251.db2.gz FPMGZLWAQDJYPL-KRWDZBQOSA-N 1 1 289.419 3.624 20 10 CHCDMO CCOc1cccc(C[N@@H+](Cc2ccccc2)C2CC2)c1O ZINC000125425008 1124891109 /nfs/dbraw/zinc/89/11/09/1124891109.db2.gz HNBBXEGFZUOIBY-UHFFFAOYSA-N 1 1 297.398 3.956 20 10 CHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2csc(C)n2)cc1 ZINC000126556128 1125032535 /nfs/dbraw/zinc/03/25/35/1125032535.db2.gz NBYKQHWNCIOONS-LBPRGKRZSA-N 1 1 289.448 3.758 20 10 CHCDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c(O)c1 ZINC000877548699 1125043586 /nfs/dbraw/zinc/04/35/86/1125043586.db2.gz RRAOFKJHKCJCTB-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO CSC1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000877663101 1125061591 /nfs/dbraw/zinc/06/15/91/1125061591.db2.gz GMEOZAPULGXDGE-UHFFFAOYSA-N 1 1 289.803 3.512 20 10 CHCDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000877795429 1125079524 /nfs/dbraw/zinc/07/95/24/1125079524.db2.gz KPERXHWFRBECDX-INIZCTEOSA-N 1 1 299.414 3.528 20 10 CHCDMO Cc1cc([O-])c(C[NH2+]C(C)(C)CCC[NH+](C)C)cc1Cl ZINC000826064167 1125173039 /nfs/dbraw/zinc/17/30/39/1125173039.db2.gz FYEFOVDOMTZKFS-UHFFFAOYSA-N 1 1 298.858 3.564 20 10 CHCDMO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879652372 1125223600 /nfs/dbraw/zinc/22/36/00/1125223600.db2.gz ZJBURHNUOVDKLC-NWDGAFQWSA-N 1 1 289.379 3.530 20 10 CHCDMO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1O ZINC000879650725 1125224600 /nfs/dbraw/zinc/22/46/00/1125224600.db2.gz POACVQVLWBMASB-NSHDSACASA-N 1 1 274.364 3.529 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)c1O ZINC000130808666 1125368882 /nfs/dbraw/zinc/36/88/82/1125368882.db2.gz JJSIZSUGHFRTIP-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO CC[C@H]([NH2+][C@@H](CC)[C@H]1CCCOC1)c1ccc(F)cc1O ZINC000883352975 1125400380 /nfs/dbraw/zinc/40/03/80/1125400380.db2.gz LVDSUBYHAJTGGN-RCBQFDQVSA-N 1 1 295.398 3.777 20 10 CHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2)ccc1N(C)C ZINC001139669675 1131354144 /nfs/dbraw/zinc/35/41/44/1131354144.db2.gz GUIBHZWKYVMSRP-UHFFFAOYSA-N 1 1 286.394 3.832 20 10 CHCDMO CCC(CC)C[N@@H+](CC)Cc1cc(OC)ccc1O ZINC000132928756 1125427877 /nfs/dbraw/zinc/42/78/77/1125427877.db2.gz HRMZJUPFYRHZAN-UHFFFAOYSA-N 1 1 265.397 3.659 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@@H](C)CC2)ccc1N(C)C ZINC001139669737 1131355994 /nfs/dbraw/zinc/35/59/94/1131355994.db2.gz KECHHBWXBQMRPL-CQSZACIVSA-N 1 1 260.425 3.683 20 10 CHCDMO Cc1cc(C[N@H+]2CCCC[C@](C)(F)C2)ccc1N(C)C ZINC001139669739 1131356121 /nfs/dbraw/zinc/35/61/21/1131356121.db2.gz KGWCVRPFWBYCGT-KRWDZBQOSA-N 1 1 278.415 3.775 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1c(O)ccc2ccncc21 ZINC000799389312 1129207354 /nfs/dbraw/zinc/20/73/54/1129207354.db2.gz AINDSOKXXZLDFD-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO C[C@H]([NH2+]CCCC(C)(F)F)c1ccc(F)cc1O ZINC000297236157 1129225480 /nfs/dbraw/zinc/22/54/80/1129225480.db2.gz ICRIKVXFSZUPQI-VIFPVBQESA-N 1 1 261.287 3.617 20 10 CHCDMO COCCCCC[N@H+](CC(C)C)c1ccc(OC)cc1 ZINC000735078742 1129330540 /nfs/dbraw/zinc/33/05/40/1129330540.db2.gz TZNBKIKICFNKMD-UHFFFAOYSA-N 1 1 279.424 3.974 20 10 CHCDMO COCCCCC[N@@H+](CC(C)C)c1ccc(OC)cc1 ZINC000735078742 1129330544 /nfs/dbraw/zinc/33/05/44/1129330544.db2.gz TZNBKIKICFNKMD-UHFFFAOYSA-N 1 1 279.424 3.974 20 10 CHCDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000091974431 1129376122 /nfs/dbraw/zinc/37/61/22/1129376122.db2.gz QFRVYBNEOQMGLH-DOMZBBRYSA-N 1 1 271.360 3.741 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000092709750 1129405659 /nfs/dbraw/zinc/40/56/59/1129405659.db2.gz FHSNDIBWQSJLNL-BBRMVZONSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(C)ccc3O)C2)cc1 ZINC000092783527 1129407438 /nfs/dbraw/zinc/40/74/38/1129407438.db2.gz OCBIRTRAIZSUOE-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093275597 1129420572 /nfs/dbraw/zinc/42/05/72/1129420572.db2.gz INPTXEKVHGBAAF-LBPRGKRZSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2cccc(O)c2)cc1C ZINC000093315581 1129421285 /nfs/dbraw/zinc/42/12/85/1129421285.db2.gz ZTQHIBJDVSZOOC-CQSZACIVSA-N 1 1 285.387 3.908 20 10 CHCDMO Cn1ccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000093319262 1129421501 /nfs/dbraw/zinc/42/15/01/1129421501.db2.gz AXROBKQDGOGCMM-UHFFFAOYSA-N 1 1 284.403 3.676 20 10 CHCDMO CC[N@H+](Cc1cc(C)ccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000093641123 1129426924 /nfs/dbraw/zinc/42/69/24/1129426924.db2.gz FUCNNJFOEYBJNQ-LJQANCHMSA-N 1 1 299.414 3.565 20 10 CHCDMO C[N@@H+](CCCCF)Cc1ccc(N2CCCCC2)cc1 ZINC000795851744 1129452693 /nfs/dbraw/zinc/45/26/93/1129452693.db2.gz HFKZUAMVTPYOQR-UHFFFAOYSA-N 1 1 278.415 3.858 20 10 CHCDMO C[N@@H+](CCCCOc1ccccc1)Cc1ccccc1O ZINC000741786066 1129452936 /nfs/dbraw/zinc/45/29/36/1129452936.db2.gz VBPUZTSKHCHRBH-UHFFFAOYSA-N 1 1 285.387 3.683 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCCCF)Cc1ccco1 ZINC000795954116 1129460919 /nfs/dbraw/zinc/46/09/19/1129460919.db2.gz YRLREYLGWOHTPQ-UHFFFAOYSA-N 1 1 277.339 3.737 20 10 CHCDMO CCC[N@@H+](CCOc1ccccc1)Cc1ccccc1O ZINC000303145865 1129529991 /nfs/dbraw/zinc/52/99/91/1129529991.db2.gz RVJREPQXJBAXKQ-UHFFFAOYSA-N 1 1 285.387 3.683 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccccc1N(C)C ZINC000743869802 1129542313 /nfs/dbraw/zinc/54/23/13/1129542313.db2.gz ANAZWVIEXJVFRI-UHFFFAOYSA-N 1 1 298.430 3.870 20 10 CHCDMO CN1CCC(C)(C)c2cc(C3=CCC[N@@H+](C)C3)ccc21 ZINC001241571993 1129584746 /nfs/dbraw/zinc/58/47/46/1129584746.db2.gz MSSVLKNOYHPZMW-UHFFFAOYSA-N 1 1 270.420 3.523 20 10 CHCDMO CO[C@@H](C[N@@H+](Cc1ccccc1O)C1CCCC1)C1CC1 ZINC000822622182 1131389738 /nfs/dbraw/zinc/38/97/38/1131389738.db2.gz UNLXDIFHIVVDEX-SFHVURJKSA-N 1 1 289.419 3.562 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc(F)c2)cc1F ZINC000768159391 1129835887 /nfs/dbraw/zinc/83/58/87/1129835887.db2.gz DPECICKLEYKQCU-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO CCCC[N@@H+](CCO)Cc1cc(-c2ccccc2)ccc1O ZINC000768139119 1129836537 /nfs/dbraw/zinc/83/65/37/1129836537.db2.gz BDCDRXJGAVAODR-UHFFFAOYSA-N 1 1 299.414 3.654 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000016081372 1129839965 /nfs/dbraw/zinc/83/99/65/1129839965.db2.gz AQWIPQYCXQNMSE-UHFFFAOYSA-N 1 1 299.370 3.532 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)Cc1ccc(F)cc1F ZINC000768232486 1129845263 /nfs/dbraw/zinc/84/52/63/1129845263.db2.gz BEFRXXWMYWVJPM-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)Cc1ccc(F)cc1F ZINC000768232486 1129845269 /nfs/dbraw/zinc/84/52/69/1129845269.db2.gz BEFRXXWMYWVJPM-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000768231642 1129845286 /nfs/dbraw/zinc/84/52/86/1129845286.db2.gz VFPALRQVVSUHQY-UHFFFAOYSA-N 1 1 283.371 3.565 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000768229558 1129845983 /nfs/dbraw/zinc/84/59/83/1129845983.db2.gz LSMSPSFEMORADD-UHFFFAOYSA-N 1 1 297.398 3.956 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2cccc(C)c2)c1O ZINC000768263808 1129847897 /nfs/dbraw/zinc/84/78/97/1129847897.db2.gz WADMUIXRJHCHPP-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c(O)c1 ZINC000768263576 1129847982 /nfs/dbraw/zinc/84/79/82/1129847982.db2.gz VCHOFLNPIBZLTP-DZGCQCFKSA-N 1 1 277.408 3.801 20 10 CHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCSC1 ZINC000768262094 1129848972 /nfs/dbraw/zinc/84/89/72/1129848972.db2.gz GJECRCDWCKRRQL-QGZVFWFLSA-N 1 1 299.439 3.997 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCCc2ccccc2)c1 ZINC000768337782 1129852533 /nfs/dbraw/zinc/85/25/33/1129852533.db2.gz VOSJHWUMVRBQSZ-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC000768354956 1129853059 /nfs/dbraw/zinc/85/30/59/1129853059.db2.gz LCPDNNNVFYKJCJ-SFHVURJKSA-N 1 1 299.393 3.624 20 10 CHCDMO CC(C)[N@@H+](Cc1ccoc1)Cc1ccc(N(C)C)cc1 ZINC000768353454 1129853403 /nfs/dbraw/zinc/85/34/03/1129853403.db2.gz UXVLYXKXDPGLIO-UHFFFAOYSA-N 1 1 272.392 3.756 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CC1)CCCC2 ZINC000768452049 1129857917 /nfs/dbraw/zinc/85/79/17/1129857917.db2.gz NQKLCDMWALPOJR-QGZVFWFLSA-N 1 1 271.404 3.645 20 10 CHCDMO CSC[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000768462452 1129858855 /nfs/dbraw/zinc/85/88/55/1129858855.db2.gz LNVPXHYLWFCWNE-INIZCTEOSA-N 1 1 291.460 3.598 20 10 CHCDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(OC)ccc1O ZINC000768530291 1129859754 /nfs/dbraw/zinc/85/97/54/1129859754.db2.gz HICGNAOXLJHBGA-KRWDZBQOSA-N 1 1 297.398 3.738 20 10 CHCDMO COCC[N@@H+](Cc1cc(C)ccc1O)[C@@H](C)c1ccccc1 ZINC000768598277 1129864917 /nfs/dbraw/zinc/86/49/17/1129864917.db2.gz XCPRULGZXFQCOE-INIZCTEOSA-N 1 1 299.414 3.910 20 10 CHCDMO CC[N@@H+](CCc1cccs1)Cc1cc(C)ccc1O ZINC000768761531 1129870183 /nfs/dbraw/zinc/87/01/83/1129870183.db2.gz XGDRCPZTZHNSRY-UHFFFAOYSA-N 1 1 275.417 3.827 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)CCCOc2ccccc2)c1 ZINC000768825207 1129876362 /nfs/dbraw/zinc/87/63/62/1129876362.db2.gz JFJHESRABBQMFZ-UHFFFAOYSA-N 1 1 285.387 3.602 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1nccc2ccccc21 ZINC000768872926 1129878272 /nfs/dbraw/zinc/87/82/72/1129878272.db2.gz LTJHSSZMIDECRK-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccoc2)cc1F ZINC000769005285 1129888610 /nfs/dbraw/zinc/88/86/10/1129888610.db2.gz QJGYNKPGZWTCKI-UHFFFAOYSA-N 1 1 290.382 3.897 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CC=CCC1 ZINC000769201087 1129896580 /nfs/dbraw/zinc/89/65/80/1129896580.db2.gz QQTIZYHKEXXJLJ-HNNXBMFYSA-N 1 1 259.393 3.961 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000769426056 1129907298 /nfs/dbraw/zinc/90/72/98/1129907298.db2.gz BHISOHMDBCKZMX-SFHVURJKSA-N 1 1 287.403 3.723 20 10 CHCDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1c(O)cccc1OC ZINC000769488610 1129909704 /nfs/dbraw/zinc/90/97/04/1129909704.db2.gz GKAOMZDUAPQNFK-MRXNPFEDSA-N 1 1 299.414 3.854 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000769498654 1129914135 /nfs/dbraw/zinc/91/41/35/1129914135.db2.gz NTUSHKQWBQQRHK-ZBFHGGJFSA-N 1 1 297.398 3.779 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc[nH]2)cc1F ZINC000769542324 1129914595 /nfs/dbraw/zinc/91/45/95/1129914595.db2.gz GBSCDGHQWFJWNW-UHFFFAOYSA-N 1 1 289.398 3.632 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000769516313 1129914851 /nfs/dbraw/zinc/91/48/51/1129914851.db2.gz SBVXAUHEQSBAHA-GOSISDBHSA-N 1 1 284.447 3.909 20 10 CHCDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1c(O)cccc1OC ZINC000769536649 1129916218 /nfs/dbraw/zinc/91/62/18/1129916218.db2.gz CEAKINSKSOFHON-ZFWWWQNUSA-N 1 1 277.408 3.801 20 10 CHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549028 1129916842 /nfs/dbraw/zinc/91/68/42/1129916842.db2.gz JUWGXIWUTIPHAI-STQMWFEESA-N 1 1 295.448 3.507 20 10 CHCDMO CCCC[N@@H+](CCC(F)(F)F)Cc1ccccc1O ZINC000801595530 1129930929 /nfs/dbraw/zinc/93/09/29/1129930929.db2.gz MWSUMWZHZTZBHX-UHFFFAOYSA-N 1 1 275.314 3.947 20 10 CHCDMO C[C@@H]([N@H+](C)Cc1cc(Br)ccc1O)C1(C)CC1 ZINC000770288131 1129943998 /nfs/dbraw/zinc/94/39/98/1129943998.db2.gz FWQKUHNNBIJGHU-SNVBAGLBSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]([N@@H+](C)Cc1cc(Br)ccc1O)C1(C)CC1 ZINC000770288131 1129944000 /nfs/dbraw/zinc/94/40/00/1129944000.db2.gz FWQKUHNNBIJGHU-SNVBAGLBSA-N 1 1 298.224 3.775 20 10 CHCDMO CCCCC[C@H]1CCC[N@H+]1Cc1cccc(OC)c1O ZINC000770353285 1129945915 /nfs/dbraw/zinc/94/59/15/1129945915.db2.gz ZFIDMXFZTVZCMY-HNNXBMFYSA-N 1 1 277.408 3.946 20 10 CHCDMO Cc1ccc(C[C@H]2CCC[N@H+]2Cc2ccccc2O)cc1 ZINC000770509478 1129948993 /nfs/dbraw/zinc/94/89/93/1129948993.db2.gz AESDQDZTFVJWJS-GOSISDBHSA-N 1 1 281.399 3.908 20 10 CHCDMO C[N@@H+](Cc1ccoc1)Cc1ccc(N2CCCCC2)cc1 ZINC000771935399 1129996285 /nfs/dbraw/zinc/99/62/85/1129996285.db2.gz RDGVURLHIQXLMQ-UHFFFAOYSA-N 1 1 284.403 3.902 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1c(O)cccc1F ZINC000903284001 1130145979 /nfs/dbraw/zinc/14/59/79/1130145979.db2.gz UEZKAFYXFHAZLE-WDEREUQCSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(F)cc1O ZINC000903427216 1130175506 /nfs/dbraw/zinc/17/55/06/1130175506.db2.gz FYNZHJNWJWDMRZ-PIGZYNQJSA-N 1 1 286.350 3.728 20 10 CHCDMO C[C@H]1C[C@@H]1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444032 1130186884 /nfs/dbraw/zinc/18/68/84/1130186884.db2.gz WOYVJIFKGLJCDY-DZGCQCFKSA-N 1 1 271.360 3.643 20 10 CHCDMO 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/nfs/dbraw/zinc/12/85/44/1131128544.db2.gz YJAODBNBXLCQOU-UHFFFAOYSA-N 1 1 253.773 3.586 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c1O ZINC001237687802 1131128595 /nfs/dbraw/zinc/12/85/95/1131128595.db2.gz VHTMLUWJEUIEBP-JQWIXIFHSA-N 1 1 267.800 3.974 20 10 CHCDMO [O-]c1c(Cl)cc(F)cc1C[N@H+]1CCc2ccccc2C1 ZINC001237810589 1131142376 /nfs/dbraw/zinc/14/23/76/1131142376.db2.gz QPFDQIFFXALTGI-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO [O-]c1c(Cl)cc(F)cc1CN1CCc2ccccc2C1 ZINC001237810589 1131142381 /nfs/dbraw/zinc/14/23/81/1131142381.db2.gz QPFDQIFFXALTGI-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237807857 1131143425 /nfs/dbraw/zinc/14/34/25/1131143425.db2.gz NIAVZIYROLCYJQ-UHFFFAOYSA-N 1 1 257.736 3.559 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@H](C)S1 ZINC001116442438 1131146358 /nfs/dbraw/zinc/14/63/58/1131146358.db2.gz WUQJZCVIAQSIAQ-GASCZTMLSA-N 1 1 290.476 3.613 20 10 CHCDMO CC(C)CC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116443881 1131146504 /nfs/dbraw/zinc/14/65/04/1131146504.db2.gz HBVZVANRNZIIPD-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+](C)Cc2cccs2)c1O ZINC001238061925 1131166063 /nfs/dbraw/zinc/16/60/63/1131166063.db2.gz LQSSHSWGALINHJ-UHFFFAOYSA-N 1 1 265.353 3.533 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC001238063422 1131167063 /nfs/dbraw/zinc/16/70/63/1131167063.db2.gz WDPMIRKUTBRFGG-MRXNPFEDSA-N 1 1 286.350 3.572 20 10 CHCDMO CCC([NH3+])(CC)CN[C@H](C)c1cc(Cl)cc(C)c1O ZINC000817960859 1131192364 /nfs/dbraw/zinc/19/23/64/1131192364.db2.gz RWPOAJVHYXMIHW-LLVKDONJSA-N 1 1 284.831 3.522 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001137832950 1131420622 /nfs/dbraw/zinc/42/06/22/1131420622.db2.gz NGESOHISOQDZBS-UHFFFAOYSA-N 1 1 263.356 3.688 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001137832950 1131420626 /nfs/dbraw/zinc/42/06/26/1131420626.db2.gz NGESOHISOQDZBS-UHFFFAOYSA-N 1 1 263.356 3.688 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](c3cccnc3)C2)cc1 ZINC000829522485 1131423109 /nfs/dbraw/zinc/42/31/09/1131423109.db2.gz JOSBONHCGNKALK-SFHVURJKSA-N 1 1 295.430 3.527 20 10 CHCDMO COC[C@@H]1CC[N@@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854420 1131424021 /nfs/dbraw/zinc/42/40/21/1131424021.db2.gz VNOKKPSVIVPMQO-QGZVFWFLSA-N 1 1 298.430 3.562 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc3cccnc3o2)cc1 ZINC000823372098 1131424216 /nfs/dbraw/zinc/42/42/16/1131424216.db2.gz UTOWGLALTFKQFC-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO Cc1ccc(F)c(C[N@H+](C)Cc2ccccc2O)c1F ZINC001138120064 1131468906 /nfs/dbraw/zinc/46/89/06/1131468906.db2.gz ZOYZZYYFKPOMGF-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2ccccc2O)c1F ZINC001138120064 1131468907 /nfs/dbraw/zinc/46/89/07/1131468907.db2.gz ZOYZZYYFKPOMGF-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO C[C@]1(F)CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000824472578 1131470512 /nfs/dbraw/zinc/47/05/12/1131470512.db2.gz VLPIONJSEGHCPV-KRWDZBQOSA-N 1 1 273.351 3.869 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCCC12CC2 ZINC001138213879 1131477816 /nfs/dbraw/zinc/47/78/16/1131477816.db2.gz DNHXRWWYFKEFDY-UHFFFAOYSA-N 1 1 270.420 3.805 20 10 CHCDMO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138215733 1131478128 /nfs/dbraw/zinc/47/81/28/1131478128.db2.gz RRPHEELARQYUCR-GDBMZVCRSA-N 1 1 276.399 3.609 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138356330 1131493644 /nfs/dbraw/zinc/49/36/44/1131493644.db2.gz LCJIMLBHGWSAQG-UHFFFAOYSA-N 1 1 260.425 3.689 20 10 CHCDMO COc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1O ZINC000825103432 1131496278 /nfs/dbraw/zinc/49/62/78/1131496278.db2.gz FGEBBNMPTWMNBS-KRWDZBQOSA-N 1 1 299.370 3.721 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC2CC2)c(OC)c1 ZINC001138388893 1131497195 /nfs/dbraw/zinc/49/71/95/1131497195.db2.gz AELPEGOXVAXROM-UHFFFAOYSA-N 1 1 290.451 3.773 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1c[nH]c3cccc(F)c13)CC2 ZINC001136986963 1131498960 /nfs/dbraw/zinc/49/89/60/1131498960.db2.gz 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/nfs/dbraw/zinc/62/77/01/1131627701.db2.gz CZMASXAHFVQDOW-UKRRQHHQSA-N 1 1 260.425 3.681 20 10 CHCDMO CC[N@@H+](Cc1ccc(COC)s1)Cc1ccccc1O ZINC001139831658 1131640252 /nfs/dbraw/zinc/64/02/52/1131640252.db2.gz YDSWWPWWKOQTEX-UHFFFAOYSA-N 1 1 291.416 3.622 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140178924 1131672905 /nfs/dbraw/zinc/67/29/05/1131672905.db2.gz CVZXZRBNGCNVOT-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCc3ccccc3C2)c1O ZINC001140180976 1131672941 /nfs/dbraw/zinc/67/29/41/1131672941.db2.gz RRTFIINBTGRIPO-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1O ZINC001140181649 1131673508 /nfs/dbraw/zinc/67/35/08/1131673508.db2.gz DVILAVAMDADMRB-GOSISDBHSA-N 1 1 297.398 3.583 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(O)cc1C)Cc1ccccc1O ZINC001140201822 1131676110 /nfs/dbraw/zinc/67/61/10/1131676110.db2.gz BUZUTTAKYCPNCZ-UHFFFAOYSA-N 1 1 285.387 3.737 20 10 CHCDMO C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)c1ccc(F)cc1O ZINC000846184646 1131697687 /nfs/dbraw/zinc/69/76/87/1131697687.db2.gz MMSZVTYLWKZWRY-HERUPUMHSA-N 1 1 289.753 3.887 20 10 CHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC001140338116 1131702696 /nfs/dbraw/zinc/70/26/96/1131702696.db2.gz VSHJFYZUDSVVPH-UHFFFAOYSA-N 1 1 289.753 3.913 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCCC2(CCC2)C1 ZINC001140342807 1131704755 /nfs/dbraw/zinc/70/47/55/1131704755.db2.gz ZAMIRNBQGHBGMG-UHFFFAOYSA-N 1 1 265.784 3.812 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000834885116 1131718865 /nfs/dbraw/zinc/71/88/65/1131718865.db2.gz SZLGMIIZZFEAEF-UHFFFAOYSA-N 1 1 292.382 3.963 20 10 CHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1ccc(Cl)cc1O ZINC001140461029 1131747992 /nfs/dbraw/zinc/74/79/92/1131747992.db2.gz BURVVIVASIGAKI-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001140463108 1131748971 /nfs/dbraw/zinc/74/89/71/1131748971.db2.gz SOMMIQVHWMQHPV-TXEJJXNPSA-N 1 1 265.784 3.668 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001140465430 1131750302 /nfs/dbraw/zinc/75/03/02/1131750302.db2.gz NAGBPWHMYKRBBB-SMDDNHRTSA-N 1 1 265.784 3.810 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1ccc(Cl)cc1O ZINC001140465927 1131750680 /nfs/dbraw/zinc/75/06/80/1131750680.db2.gz WHHDMLZIUVBBJQ-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO C[C@@H](c1ccncc1)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835046969 1131763381 /nfs/dbraw/zinc/76/33/81/1131763381.db2.gz AZQDGUXOEXAWBV-JFDDCEBESA-N 1 1 295.430 3.854 20 10 CHCDMO C[N@H+](CCCC[NH2+]Cc1ccc2ccccc2c1[O-])C1CC1 ZINC000835063425 1131768557 /nfs/dbraw/zinc/76/85/57/1131768557.db2.gz LFNUVKBWYHOFKN-UHFFFAOYSA-N 1 1 298.430 3.509 20 10 CHCDMO C[N@@H+](CCCC[NH2+]Cc1ccc2ccccc2c1[O-])C1CC1 ZINC000835063425 1131768566 /nfs/dbraw/zinc/76/85/66/1131768566.db2.gz LFNUVKBWYHOFKN-UHFFFAOYSA-N 1 1 298.430 3.509 20 10 CHCDMO COc1ccc2c(c1)C[N@H+](Cc1cc(C)ccc1O)CCC2 ZINC001140624494 1131832770 /nfs/dbraw/zinc/83/27/70/1131832770.db2.gz YINLVHNRPJXYAT-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc2ccncc21 ZINC001140644238 1131844064 /nfs/dbraw/zinc/84/40/64/1131844064.db2.gz FOWFCTASVQWKTO-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO Cc1c(O)ccc(C[N@H+](Cc2ccccc2)C(C)C)c1O ZINC001140742731 1131905764 /nfs/dbraw/zinc/90/57/64/1131905764.db2.gz XBDJCLPWONJWPK-UHFFFAOYSA-N 1 1 285.387 3.817 20 10 CHCDMO CCCC[N@@H+](CC)Cc1ccc(N(CC)CC)cc1O ZINC001140852054 1131947577 /nfs/dbraw/zinc/94/75/77/1131947577.db2.gz ZXNHTIKIRQXXNA-UHFFFAOYSA-N 1 1 278.440 3.860 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1Cl)C(C)C ZINC001140921805 1131962869 /nfs/dbraw/zinc/96/28/69/1131962869.db2.gz QTOIQNFRBKXRMK-UHFFFAOYSA-N 1 1 254.805 3.636 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c(Cl)c1 ZINC001140922256 1131963793 /nfs/dbraw/zinc/96/37/93/1131963793.db2.gz LWPQBZGCZCNSSH-OAHLLOKOSA-N 1 1 284.806 3.730 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@](C)(F)C2)c(Cl)c1 ZINC001140922256 1131963796 /nfs/dbraw/zinc/96/37/96/1131963796.db2.gz LWPQBZGCZCNSSH-OAHLLOKOSA-N 1 1 284.806 3.730 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccccc2Cl)c(O)c1 ZINC001140949716 1131968785 /nfs/dbraw/zinc/96/87/85/1131968785.db2.gz JHKVMJOSSUKKRT-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Cc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC001140948173 1131968993 /nfs/dbraw/zinc/96/89/93/1131968993.db2.gz WOKYUZPDNXAFNG-AWEZNQCLSA-N 1 1 267.372 3.820 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC001140948057 1131969861 /nfs/dbraw/zinc/96/98/61/1131969861.db2.gz RBIUYRBEBWMLBV-CQSZACIVSA-N 1 1 267.372 3.820 20 10 CHCDMO Cc1ccncc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001141035157 1131990860 /nfs/dbraw/zinc/99/08/60/1131990860.db2.gz JQPYHBAATGJJGK-UHFFFAOYSA-N 1 1 295.430 3.622 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076467 1132006320 /nfs/dbraw/zinc/00/63/20/1132006320.db2.gz SLSVPWFKPZCTHN-SFHVURJKSA-N 1 1 284.447 3.760 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cc(O)ccc1O 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C[C@H]1[C@@H](C)[N@H+](Cc2c(O)ccc(Cl)c2F)C[C@H]1C ZINC001206342871 1133692420 /nfs/dbraw/zinc/69/24/20/1133692420.db2.gz MRHLZOWJTJKEBH-OPRDCNLKSA-N 1 1 271.763 3.661 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC001207621474 1133832795 /nfs/dbraw/zinc/83/27/95/1133832795.db2.gz GCUXTCMAFBMTCB-UHFFFAOYSA-N 1 1 283.705 3.614 20 10 CHCDMO Cc1ccc([C@@H](C)CC[N@H+]2CCc3cccc(O)c3C2)o1 ZINC001208165851 1133893154 /nfs/dbraw/zinc/89/31/54/1133893154.db2.gz HFDHGCUQRCLRHV-ZDUSSCGKSA-N 1 1 285.387 3.846 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1 ZINC001209516204 1134033000 /nfs/dbraw/zinc/03/30/00/1134033000.db2.gz CPJUGMZBYUBPQS-YTQUADARSA-N 1 1 298.405 3.884 20 10 CHCDMO CCC[N@@H+](Cc1cnc(C)s1)Cc1ccccc1O ZINC000075829103 260291935 /nfs/dbraw/zinc/29/19/35/260291935.db2.gz MFLRYBVPGHJFJL-UHFFFAOYSA-N 1 1 276.405 3.569 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000162703326 261291508 /nfs/dbraw/zinc/29/15/08/261291508.db2.gz SNCCVICAGOQUOK-CYBMUJFWSA-N 1 1 289.400 3.799 20 10 CHCDMO CCC[N@@H+](Cc1c(C)onc1CC)Cc1ccccc1O ZINC000163378612 261314138 /nfs/dbraw/zinc/31/41/38/261314138.db2.gz ZSMNPZAIKILBDV-UHFFFAOYSA-N 1 1 288.391 3.663 20 10 CHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(C)c(C)cc2O)no1 ZINC000369991627 267281853 /nfs/dbraw/zinc/28/18/53/267281853.db2.gz TXPNRFLZIUSCMW-MRXNPFEDSA-N 1 1 286.375 3.643 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCOC(C)(C)C1 ZINC000289975680 521320404 /nfs/dbraw/zinc/32/04/04/521320404.db2.gz XHHXCZCJIWNQFV-KRWDZBQOSA-N 1 1 290.451 3.532 20 10 CHCDMO CCC[N@@H+](Cc1nc(C)cs1)Cc1ccccc1O ZINC000088602563 521694059 /nfs/dbraw/zinc/69/40/59/521694059.db2.gz ASWCBBQSFHMKCK-UHFFFAOYSA-N 1 1 276.405 3.569 20 10 CHCDMO CC[C@H]([NH2+]CC1CCSCC1)c1ccc(F)cc1O ZINC000285976836 522577921 /nfs/dbraw/zinc/57/79/21/522577921.db2.gz HKOLSPLQGLMFSA-AWEZNQCLSA-N 1 1 283.412 3.715 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000286107486 522598290 /nfs/dbraw/zinc/59/82/90/522598290.db2.gz MYRTWMXECQMXCG-ZFWWWQNUSA-N 1 1 281.371 3.531 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000279940518 526331287 /nfs/dbraw/zinc/33/12/87/526331287.db2.gz YSWCINSKRFDYLX-INIZCTEOSA-N 1 1 289.325 3.838 20 10 CHCDMO CCO[C@H](CC[NH2+][C@H](C)c1ccc(F)cc1O)C(C)C ZINC000185625489 1117859031 /nfs/dbraw/zinc/85/90/31/1117859031.db2.gz AQTUKKRXSNAEAO-MLGOLLRUSA-N 1 1 283.387 3.633 20 10 CHCDMO [O-]c1c(Br)cccc1C[N@H+]1CCC2(CCC2)C1 ZINC000093455917 1120559158 /nfs/dbraw/zinc/55/91/58/1120559158.db2.gz RKEFZJCCUKBDMJ-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC2(CCC2)C1 ZINC000093455917 1120559163 /nfs/dbraw/zinc/55/91/63/1120559163.db2.gz RKEFZJCCUKBDMJ-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO Oc1c(Br)cccc1C[N@H+]1CCC2(CCC2)C1 ZINC000093455917 1120559167 /nfs/dbraw/zinc/55/91/67/1120559167.db2.gz RKEFZJCCUKBDMJ-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000922836364 1120607747 /nfs/dbraw/zinc/60/77/47/1120607747.db2.gz JFPBDWLJZQFEIA-BDAKNGLRSA-N 1 1 289.803 3.558 20 10 CHCDMO CC[N@H+](Cc1ccc(Cl)cc1O)[C@H](C)C(C)C ZINC001180043667 1121942118 /nfs/dbraw/zinc/94/21/18/1121942118.db2.gz WODWLKMJSVUZQZ-LLVKDONJSA-N 1 1 255.789 3.912 20 10 CHCDMO CC[N@@H+](Cc1ccc(Cl)cc1O)[C@H](C)C(C)C ZINC001180043667 1121942124 /nfs/dbraw/zinc/94/21/24/1121942124.db2.gz WODWLKMJSVUZQZ-LLVKDONJSA-N 1 1 255.789 3.912 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)c1O ZINC000775664276 1122877207 /nfs/dbraw/zinc/87/72/07/1122877207.db2.gz JWCWWVNNGDDERM-PHIMTYICSA-N 1 1 285.840 3.680 20 10 CHCDMO Oc1cc(Br)ccc1C[N@H+]1CCCC2(CC2)C1 ZINC000825537279 1123219601 /nfs/dbraw/zinc/21/96/01/1123219601.db2.gz UGVFYAJFYLRJPQ-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(Cl)cc1O ZINC000866403880 1124063597 /nfs/dbraw/zinc/06/35/97/1124063597.db2.gz SLDHLVWHHLXMKI-GHMZBOCLSA-N 1 1 285.840 3.839 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001140462206 1131748831 /nfs/dbraw/zinc/74/88/31/1131748831.db2.gz AKDOIHLNVAPKHL-NWDGAFQWSA-N 1 1 265.784 3.668 20 10 CHCDMO Cc1ncc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841747592 1132390512 /nfs/dbraw/zinc/39/05/12/1132390512.db2.gz CSQMIXYHPDWJET-SECBINFHSA-N 1 1 296.823 3.704 20 10 CHCDMO C[C@H]([NH2+]CC1(C)CCOCC1)c1ccc(Cl)cc1O ZINC000841753272 1132391132 /nfs/dbraw/zinc/39/11/32/1132391132.db2.gz YLVLMTBVERAIQN-NSHDSACASA-N 1 1 283.799 3.513 20 10 CHCDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233451279 1132624698 /nfs/dbraw/zinc/62/46/98/1132624698.db2.gz DXUHNSWBYDVYPG-SNVBAGLBSA-N 1 1 273.298 3.785 20 10 CHCDMO CCC(C)(C)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001205634761 1133597564 /nfs/dbraw/zinc/59/75/64/1133597564.db2.gz ZELJLZSVWUCFMZ-HJWRWDBZSA-N 1 1 260.425 3.886 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000134957864 1125571457 /nfs/dbraw/zinc/57/14/57/1125571457.db2.gz UZIDCXPKQQTGEZ-QWHCGFSZSA-N 1 1 255.361 3.776 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1ccc(Cl)cc1O ZINC000841756642 1125594002 /nfs/dbraw/zinc/59/40/02/1125594002.db2.gz ZIPQPPXILXGHDY-XZJROXQQSA-N 1 1 297.826 3.637 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(Cl)cc1O ZINC000841758913 1125600298 /nfs/dbraw/zinc/60/02/98/1125600298.db2.gz WDYBQUHMKUHBTH-JYILRKAJSA-N 1 1 265.784 3.885 20 10 CHCDMO CCOc1ccccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886510055 1125681457 /nfs/dbraw/zinc/68/14/57/1125681457.db2.gz RLDGBRGWXSWCBS-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886542612 1125686955 /nfs/dbraw/zinc/68/69/55/1125686955.db2.gz CPTQVEQXTIECLU-VXGBXAGGSA-N 1 1 274.339 3.647 20 10 CHCDMO CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)c2c(O)cccc2F)CCO1 ZINC000886580249 1125692734 /nfs/dbraw/zinc/69/27/34/1125692734.db2.gz BFHQOHLKHGFNQP-MGPQQGTHSA-N 1 1 295.398 3.776 20 10 CHCDMO CCC[N@@H+](Cc1cccc(COC)c1)Cc1ccccc1O ZINC000179225186 1125699477 /nfs/dbraw/zinc/69/94/77/1125699477.db2.gz PIJRSIXJOMGTHO-UHFFFAOYSA-N 1 1 299.414 3.951 20 10 CHCDMO COc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1C ZINC000886639574 1125701527 /nfs/dbraw/zinc/70/15/27/1125701527.db2.gz GKPQKSUBZFJPSC-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(F)cc1O ZINC000886684265 1125706835 /nfs/dbraw/zinc/70/68/35/1125706835.db2.gz IORFJZPPXXBYTM-CQSZACIVSA-N 1 1 290.338 3.638 20 10 CHCDMO CCC[N@@H+](Cc1cc2c(cc1O)CCCC2)C1CC1 ZINC000768451339 1129857693 /nfs/dbraw/zinc/85/76/93/1129857693.db2.gz MVONVTLDSLWNNG-UHFFFAOYSA-N 1 1 259.393 3.645 20 10 CHCDMO CCOc1ccc(C)c(C[N@H+]2CCc3cccc(O)c3C2)c1 ZINC001238715269 1131236590 /nfs/dbraw/zinc/23/65/90/1131236590.db2.gz XJQOINWCIWYGKM-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792794236 1130498693 /nfs/dbraw/zinc/49/86/93/1130498693.db2.gz XVZVQQOKESSJKN-LLVKDONJSA-N 1 1 286.341 3.613 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](CC2CC2)C2CCC2)cc1C ZINC000793396542 1130552961 /nfs/dbraw/zinc/55/29/61/1130552961.db2.gz RNWQOFJGRNABNH-UHFFFAOYSA-N 1 1 259.393 3.774 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000179596741 1126830477 /nfs/dbraw/zinc/83/04/77/1126830477.db2.gz NDFPWGQXLARNOA-ZDUSSCGKSA-N 1 1 271.360 3.594 20 10 CHCDMO COc1ccc(O)c(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000179850027 1126836184 /nfs/dbraw/zinc/83/61/84/1126836184.db2.gz UNKJANJHRRVGHY-GFCCVEGCSA-N 1 1 287.359 3.719 20 10 CHCDMO Cc1ncsc1C[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000180038907 1126838759 /nfs/dbraw/zinc/83/87/59/1126838759.db2.gz BLZFKDBMHJQWDI-UHFFFAOYSA-N 1 1 296.823 3.751 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000245565701 1129211910 /nfs/dbraw/zinc/21/19/10/1129211910.db2.gz SAQDSZMRMKUTLL-CZUORRHYSA-N 1 1 275.392 3.555 20 10 CHCDMO CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H](F)C2)c(O)c1 ZINC001235681668 1130767010 /nfs/dbraw/zinc/76/70/10/1130767010.db2.gz BXYCAHBMEHRQFM-CQSZACIVSA-N 1 1 265.372 3.624 20 10 CHCDMO CC[C@](C)(O)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192841695 1126964703 /nfs/dbraw/zinc/96/47/03/1126964703.db2.gz GDNKLPMUSLGTEM-OQPBUACISA-N 1 1 292.206 3.511 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)c1cccnc1 ZINC000269334555 1127038001 /nfs/dbraw/zinc/03/80/01/1127038001.db2.gz AZZMWZAJASPKRI-OAHLLOKOSA-N 1 1 283.419 3.731 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cscn1 ZINC000271172206 1127071327 /nfs/dbraw/zinc/07/13/27/1127071327.db2.gz UMVXRUPMQGJPTH-CYBMUJFWSA-N 1 1 287.432 3.594 20 10 CHCDMO CC(C)C[N@H+](C)Cc1c(O)ccc(Cl)c1Cl ZINC001237078000 1131048215 /nfs/dbraw/zinc/04/82/15/1131048215.db2.gz MBPUSYCVIXJDAH-UHFFFAOYSA-N 1 1 262.180 3.787 20 10 CHCDMO CC(C)C[N@@H+](C)Cc1c(O)ccc(Cl)c1Cl ZINC001237078000 1131048220 /nfs/dbraw/zinc/04/82/20/1131048220.db2.gz MBPUSYCVIXJDAH-UHFFFAOYSA-N 1 1 262.180 3.787 20 10 CHCDMO c1csc(S[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000283109454 1127122425 /nfs/dbraw/zinc/12/24/25/1127122425.db2.gz RTULAASIFJEUJK-CYBMUJFWSA-N 1 1 276.430 3.510 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137107 1131056761 /nfs/dbraw/zinc/05/67/61/1131056761.db2.gz MCCQFMHAFLDERK-JTQLQIEISA-N 1 1 273.298 3.643 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1OC(F)(F)F)C1CCCC1 ZINC001237122720 1131056045 /nfs/dbraw/zinc/05/60/45/1131056045.db2.gz LDDMNTPSZYYEOR-UHFFFAOYSA-N 1 1 289.297 3.665 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccc(Cl)nc2)c1 ZINC000163895730 1127147320 /nfs/dbraw/zinc/14/73/20/1127147320.db2.gz IHSBUXDQMXASOK-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)CCc2cccs2)c1 ZINC000164421281 1127164148 /nfs/dbraw/zinc/16/41/48/1127164148.db2.gz SYHBSCJURAIDID-UHFFFAOYSA-N 1 1 275.417 3.745 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(Cl)c(F)cc2[O-])CCS1 ZINC000816513676 1131103770 /nfs/dbraw/zinc/10/37/70/1131103770.db2.gz YQERUJNHJNNDBV-UHFFFAOYSA-N 1 1 289.803 3.512 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000816513676 1131103776 /nfs/dbraw/zinc/10/37/76/1131103776.db2.gz YQERUJNHJNNDBV-UHFFFAOYSA-N 1 1 289.803 3.512 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC000816647952 1131120800 /nfs/dbraw/zinc/12/08/00/1131120800.db2.gz BEFTYIXJOBLPFP-QWRGUYRKSA-N 1 1 286.341 3.612 20 10 CHCDMO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1ccc(F)cc1O ZINC000286161803 1127260928 /nfs/dbraw/zinc/26/09/28/1127260928.db2.gz PWJFRMSKBGUMBG-HNNXBMFYSA-N 1 1 295.398 3.779 20 10 CHCDMO COCC(C)(C)CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000286934338 1127276009 /nfs/dbraw/zinc/27/60/09/1127276009.db2.gz GKPDPKFXJRZTMF-LBPRGKRZSA-N 1 1 283.387 3.635 20 10 CHCDMO CCSCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168807411 1127471125 /nfs/dbraw/zinc/47/11/25/1127471125.db2.gz ISRPPBGPGPUQNW-QWRGUYRKSA-N 1 1 271.401 3.714 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC000228173045 1127535941 /nfs/dbraw/zinc/53/59/41/1127535941.db2.gz HBAIIESLPVJOEN-DZGCQCFKSA-N 1 1 275.392 3.555 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc1Cl ZINC001231870794 1127544518 /nfs/dbraw/zinc/54/45/18/1127544518.db2.gz UFQOUVPCTDFWLR-ZYHUDNBSSA-N 1 1 267.800 3.974 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1O ZINC000228627015 1127576295 /nfs/dbraw/zinc/57/62/95/1127576295.db2.gz NTNZMYICGNEYAQ-JTQLQIEISA-N 1 1 285.815 3.921 20 10 CHCDMO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001118884479 1131240497 /nfs/dbraw/zinc/24/04/97/1131240497.db2.gz ZJVMBGZYPZXNRE-UHFFFAOYSA-N 1 1 294.398 3.508 20 10 CHCDMO Oc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001118884479 1131240500 /nfs/dbraw/zinc/24/05/00/1131240500.db2.gz ZJVMBGZYPZXNRE-UHFFFAOYSA-N 1 1 294.398 3.508 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1ccc(F)cc1O ZINC000230407933 1127752378 /nfs/dbraw/zinc/75/23/78/1127752378.db2.gz IXDZFOJUWGSKKR-IJLUTSLNSA-N 1 1 251.345 3.618 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccc(F)cc1)c1ccc(F)cc1O ZINC000062744755 1127772373 /nfs/dbraw/zinc/77/23/73/1127772373.db2.gz NBMPUQLORVIUEZ-LLVKDONJSA-N 1 1 277.314 3.564 20 10 CHCDMO C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748206 1127773861 /nfs/dbraw/zinc/77/38/61/1127773861.db2.gz KZHFJCYPMUHVDP-GHMZBOCLSA-N 1 1 279.380 3.875 20 10 CHCDMO CCc1cc(NCc2ccc(N3CCCC3)cc2)nc(C)[nH+]1 ZINC000172711416 1127779530 /nfs/dbraw/zinc/77/95/30/1127779530.db2.gz WWPMUWKFIILOEL-UHFFFAOYSA-N 1 1 296.418 3.560 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(C)cc1O ZINC000373559707 1127848859 /nfs/dbraw/zinc/84/88/59/1127848859.db2.gz CPXRPEVAYCWMQT-LSDHHAIUSA-N 1 1 285.391 3.542 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CCc3cccc(C)c3C2)c1O ZINC000762087446 1128268151 /nfs/dbraw/zinc/26/81/51/1128268151.db2.gz PGZQLWWTNPIJMD-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO CC(C)[N@H+](Cc1cc2c(cc1O)CCC2)CC1CC1 ZINC000915209462 1128292115 /nfs/dbraw/zinc/29/21/15/1128292115.db2.gz XDCMMMLQKFVLTC-UHFFFAOYSA-N 1 1 259.393 3.501 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000918066639 1128533025 /nfs/dbraw/zinc/53/30/25/1128533025.db2.gz HKIOPNXQAYNLPK-UHFFFAOYSA-N 1 1 298.430 3.707 20 10 CHCDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000778995534 1128674420 /nfs/dbraw/zinc/67/44/20/1128674420.db2.gz ZBNLVSWCSSGRQI-JTQLQIEISA-N 1 1 277.364 3.712 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)C2CC2)cc1 ZINC000920258297 1128674677 /nfs/dbraw/zinc/67/46/77/1128674677.db2.gz MAGJRAYGYPRZMM-UHFFFAOYSA-N 1 1 270.376 3.510 20 10 CHCDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1ccccc1O ZINC000778996560 1128675837 /nfs/dbraw/zinc/67/58/37/1128675837.db2.gz QHJDGKPJIFXLNT-UHFFFAOYSA-N 1 1 299.414 3.658 20 10 CHCDMO C[N@@H+](Cc1cc(F)ccc1O)Cc1ccc(F)cc1Cl ZINC000779014442 1128678608 /nfs/dbraw/zinc/67/86/08/1128678608.db2.gz PHURXWGNYRULMU-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@H+](Cc1cc(F)ccc1O)Cc1ccc(F)cc1Cl ZINC000779014442 1128678610 /nfs/dbraw/zinc/67/86/10/1128678610.db2.gz PHURXWGNYRULMU-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000779014952 1128679512 /nfs/dbraw/zinc/67/95/12/1128679512.db2.gz MMJKWKSVMJBVHO-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO CCO[C@H](CC[NH2+][C@@H](C)c1ccc(F)cc1O)C(C)C ZINC000185625448 1117859442 /nfs/dbraw/zinc/85/94/42/1117859442.db2.gz AQTUKKRXSNAEAO-BLLLJJGKSA-N 1 1 283.387 3.633 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000728196649 1117868784 /nfs/dbraw/zinc/86/87/84/1117868784.db2.gz OIGBARGTYUSALY-QGZVFWFLSA-N 1 1 282.387 3.705 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000186017580 1117968782 /nfs/dbraw/zinc/96/87/82/1117968782.db2.gz LXMQAZPRFXKISJ-DXCKQFNASA-N 1 1 285.362 3.986 20 10 CHCDMO CC(C)[C@H]1OCCC[C@H]1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186093391 1117990772 /nfs/dbraw/zinc/99/07/72/1117990772.db2.gz VAFKWDHZGKSFHD-GDZNZVCISA-N 1 1 295.398 3.633 20 10 CHCDMO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186093449 1117991187 /nfs/dbraw/zinc/99/11/87/1117991187.db2.gz VAFKWDHZGKSFHD-AHIWAGSCSA-N 1 1 295.398 3.633 20 10 CHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccccc1O ZINC000179581743 1128748962 /nfs/dbraw/zinc/74/89/62/1128748962.db2.gz JSVGXGLRVLKIJL-CYBMUJFWSA-N 1 1 253.345 3.512 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1O ZINC000179631050 1128750331 /nfs/dbraw/zinc/75/03/31/1128750331.db2.gz JLISGCVEWROTOW-UHFFFAOYSA-N 1 1 295.382 3.696 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1O ZINC000779149039 1128752357 /nfs/dbraw/zinc/75/23/57/1128752357.db2.gz KCRWFMMGTAKMNI-RNCFNFMXSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c1O ZINC000779149039 1128752358 /nfs/dbraw/zinc/75/23/58/1128752358.db2.gz KCRWFMMGTAKMNI-RNCFNFMXSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c1O ZINC000779149040 1128752483 /nfs/dbraw/zinc/75/24/83/1128752483.db2.gz KCRWFMMGTAKMNI-TVQRCGJNSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c1O ZINC000779149040 1128752486 /nfs/dbraw/zinc/75/24/86/1128752486.db2.gz KCRWFMMGTAKMNI-TVQRCGJNSA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cn1 ZINC000765575634 1118174537 /nfs/dbraw/zinc/17/45/37/1118174537.db2.gz CBVMBNLVOYQMMZ-UHFFFAOYSA-N 1 1 297.446 3.867 20 10 CHCDMO CC[C@@H]1CCC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000079352809 1118305720 /nfs/dbraw/zinc/30/57/20/1118305720.db2.gz STRARDFBOFUOEY-CYBMUJFWSA-N 1 1 293.382 3.746 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000079352809 1118305724 /nfs/dbraw/zinc/30/57/24/1118305724.db2.gz STRARDFBOFUOEY-CYBMUJFWSA-N 1 1 293.382 3.746 20 10 CHCDMO Cc1cc([NH+](C)C)cc(C)c1NCc1ccccc1O ZINC000186266081 1118405359 /nfs/dbraw/zinc/40/53/59/1118405359.db2.gz TUELVARSURFOHU-UHFFFAOYSA-N 1 1 270.376 3.687 20 10 CHCDMO C[C@@H]([NH2+]CCOCC1CCCC1)c1cc(F)cc(F)c1O ZINC000834908237 1118627378 /nfs/dbraw/zinc/62/73/78/1118627378.db2.gz CMDQVNAWLVPIFZ-LLVKDONJSA-N 1 1 299.361 3.528 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707136584 1118641041 /nfs/dbraw/zinc/64/10/41/1118641041.db2.gz TTXVBQVBFLZLEE-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO Oc1cccc(Br)c1C[N@H+]1CC2CCC1CC2 ZINC000707138741 1118642888 /nfs/dbraw/zinc/64/28/88/1118642888.db2.gz FXTOUIJXTHVADW-UHFFFAOYSA-N 1 1 296.208 3.529 20 10 CHCDMO CCc1nc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cs1 ZINC000111406757 1119082197 /nfs/dbraw/zinc/08/21/97/1119082197.db2.gz BXFIQCHDUFSFKQ-GFCCVEGCSA-N 1 1 289.448 3.622 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@H]2Cc2ccccc2)ccc1N(C)C ZINC001167593935 1119141369 /nfs/dbraw/zinc/14/13/69/1119141369.db2.gz GDELTQGBQYGZOB-IBGZPJMESA-N 1 1 294.442 3.878 20 10 CHCDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562218 1119157459 /nfs/dbraw/zinc/15/74/59/1119157459.db2.gz AWELTMRVDQJAAH-FZMZJTMJSA-N 1 1 251.345 3.542 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1cccnc1 ZINC000076074095 1119182543 /nfs/dbraw/zinc/18/25/43/1119182543.db2.gz MNLFLESVBWUFOP-AWEZNQCLSA-N 1 1 270.376 3.760 20 10 CHCDMO C[C@H]([NH2+]CCCC(F)(F)F)c1ccc(F)cc1O ZINC000148599754 1119336713 /nfs/dbraw/zinc/33/67/13/1119336713.db2.gz IMJHWOIUCYLKAV-QMMMGPOBSA-N 1 1 265.250 3.524 20 10 CHCDMO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708445608 1119467116 /nfs/dbraw/zinc/46/71/16/1119467116.db2.gz VGKSUFSGOKCUEZ-NXEZZACHSA-N 1 1 257.324 3.585 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)c1O ZINC000169084272 1119492718 /nfs/dbraw/zinc/49/27/18/1119492718.db2.gz KUUJYUUAPIHUAC-MNOVXSKESA-N 1 1 283.799 3.532 20 10 CHCDMO CC[C@H]([NH2+]C1CCCCC1)c1ccc(F)cc1O ZINC000796665462 1119839870 /nfs/dbraw/zinc/83/98/70/1119839870.db2.gz IYWGUASPDCGUBE-AWEZNQCLSA-N 1 1 251.345 3.905 20 10 CHCDMO Nc1ccc(N(Cc2ccccc2)c2ccc[nH+]c2N)cc1 ZINC001212404316 1120065590 /nfs/dbraw/zinc/06/55/90/1120065590.db2.gz XQAVTZYSWISUHG-UHFFFAOYSA-N 1 1 290.370 3.584 20 10 CHCDMO COC[C@@H]1CCCC[N@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103381 1120346188 /nfs/dbraw/zinc/34/61/88/1120346188.db2.gz BJKREWIWTWYPDU-HNNXBMFYSA-N 1 1 291.435 3.691 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH+]2C[C@@H](C)[C@H](C)C2)c1 ZINC000781908465 1120511420 /nfs/dbraw/zinc/51/14/20/1120511420.db2.gz IYQLNNBFTQMWHQ-GHMZBOCLSA-N 1 1 298.224 3.551 20 10 CHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3ccccc3O)CCO2)cc1 ZINC000191665428 1120525993 /nfs/dbraw/zinc/52/59/93/1120525993.db2.gz YNYLWWBSHCNXRL-LJQANCHMSA-N 1 1 297.398 3.528 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(F)cc1O ZINC000796798992 1120818050 /nfs/dbraw/zinc/81/80/50/1120818050.db2.gz OVJCQKMDURIZIS-MLGOLLRUSA-N 1 1 288.366 3.771 20 10 CHCDMO C[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C ZINC000162897536 1120923659 /nfs/dbraw/zinc/92/36/59/1120923659.db2.gz AADSSOBQWGMYGS-QWRGUYRKSA-N 1 1 253.773 3.524 20 10 CHCDMO CCC[N@@H+](Cc1c(O)ccc2ccccc21)C1CC1 ZINC000728903421 1121173475 /nfs/dbraw/zinc/17/34/75/1121173475.db2.gz YLPMWRUNBFEWRH-UHFFFAOYSA-N 1 1 255.361 3.920 20 10 CHCDMO C[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2ccccc21 ZINC001137831936 1121180403 /nfs/dbraw/zinc/18/04/03/1121180403.db2.gz TXOFFGPJYUIGKA-LBPRGKRZSA-N 1 1 271.335 3.651 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2ccccc21 ZINC001137831936 1121180404 /nfs/dbraw/zinc/18/04/04/1121180404.db2.gz TXOFFGPJYUIGKA-LBPRGKRZSA-N 1 1 271.335 3.651 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC[C@H](C)C2)c1O ZINC000703203779 1121239381 /nfs/dbraw/zinc/23/93/81/1121239381.db2.gz FMVVPGYAJDYUOK-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237121022 1128980725 /nfs/dbraw/zinc/98/07/25/1128980725.db2.gz JYJNNXKZMPLLAM-AOOOYVTPSA-N 1 1 271.763 3.948 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCc2sccc21 ZINC000708408982 1121465096 /nfs/dbraw/zinc/46/50/96/1121465096.db2.gz KDHQXAWNMQDEBY-ZDUSSCGKSA-N 1 1 295.354 3.899 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)s1 ZINC000708535697 1121468651 /nfs/dbraw/zinc/46/86/51/1121468651.db2.gz PKISEVKEDCFXNP-SECBINFHSA-N 1 1 283.343 3.891 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1ccccc1O ZINC000727831286 1121751101 /nfs/dbraw/zinc/75/11/01/1121751101.db2.gz TVEWLQDCDARSJA-UHFFFAOYSA-N 1 1 255.361 3.804 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)C(C2CC2)C2CC2)cc1 ZINC000773755912 1121798496 /nfs/dbraw/zinc/79/84/96/1121798496.db2.gz OIZAJLIZOHCVNZ-UHFFFAOYSA-N 1 1 272.436 3.763 20 10 CHCDMO C[N@@H+](Cc1cc2oc3ccccc3c2cc1O)[C@H]1CCOC1 ZINC000730259799 1121799511 /nfs/dbraw/zinc/79/95/11/1121799511.db2.gz DFJZCVXAZPYFQT-ZDUSSCGKSA-N 1 1 297.354 3.512 20 10 CHCDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccccc1O ZINC000731842813 1121889161 /nfs/dbraw/zinc/88/91/61/1121889161.db2.gz GXHHGTWWUGJPAM-UHFFFAOYSA-N 1 1 285.387 3.602 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](C)[C@H]1C ZINC001179858352 1121916755 /nfs/dbraw/zinc/91/67/55/1121916755.db2.gz DBJLRRYTVWTFNH-UKRRQHHQSA-N 1 1 260.425 3.681 20 10 CHCDMO CN(C)c1ccc(/C=C\C[N@@H+](C)C(C2CC2)C2CC2)cc1 ZINC001180006473 1121937607 /nfs/dbraw/zinc/93/76/07/1121937607.db2.gz FLGUHIYLBKBPAA-PLNGDYQASA-N 1 1 284.447 3.886 20 10 CHCDMO CN(C)c1ccc(/C=C/C[N@@H+](C)C(C2CC2)C2CC2)cc1 ZINC001180006474 1121937781 /nfs/dbraw/zinc/93/77/81/1121937781.db2.gz FLGUHIYLBKBPAA-SNAWJCMRSA-N 1 1 284.447 3.886 20 10 CHCDMO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1cccc(F)c1O ZINC001180057490 1121943825 /nfs/dbraw/zinc/94/38/25/1121943825.db2.gz GEMNJVSVENPUMB-NSHDSACASA-N 1 1 279.380 3.656 20 10 CHCDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1cccc(F)c1O ZINC001180057490 1121943831 /nfs/dbraw/zinc/94/38/31/1121943831.db2.gz GEMNJVSVENPUMB-NSHDSACASA-N 1 1 279.380 3.656 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC001180203729 1121962583 /nfs/dbraw/zinc/96/25/83/1121962583.db2.gz YJCBLTKYXIITKB-CRAIPNDOSA-N 1 1 289.419 3.517 20 10 CHCDMO C[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC001180198582 1121965588 /nfs/dbraw/zinc/96/55/88/1121965588.db2.gz DWXFECKJFCCYCM-VHSXEESVSA-N 1 1 271.763 3.663 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC001180198582 1121965591 /nfs/dbraw/zinc/96/55/91/1121965591.db2.gz DWXFECKJFCCYCM-VHSXEESVSA-N 1 1 271.763 3.663 20 10 CHCDMO CC[N@H+](CCC1CC1)Cc1c(O)ccc(Cl)c1F ZINC001180614113 1122000654 /nfs/dbraw/zinc/00/06/54/1122000654.db2.gz WQGNMUOAXJPNCN-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO CC[N@@H+](CCC1CC1)Cc1c(O)ccc(Cl)c1F ZINC001180614113 1122000662 /nfs/dbraw/zinc/00/06/62/1122000662.db2.gz WQGNMUOAXJPNCN-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO Cc1[nH]c2ccccc2c1C[N@H+](C)Cc1ccccc1O ZINC001204295651 1122048994 /nfs/dbraw/zinc/04/89/94/1122048994.db2.gz UGLISUQWOXGCMU-UHFFFAOYSA-N 1 1 280.371 3.814 20 10 CHCDMO Cc1cccc(C[N@H+](Cc2ccco2)C(C)C)c1O ZINC000271710980 1122171674 /nfs/dbraw/zinc/17/16/74/1122171674.db2.gz AYEIRXQRCHJLNC-UHFFFAOYSA-N 1 1 259.349 3.704 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001182969779 1122198280 /nfs/dbraw/zinc/19/82/80/1122198280.db2.gz JVEBMEVLFDACBV-ZDUSSCGKSA-N 1 1 263.356 3.543 20 10 CHCDMO Oc1cccc2sc(C[N@H+]3Cc4cccc(O)c4C3)cc21 ZINC001183455688 1122224940 /nfs/dbraw/zinc/22/49/40/1122224940.db2.gz VZDXZSVUDZEDQC-UHFFFAOYSA-N 1 1 297.379 3.828 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(F)cc1O ZINC000273462326 1122234534 /nfs/dbraw/zinc/23/45/34/1122234534.db2.gz CZPWHMVYGDVTQG-ZUZCIYMTSA-N 1 1 287.334 3.575 20 10 CHCDMO CCCC[C@H](C)[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183918661 1122248322 /nfs/dbraw/zinc/24/83/22/1122248322.db2.gz BETWXKUEOLOTSF-RYUDHWBXSA-N 1 1 253.361 3.836 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775634209 1122838473 /nfs/dbraw/zinc/83/84/73/1122838473.db2.gz ORHDRIXRXVJJLH-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000775680167 1122900866 /nfs/dbraw/zinc/90/08/66/1122900866.db2.gz BDWMRAYKSWVVRZ-AWEZNQCLSA-N 1 1 267.372 3.820 20 10 CHCDMO CC[N@H+](Cc1cc(Br)cc(C)c1O)CC1CC1 ZINC000775700070 1122911801 /nfs/dbraw/zinc/91/18/01/1122911801.db2.gz AGDMSQHOOCPKGZ-UHFFFAOYSA-N 1 1 298.224 3.695 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCc3ccsc3C2)c1O ZINC000775699704 1122912122 /nfs/dbraw/zinc/91/21/22/1122912122.db2.gz CBPZJQCQZGRKFO-UHFFFAOYSA-N 1 1 293.819 3.974 20 10 CHCDMO Cc1cccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c1O ZINC000775698215 1122912139 /nfs/dbraw/zinc/91/21/39/1122912139.db2.gz MBSJRMMZLLUWDH-QGZVFWFLSA-N 1 1 299.439 3.991 20 10 CHCDMO Cc1cccc(C[N@H+](CC(F)F)CC2CCC2)c1O ZINC000775735966 1122930180 /nfs/dbraw/zinc/93/01/80/1122930180.db2.gz HMLDMWYMOWWSJS-UHFFFAOYSA-N 1 1 269.335 3.568 20 10 CHCDMO Cc1cccc(C[N@@H+](CC(F)F)CC2CCC2)c1O ZINC000775735966 1122930182 /nfs/dbraw/zinc/93/01/82/1122930182.db2.gz HMLDMWYMOWWSJS-UHFFFAOYSA-N 1 1 269.335 3.568 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2Cc3cccc(F)c3C2)cc1C ZINC000839182023 1123034812 /nfs/dbraw/zinc/03/48/12/1123034812.db2.gz GGIJNPQEXKZGRT-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2Cc3cccc(F)c3C2)cc1C ZINC000839182023 1123034817 /nfs/dbraw/zinc/03/48/17/1123034817.db2.gz GGIJNPQEXKZGRT-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776013186 1123035305 /nfs/dbraw/zinc/03/53/05/1123035305.db2.gz LFDDVBTVWZOCBI-WCQYABFASA-N 1 1 287.325 3.863 20 10 CHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)ccc1O ZINC000776012504 1123036043 /nfs/dbraw/zinc/03/60/43/1123036043.db2.gz HFNQRRYJXWAIKQ-BXKDBHETSA-N 1 1 291.288 3.694 20 10 CHCDMO FC(F)(F)C1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000894898341 1123053227 /nfs/dbraw/zinc/05/32/27/1123053227.db2.gz WZNAXESYLNOUPE-UHFFFAOYSA-N 1 1 298.352 3.671 20 10 CHCDMO CCOc1cccc(C[NH2+]CC(F)(F)C(C)(C)C)c1O ZINC000850409631 1123264106 /nfs/dbraw/zinc/26/41/06/1123264106.db2.gz DXFCWTVJUVLDIW-UHFFFAOYSA-N 1 1 287.350 3.562 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(F)cc1O ZINC000850482269 1123273332 /nfs/dbraw/zinc/27/33/32/1123273332.db2.gz NDGYAKIBBMJZKX-SWLSCSKDSA-N 1 1 288.366 3.771 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(F)cc1O ZINC000850511827 1123278009 /nfs/dbraw/zinc/27/80/09/1123278009.db2.gz NYMSIYLOIVXHAS-JOYOIKCWSA-N 1 1 280.368 3.790 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(F)c2cccnc12 ZINC000109770374 1123326129 /nfs/dbraw/zinc/32/61/29/1123326129.db2.gz IWEFPXYIMJXLAL-UHFFFAOYSA-N 1 1 296.345 3.712 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCC1CCC1)C[C@@H]1CCCO1 ZINC000851840911 1123384222 /nfs/dbraw/zinc/38/42/22/1123384222.db2.gz LQZUKPWUXLUDBG-KRWDZBQOSA-N 1 1 289.419 3.563 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000853581671 1123444074 /nfs/dbraw/zinc/44/40/74/1123444074.db2.gz WXKUMFXQRUFFGC-CHWSQXEVSA-N 1 1 289.419 3.540 20 10 CHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1O ZINC000112516921 1123492201 /nfs/dbraw/zinc/49/22/01/1123492201.db2.gz PJPVSCZCXGMZKW-UHFFFAOYSA-N 1 1 273.351 3.944 20 10 CHCDMO Cc1cccc(N[C@H](C)c2ccc(N(C)C)cc2)[nH+]1 ZINC000776794767 1123507146 /nfs/dbraw/zinc/50/71/46/1123507146.db2.gz IWUCRMHMFUPQEK-CYBMUJFWSA-N 1 1 255.365 3.629 20 10 CHCDMO Cn1c[nH+]c2cc(NCc3cc(F)cc(Cl)c3)ccc21 ZINC000776800442 1123511271 /nfs/dbraw/zinc/51/12/71/1123511271.db2.gz MYFAMKDOYJBGPW-UHFFFAOYSA-N 1 1 289.741 3.978 20 10 CHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCCC(F)(F)CC2)cc1 ZINC000862467137 1123812837 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CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000193494863 1125199376 /nfs/dbraw/zinc/19/93/76/1125199376.db2.gz AKWOZKOBNZUWOX-LSDHHAIUSA-N 1 1 298.430 3.538 20 10 CHCDMO CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000193494863 1125199378 /nfs/dbraw/zinc/19/93/78/1125199378.db2.gz AKWOZKOBNZUWOX-LSDHHAIUSA-N 1 1 298.430 3.538 20 10 CHCDMO CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000193494863 1125199380 /nfs/dbraw/zinc/19/93/80/1125199380.db2.gz AKWOZKOBNZUWOX-LSDHHAIUSA-N 1 1 298.430 3.538 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCCCC[C@H]2C)c1O ZINC000228666486 1125251148 /nfs/dbraw/zinc/25/11/48/1125251148.db2.gz ILXDMJHDZSHKHQ-LLVKDONJSA-N 1 1 283.799 3.819 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](CC)CC2)c1O ZINC000211463215 1125306445 /nfs/dbraw/zinc/30/64/45/1125306445.db2.gz UQIJAZZCNZPCSH-CQSZACIVSA-N 1 1 277.408 3.803 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC(CC)(CC)C2)c1O ZINC000211558716 1125308606 /nfs/dbraw/zinc/30/86/06/1125308606.db2.gz 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CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000092781216 1129407282 /nfs/dbraw/zinc/40/72/82/1129407282.db2.gz MWTROSDFHCFESE-INIZCTEOSA-N 1 1 275.392 3.555 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC3(CCCC3)C2)c1O ZINC000093336607 1129421084 /nfs/dbraw/zinc/42/10/84/1129421084.db2.gz KJKGSCGGGWVWIH-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1O ZINC000093439509 1129423813 /nfs/dbraw/zinc/42/38/13/1129423813.db2.gz BMFAKQRJJXWPPS-GOSISDBHSA-N 1 1 287.403 3.723 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000093666108 1129426854 /nfs/dbraw/zinc/42/68/54/1129426854.db2.gz GPDLSVSMAKXSNM-QGZVFWFLSA-N 1 1 289.419 3.624 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000093666104 1129427019 /nfs/dbraw/zinc/42/70/19/1129427019.db2.gz GPDLSVSMAKXSNM-KRWDZBQOSA-N 1 1 289.419 3.624 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c1 ZINC000093660756 1129427088 /nfs/dbraw/zinc/42/70/88/1129427088.db2.gz 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CCCO[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286071 1132595278 /nfs/dbraw/zinc/59/52/78/1132595278.db2.gz DJZQVSDYYUXKIO-INIZCTEOSA-N 1 1 291.435 3.691 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3CC[C@@H]2C3)c1 ZINC001233286164 1132595991 /nfs/dbraw/zinc/59/59/91/1132595991.db2.gz HZEAPDJOUQTOQV-SWLSCSKDSA-N 1 1 259.393 3.674 20 10 CHCDMO C[C@H]1C[N@H+](Cc2c(O)ccc(F)c2F)Cc2ccccc21 ZINC001233332130 1132604280 /nfs/dbraw/zinc/60/42/80/1132604280.db2.gz ZSVNLKWHVAHVHR-NSHDSACASA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)Cc2ccccc21 ZINC001233332130 1132604282 /nfs/dbraw/zinc/60/42/82/1132604282.db2.gz ZSVNLKWHVAHVHR-NSHDSACASA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@H]1C[C@H](C)C[NH+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233418433 1132619480 /nfs/dbraw/zinc/61/94/80/1132619480.db2.gz GXAXQPKMEHTQSX-QWRGUYRKSA-N 1 1 287.325 3.889 20 10 CHCDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1O)C1CC(F)(F)C1 ZINC001233451382 1132625621 /nfs/dbraw/zinc/62/56/21/1132625621.db2.gz 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/nfs/dbraw/zinc/36/48/19/1133364819.db2.gz GUKVXFKXUAJHOM-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](CC)Cc2cccnc2)cc1 ZINC001203938802 1133385862 /nfs/dbraw/zinc/38/58/62/1133385862.db2.gz FDCUCSRETVRBCI-UHFFFAOYSA-N 1 1 297.446 3.950 20 10 CHCDMO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)CCC[C@@H]1C ZINC001203929409 1133386039 /nfs/dbraw/zinc/38/60/39/1133386039.db2.gz CGZAIGICKOIPPL-GJZGRUSLSA-N 1 1 260.425 3.621 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](F)CC2)cc1 ZINC001203936283 1133386307 /nfs/dbraw/zinc/38/63/07/1133386307.db2.gz LPDHOIBKCYRBAO-INIZCTEOSA-N 1 1 278.415 3.857 20 10 CHCDMO C[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233691 1133422828 /nfs/dbraw/zinc/42/28/28/1133422828.db2.gz UKDDXPTYAGYVSL-AWEZNQCLSA-N 1 1 268.404 3.890 20 10 CHCDMO CSCC[N@@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204240155 1133423955 /nfs/dbraw/zinc/42/39/55/1133423955.db2.gz JNKBRRIRXVUWIZ-UHFFFAOYSA-N 1 1 288.460 3.701 20 10 CHCDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204239681 1133424657 /nfs/dbraw/zinc/42/46/57/1133424657.db2.gz CEADOVKDTIBZGO-MRXNPFEDSA-N 1 1 298.430 3.517 20 10 CHCDMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204277368 1133427589 /nfs/dbraw/zinc/42/75/89/1133427589.db2.gz BPBINDOTWJJDRN-LLVKDONJSA-N 1 1 291.778 3.944 20 10 CHCDMO FC(F)(F)[C@H]1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204321928 1133436438 /nfs/dbraw/zinc/43/64/38/1133436438.db2.gz MAWYZDLJXZWWMO-AWEZNQCLSA-N 1 1 298.352 3.671 20 10 CHCDMO c1ccc2c(c1)CC[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204318947 1133436466 /nfs/dbraw/zinc/43/64/66/1133436466.db2.gz AODCPHLMSPBVJF-UHFFFAOYSA-N 1 1 292.426 3.845 20 10 CHCDMO Cc1cc(C)cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001204523755 1133457465 /nfs/dbraw/zinc/45/74/65/1133457465.db2.gz FFQGIAXIPUEJFC-UHFFFAOYSA-N 1 1 297.398 3.663 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC001204841248 1133491254 /nfs/dbraw/zinc/49/12/54/1133491254.db2.gz RVFOBKSJXUXTME-OAHLLOKOSA-N 1 1 299.418 3.618 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)c(F)c1)Cc1ccccc1O ZINC001205243612 1133549089 /nfs/dbraw/zinc/54/90/89/1133549089.db2.gz LVVFTDCHEPQGED-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCSCC[C@@H]2C)c1 ZINC001205405989 1133574450 /nfs/dbraw/zinc/57/44/50/1133574450.db2.gz PDQUNUAIRXRYBN-ZDUSSCGKSA-N 1 1 279.449 3.843 20 10 CHCDMO CC(C)(CC[NH2+]Cc1cc(F)c(F)cc1O)C1CC1 ZINC001206031313 1133644104 /nfs/dbraw/zinc/64/41/04/1133644104.db2.gz HMXQVWYFGPZOQC-UHFFFAOYSA-N 1 1 269.335 3.586 20 10 CHCDMO Cc1cncc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001207156866 1133773253 /nfs/dbraw/zinc/77/32/53/1133773253.db2.gz OLPBGSQJPLVXMQ-UHFFFAOYSA-N 1 1 295.430 3.622 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000166373130 1133916972 /nfs/dbraw/zinc/91/69/72/1133916972.db2.gz BHIZMTGXBIWCPY-CQSZACIVSA-N 1 1 271.335 3.521 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000166373130 1133916975 /nfs/dbraw/zinc/91/69/75/1133916975.db2.gz BHIZMTGXBIWCPY-CQSZACIVSA-N 1 1 271.335 3.521 20 10 CHCDMO C[N@H+](Cc1cccc(F)c1O)[C@@H]1CCc2ccccc21 ZINC000166372750 1133917474 /nfs/dbraw/zinc/91/74/74/1133917474.db2.gz KATIBPZBRSLIMM-MRXNPFEDSA-N 1 1 271.335 3.651 20 10 CHCDMO C[N@@H+](Cc1cccc(F)c1O)[C@@H]1CCc2ccccc21 ZINC000166372750 1133917478 /nfs/dbraw/zinc/91/74/78/1133917478.db2.gz KATIBPZBRSLIMM-MRXNPFEDSA-N 1 1 271.335 3.651 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCc1ccc(F)cc1)CC2 ZINC001208774422 1133942802 /nfs/dbraw/zinc/94/28/02/1133942802.db2.gz DEDAADBRJRPFEN-UHFFFAOYSA-N 1 1 285.362 3.522 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H]2C)cc1 ZINC001209516908 1134032170 /nfs/dbraw/zinc/03/21/70/1134032170.db2.gz SJUKRONBQQPAEH-ZDUSSCGKSA-N 1 1 254.377 3.688 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2ccccn2)c1O ZINC000182066874 261922413 /nfs/dbraw/zinc/92/24/13/261922413.db2.gz QKPABYQMIQUOFS-GFCCVEGCSA-N 1 1 290.794 3.942 20 10 CHCDMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1O ZINC000186117364 262080309 /nfs/dbraw/zinc/08/03/09/262080309.db2.gz BASCHGWMZRFEFI-SECBINFHSA-N 1 1 292.379 3.716 20 10 CHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(C)c(C)cc2O)no1 ZINC000369991626 267281912 /nfs/dbraw/zinc/28/19/12/267281912.db2.gz TXPNRFLZIUSCMW-INIZCTEOSA-N 1 1 286.375 3.643 20 10 CHCDMO Cc1nc(NCc2c(O)ccc3c2CCCC3)c(C)c(C)[nH+]1 ZINC000301670938 328829342 /nfs/dbraw/zinc/82/93/42/328829342.db2.gz FGJGWOSQEZISPT-UHFFFAOYSA-N 1 1 297.402 3.598 20 10 CHCDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(F)c1O ZINC000164960558 331305517 /nfs/dbraw/zinc/30/55/17/331305517.db2.gz BXAHQVIXAJCQLZ-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H](C)c1cccnc1 ZINC000290425149 521291629 /nfs/dbraw/zinc/29/16/29/521291629.db2.gz KZJKJHPXDNBAAR-GFCCVEGCSA-N 1 1 274.339 3.509 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1F ZINC000127462141 522176803 /nfs/dbraw/zinc/17/68/03/522176803.db2.gz CFYYMEHSBAZCSH-QGZVFWFLSA-N 1 1 287.382 3.557 20 10 CHCDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1cccc(F)c1O ZINC000290432466 522965909 /nfs/dbraw/zinc/96/59/09/522965909.db2.gz LKSMCMIGAAZYGN-OAHLLOKOSA-N 1 1 274.339 3.509 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc(F)c1O ZINC000290432466 522965917 /nfs/dbraw/zinc/96/59/17/522965917.db2.gz LKSMCMIGAAZYGN-OAHLLOKOSA-N 1 1 274.339 3.509 20 10 CHCDMO COCc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062747812 523055502 /nfs/dbraw/zinc/05/55/02/523055502.db2.gz OZAYOJFZBOBDFZ-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO C[N@@H+](Cc1cccc(C(F)F)c1)Cc1ccccc1O ZINC000279177449 523300450 /nfs/dbraw/zinc/30/04/50/523300450.db2.gz AXDVAQLSYJRFFI-UHFFFAOYSA-N 1 1 277.314 3.962 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000290223821 523386785 /nfs/dbraw/zinc/38/67/85/523386785.db2.gz SAHPECMILOHKND-BETUJISGSA-N 1 1 287.325 3.945 20 10 CHCDMO COc1ccc(O)c([C@H](C)Nc2cc(C3CC3)cc[nH+]2)c1 ZINC000290081995 524775544 /nfs/dbraw/zinc/77/55/44/524775544.db2.gz GUNHCTAZZCUFSL-NSHDSACASA-N 1 1 284.359 3.846 20 10 CHCDMO C[C@@H]([NH2+]CCC1CCCC1)c1ccc(F)cc1O ZINC000062747677 525430572 /nfs/dbraw/zinc/43/05/72/525430572.db2.gz PNPQMVMRPJPPDL-LLVKDONJSA-N 1 1 251.345 3.762 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c1O ZINC000129727119 525916378 /nfs/dbraw/zinc/91/63/78/525916378.db2.gz UKKXBQMQSSRHHI-LBPRGKRZSA-N 1 1 289.350 3.733 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278366488 526364055 /nfs/dbraw/zinc/36/40/55/526364055.db2.gz KCTUURRCRVTJJJ-SECBINFHSA-N 1 1 293.716 3.820 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461890 1118720460 /nfs/dbraw/zinc/72/04/60/1118720460.db2.gz WZQVLUYPEDOYFO-JTQLQIEISA-N 1 1 289.753 3.913 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)CCC(F)(F)F)c1O ZINC000092753752 1120564716 /nfs/dbraw/zinc/56/47/16/1120564716.db2.gz FPAGAKNUZLCIRM-UHFFFAOYSA-N 1 1 291.313 3.565 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1 ZINC001191315773 1122593121 /nfs/dbraw/zinc/59/31/21/1122593121.db2.gz BWWLQDDVLALGRB-GASCZTMLSA-N 1 1 260.425 3.906 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)ccc1N(C)C ZINC001192261695 1122636629 /nfs/dbraw/zinc/63/66/29/1122636629.db2.gz FYJMTLGRARWPNT-UKRRQHHQSA-N 1 1 260.425 3.539 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c([O-])cc(F)cc2F)CCC1(F)F ZINC001140582899 1131807194 /nfs/dbraw/zinc/80/71/94/1131807194.db2.gz OYLVIYSRRQDYBX-SECBINFHSA-N 1 1 291.288 3.538 20 10 CHCDMO CC(C)COCCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841744114 1132386952 /nfs/dbraw/zinc/38/69/52/1132386952.db2.gz LZPXLXCJZPPKAJ-LBPRGKRZSA-N 1 1 285.815 3.759 20 10 CHCDMO CCC1(O)CCC([NH2+][C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841757202 1125596852 /nfs/dbraw/zinc/59/68/52/1125596852.db2.gz FSMKIEOIXMCFFE-XOMBGVMMSA-N 1 1 297.826 3.780 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841755024 1125594209 /nfs/dbraw/zinc/59/42/09/1125594209.db2.gz FUUAJEIRJDTLRK-FXPVBKGRSA-N 1 1 271.813 3.590 20 10 CHCDMO CCOc1cccc(C[N@H+]2[C@H](C)CC[C@@H]2CC)c1O ZINC000136821708 1125647895 /nfs/dbraw/zinc/64/78/95/1125647895.db2.gz QXRZNKQAVXPVON-OCCSQVGLSA-N 1 1 263.381 3.554 20 10 CHCDMO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886491745 1125680410 /nfs/dbraw/zinc/68/04/10/1125680410.db2.gz OPANHAUOGGXUJG-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1c(O)cccc1F ZINC000886525021 1125684589 /nfs/dbraw/zinc/68/45/89/1125684589.db2.gz VWGFOOSEMSDALR-IINYFYTJSA-N 1 1 287.334 3.575 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1c(O)cccc1F ZINC000886552232 1125690794 /nfs/dbraw/zinc/69/07/94/1125690794.db2.gz XARXQEQWAHLCII-NXEZZACHSA-N 1 1 273.298 3.760 20 10 CHCDMO COC1CCC(CC[NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886587824 1125693645 /nfs/dbraw/zinc/69/36/45/1125693645.db2.gz GMSRYVZTDNOGCZ-HSBZDZAISA-N 1 1 295.398 3.777 20 10 CHCDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886594327 1125695347 /nfs/dbraw/zinc/69/53/47/1125695347.db2.gz JZUGCMWWXDJEKS-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO CSCCCCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886594776 1125695636 /nfs/dbraw/zinc/69/56/36/1125695636.db2.gz UIAZROYVEMEGRZ-LLVKDONJSA-N 1 1 271.401 3.715 20 10 CHCDMO Cc1cscc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886601541 1125697002 /nfs/dbraw/zinc/69/70/02/1125697002.db2.gz VWWXZVQJHHVIDP-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)c1c(O)cccc1F ZINC000886619238 1125699985 /nfs/dbraw/zinc/69/99/85/1125699985.db2.gz XGTYLASYNMFMJG-ZJUUUORDSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886648128 1125702522 /nfs/dbraw/zinc/70/25/22/1125702522.db2.gz MEKYAXZOPHSDTD-WFASDCNBSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(Cl)n1 ZINC000886651978 1125703326 /nfs/dbraw/zinc/70/33/26/1125703326.db2.gz WKACAHQKBZJOKI-JTQLQIEISA-N 1 1 294.757 3.739 20 10 CHCDMO C[C@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1c(O)cccc1F ZINC000903325689 1126801519 /nfs/dbraw/zinc/80/15/19/1126801519.db2.gz MCXLRYNICLSFQH-DLGFLZQMSA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccccn2)cc1C ZINC000182067376 1126865573 /nfs/dbraw/zinc/86/55/73/1126865573.db2.gz AWKKSQODNOIXKL-CQSZACIVSA-N 1 1 270.376 3.597 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000183292308 1126885243 /nfs/dbraw/zinc/88/52/43/1126885243.db2.gz OZHJUSXATHSIIS-KRWDZBQOSA-N 1 1 282.387 3.905 20 10 CHCDMO CC[C@@H]([NH2+]CC(C)(C)SC)c1ccc(F)cc1O ZINC000796780380 1130931822 /nfs/dbraw/zinc/93/18/22/1130931822.db2.gz IYRDQQGWAVUYMW-GFCCVEGCSA-N 1 1 271.401 3.714 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccoc1C)c1ccc(F)cc1O ZINC000796719920 1130925859 /nfs/dbraw/zinc/92/58/59/1130925859.db2.gz JDLSYMWQFIUYTA-AWEZNQCLSA-N 1 1 263.312 3.674 20 10 CHCDMO Cn1ccc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000156479776 1127157922 /nfs/dbraw/zinc/15/79/22/1127157922.db2.gz PBALUUZRBXOEAN-UHFFFAOYSA-N 1 1 297.446 3.647 20 10 CHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(C)cc(C)c1O ZINC000164608371 1127172358 /nfs/dbraw/zinc/17/23/58/1127172358.db2.gz VKIYSNLSJFYMJG-UHFFFAOYSA-N 1 1 290.432 3.530 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC2(CCC2)C1 ZINC000816513405 1131104370 /nfs/dbraw/zinc/10/43/70/1131104370.db2.gz PJADOQCMTSMQGO-UHFFFAOYSA-N 1 1 269.747 3.561 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237814543 1131142752 /nfs/dbraw/zinc/14/27/52/1131142752.db2.gz SSGXEBXKZUGAFK-JTQLQIEISA-N 1 1 271.763 3.949 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+](CC1CC1)C1CC1 ZINC001237939641 1131152904 /nfs/dbraw/zinc/15/29/04/1131152904.db2.gz FDOSXYFJWQKHFD-UHFFFAOYSA-N 1 1 269.747 3.559 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+](CC1CC1)C1CC1 ZINC001237939641 1131152907 /nfs/dbraw/zinc/15/29/07/1131152907.db2.gz FDOSXYFJWQKHFD-UHFFFAOYSA-N 1 1 269.747 3.559 20 10 CHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237937061 1131154022 /nfs/dbraw/zinc/15/40/22/1131154022.db2.gz NKHBIQXXYIQTRT-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237937061 1131154024 /nfs/dbraw/zinc/15/40/24/1131154024.db2.gz NKHBIQXXYIQTRT-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237937061 1131154027 /nfs/dbraw/zinc/15/40/27/1131154027.db2.gz NKHBIQXXYIQTRT-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@@H]([NH2+]CC1CCSCC1)c1ccc(F)cc1O ZINC000285976840 1127250590 /nfs/dbraw/zinc/25/05/90/1127250590.db2.gz HKOLSPLQGLMFSA-CQSZACIVSA-N 1 1 283.412 3.715 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(Cl)ccc1[O-] ZINC000817975766 1131193367 /nfs/dbraw/zinc/19/33/67/1131193367.db2.gz BFEQIFBHISNTGM-BXUZGUMPSA-N 1 1 284.831 3.604 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C)C(C)(C)C2)c1O ZINC000761225923 1127550357 /nfs/dbraw/zinc/55/03/57/1127550357.db2.gz MYEGECKUAPJDRX-ZDUSSCGKSA-N 1 1 277.408 3.659 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCCc2occc21 ZINC000294315358 1127564788 /nfs/dbraw/zinc/56/47/88/1127564788.db2.gz QTZFTLGNITWQOW-ZDUSSCGKSA-N 1 1 295.741 3.945 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)C(C)C)c1O ZINC000228598927 1127569768 /nfs/dbraw/zinc/56/97/68/1127569768.db2.gz AJDQWRFASVJKTE-SNVBAGLBSA-N 1 1 271.788 3.531 20 10 CHCDMO C[C@H]([NH2+]CCCOc1ccccc1)c1ccc(F)cc1O ZINC000062748453 1127774157 /nfs/dbraw/zinc/77/41/57/1127774157.db2.gz UEKXPBYIBDJZAF-ZDUSSCGKSA-N 1 1 289.350 3.651 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)[C@H]1C ZINC000252151798 1128115606 /nfs/dbraw/zinc/11/56/06/1128115606.db2.gz MPKSUGGPLSTEDZ-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252178072 1128129160 /nfs/dbraw/zinc/12/91/60/1128129160.db2.gz PKNQACNRWZBPEN-MNOVXSKESA-N 1 1 253.773 3.666 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1c(O)cccc1F ZINC000927062902 1128213466 /nfs/dbraw/zinc/21/34/66/1128213466.db2.gz PXBGRPXHTXZWPU-RISCZKNCSA-N 1 1 286.350 3.655 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1c(O)cccc1F ZINC000927100882 1128217370 /nfs/dbraw/zinc/21/73/70/1128217370.db2.gz VEYCDXOPPPEORI-RYUDHWBXSA-N 1 1 295.398 3.776 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000915789707 1128338464 /nfs/dbraw/zinc/33/84/64/1128338464.db2.gz GQSDYHWZZCYVGB-UHFFFAOYSA-N 1 1 267.372 3.513 20 10 CHCDMO COc1cc(C[N@H+]2CCC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915790403 1128338567 /nfs/dbraw/zinc/33/85/67/1128338567.db2.gz ICTVYRPCRYBFBL-CYBMUJFWSA-N 1 1 291.435 3.930 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC000777970820 1128351829 /nfs/dbraw/zinc/35/18/29/1128351829.db2.gz WGQRSYNCWHOPDA-LRDDRELGSA-N 1 1 273.351 3.725 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H]1F ZINC000777967748 1128352189 /nfs/dbraw/zinc/35/21/89/1128352189.db2.gz ZAMAMLSNMCDXTO-BXUZGUMPSA-N 1 1 295.398 3.575 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCO1 ZINC000917074623 1128473931 /nfs/dbraw/zinc/47/39/31/1128473931.db2.gz DCQLMAABACTDNW-SFHVURJKSA-N 1 1 290.451 3.532 20 10 CHCDMO CCn1c2ccc(C)cc2[nH+]c1NCc1cc(C)ccc1O ZINC000763425640 1128532235 /nfs/dbraw/zinc/53/22/35/1128532235.db2.gz LWKKELHJYYWQBD-UHFFFAOYSA-N 1 1 295.386 3.991 20 10 CHCDMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccccc1O ZINC000154987460 1128611108 /nfs/dbraw/zinc/61/11/08/1128611108.db2.gz AYYOKJMJWXCVCC-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779015206 1128680184 /nfs/dbraw/zinc/68/01/84/1128680184.db2.gz SEIDSULDUPEGOU-GFCCVEGCSA-N 1 1 271.335 3.651 20 10 CHCDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1cc(F)ccc1O ZINC000779022678 1128685562 /nfs/dbraw/zinc/68/55/62/1128685562.db2.gz FTTMQSNWRPCOEN-DYVFJYSZSA-N 1 1 285.362 3.909 20 10 CHCDMO CCCCC[N@@H+](Cc1cc(OC)c(OC)cc1O)C(C)C ZINC000159858282 1128733525 /nfs/dbraw/zinc/73/35/25/1128733525.db2.gz HOJKHCVWZPIWRC-UHFFFAOYSA-N 1 1 295.423 3.810 20 10 CHCDMO CC[N@@H+](CC[C@@H](C)SC)Cc1ccc(N(C)C)cc1 ZINC001208147662 1117826014 /nfs/dbraw/zinc/82/60/14/1117826014.db2.gz KGWKXERVHNMLAG-CQSZACIVSA-N 1 1 280.481 3.716 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000748084892 1117940270 /nfs/dbraw/zinc/94/02/70/1117940270.db2.gz XXLMGULHIUEDQS-CYBMUJFWSA-N 1 1 270.376 3.562 20 10 CHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)Oc1ccccc1 ZINC000186040853 1117974618 /nfs/dbraw/zinc/97/46/18/1117974618.db2.gz FTCDHGUPITYGAP-CHWSQXEVSA-N 1 1 289.350 3.649 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000211433305 1118029971 /nfs/dbraw/zinc/02/99/71/1118029971.db2.gz DVQCITIBAWBIHS-LLVKDONJSA-N 1 1 253.773 3.810 20 10 CHCDMO COc1ccc(C[N@@H+](Cc2cccc(C)c2O)C2CC2)cc1 ZINC000179609900 1128751203 /nfs/dbraw/zinc/75/12/03/1128751203.db2.gz BIEDFHGNNIDEKZ-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)c1O ZINC000179643049 1128752055 /nfs/dbraw/zinc/75/20/55/1128752055.db2.gz CSBXJIUEUMGZLO-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)c1 ZINC000179682260 1128753840 /nfs/dbraw/zinc/75/38/40/1128753840.db2.gz OOUFZBOSMGUTBW-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2cccn2C)cc1C ZINC000179706176 1128754971 /nfs/dbraw/zinc/75/49/71/1128754971.db2.gz MCMUNVKZXWWYQB-KRWDZBQOSA-N 1 1 284.403 3.685 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NCCC[N@H+](C)C(C)C)cc1 ZINC000764806157 1118116521 /nfs/dbraw/zinc/11/65/21/1118116521.db2.gz KASAHCINFVLCOV-MRXNPFEDSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NCCC[N@@H+](C)C(C)C)cc1 ZINC000764806157 1118116525 /nfs/dbraw/zinc/11/65/25/1118116525.db2.gz KASAHCINFVLCOV-MRXNPFEDSA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098291 1118134885 /nfs/dbraw/zinc/13/48/85/1118134885.db2.gz GITHWOWKYGYYHN-KBPBESRZSA-N 1 1 291.435 3.607 20 10 CHCDMO CC[C@@H](C)[N@H+](C)CCN[C@H](CC)c1ccc(N(C)C)cc1 ZINC000765657138 1118187691 /nfs/dbraw/zinc/18/76/91/1118187691.db2.gz VVBXLNISASITFZ-CRAIPNDOSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)CCN[C@H](CC)c1ccc(N(C)C)cc1 ZINC000765657138 1118187693 /nfs/dbraw/zinc/18/76/93/1118187693.db2.gz VVBXLNISASITFZ-CRAIPNDOSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)[N@H+](C)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657142 1118187896 /nfs/dbraw/zinc/18/78/96/1118187896.db2.gz VVBXLNISASITFZ-QAPCUYQASA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657142 1118187900 /nfs/dbraw/zinc/18/79/00/1118187900.db2.gz VVBXLNISASITFZ-QAPCUYQASA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1cc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)no1 ZINC000387071113 1118190406 /nfs/dbraw/zinc/19/04/06/1118190406.db2.gz UKXDTRLSBCPVDF-UHFFFAOYSA-N 1 1 295.386 3.680 20 10 CHCDMO Cc1cc(C[N@H+]2CCc3cccc(O)c3C2)cc(C)c1F ZINC001143385398 1118524675 /nfs/dbraw/zinc/52/46/75/1118524675.db2.gz ROBJVCSWYKVMPH-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)cc2)c1O ZINC000160810517 1118546850 /nfs/dbraw/zinc/54/68/50/1118546850.db2.gz NFKBUXWVESEBBU-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO CCCCC[N@@H+](C)Cc1c(O)cccc1Br ZINC000707142466 1118648852 /nfs/dbraw/zinc/64/88/52/1118648852.db2.gz IVIWXWCWJGISMH-UHFFFAOYSA-N 1 1 286.213 3.777 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1c(O)cccc1Br ZINC000707142863 1118649056 /nfs/dbraw/zinc/64/90/56/1118649056.db2.gz KGYHCOWZIMLNTM-UHFFFAOYSA-N 1 1 286.213 3.775 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1c(O)cccc1Br ZINC000707152894 1118651138 /nfs/dbraw/zinc/65/11/38/1118651138.db2.gz QTVQNQMVRDTYLH-ZDUSSCGKSA-N 1 1 298.224 3.775 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC001140461596 1118719537 /nfs/dbraw/zinc/71/95/37/1118719537.db2.gz NDGMTBCEEUTRIS-OAHLLOKOSA-N 1 1 288.778 3.778 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c1 ZINC000180653707 1128800353 /nfs/dbraw/zinc/80/03/53/1128800353.db2.gz JLWOCYYTUWMFIG-UGSOOPFHSA-N 1 1 283.371 3.594 20 10 CHCDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562216 1119157324 /nfs/dbraw/zinc/15/73/24/1119157324.db2.gz AWELTMRVDQJAAH-RISCZKNCSA-N 1 1 251.345 3.542 20 10 CHCDMO COc1cccc(CNc2cc[nH+]c3ccsc32)c1O ZINC000091479245 1119234851 /nfs/dbraw/zinc/23/48/51/1119234851.db2.gz FBWLSZHNEFZJIP-UHFFFAOYSA-N 1 1 286.356 3.623 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001140623622 1119295100 /nfs/dbraw/zinc/29/51/00/1119295100.db2.gz YLVRWCOBOYKJST-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccccc1O ZINC000181171246 1128840940 /nfs/dbraw/zinc/84/09/40/1128840940.db2.gz ZPEUKKCVZVFEMP-LBPRGKRZSA-N 1 1 282.343 3.726 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cccs1 ZINC000708455142 1119467688 /nfs/dbraw/zinc/46/76/88/1119467688.db2.gz UHGLJTCQTNDOCB-MRVPVSSYSA-N 1 1 269.316 3.583 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@H](C)c1cccc(OC)c1 ZINC000179560979 1119750374 /nfs/dbraw/zinc/75/03/74/1119750374.db2.gz QRKZJINVRVWFFN-CQSZACIVSA-N 1 1 285.387 3.984 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](Cc1ccccc1O)C1CC1 ZINC000179563320 1119751332 /nfs/dbraw/zinc/75/13/32/1119751332.db2.gz FEEXUNUJIQECHP-GFCCVEGCSA-N 1 1 257.333 3.711 20 10 CHCDMO C[C@@H]([NH2+]CC(F)(F)C(C)(C)C)c1ccccc1O ZINC000850571952 1119983792 /nfs/dbraw/zinc/98/37/92/1119983792.db2.gz FTHLUNXYRAQHQX-SNVBAGLBSA-N 1 1 257.324 3.724 20 10 CHCDMO Nc1ccc(Cc2ccc(Nc3ccc[nH+]c3N)cc2)cc1 ZINC001212403979 1120063825 /nfs/dbraw/zinc/06/38/25/1120063825.db2.gz GCRRFBDGHJFDRJ-UHFFFAOYSA-N 1 1 290.370 3.580 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)c1O ZINC000180638154 1120280182 /nfs/dbraw/zinc/28/01/82/1120280182.db2.gz JNKFNBXGNGMNRL-KRWDZBQOSA-N 1 1 284.403 3.766 20 10 CHCDMO CC[N@@H+](Cc1ccc2c(c1)OCCN2C)C1CCCCC1 ZINC001141139186 1120391552 /nfs/dbraw/zinc/39/15/52/1120391552.db2.gz MIKIXWANMSHMEV-UHFFFAOYSA-N 1 1 288.435 3.670 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)CC(F)(F)F ZINC000396918660 1120423658 /nfs/dbraw/zinc/42/36/58/1120423658.db2.gz WULHQRIZDDTBLI-IUCAKERBSA-N 1 1 279.277 3.770 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000689882078 1120436447 /nfs/dbraw/zinc/43/64/47/1120436447.db2.gz MDZMFWIIDATQAV-LLVKDONJSA-N 1 1 271.763 3.617 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1 ZINC000312743311 1120589145 /nfs/dbraw/zinc/58/91/45/1120589145.db2.gz YDIXIHHPSBGZPO-ZDUSSCGKSA-N 1 1 287.325 3.863 20 10 CHCDMO CSCCCCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186783166 1120664706 /nfs/dbraw/zinc/66/47/06/1120664706.db2.gz IFIPRVWNJPWKAT-NSHDSACASA-N 1 1 271.401 3.715 20 10 CHCDMO CCCC[N@@H+](Cc1nc(C)cs1)Cc1ccccc1O ZINC000282461858 1120689196 /nfs/dbraw/zinc/68/91/96/1120689196.db2.gz MWIKMKXNCRKOFA-UHFFFAOYSA-N 1 1 290.432 3.959 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccccc2)c1 ZINC000125113331 1120709252 /nfs/dbraw/zinc/70/92/52/1120709252.db2.gz WDTJXDFQTUYSCI-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccccc2O)CC[C@@H]1C(F)(F)F ZINC000191658812 1128950157 /nfs/dbraw/zinc/95/01/57/1128950157.db2.gz WJEIKXSQCOJXBJ-ZDUSSCGKSA-N 1 1 287.325 3.803 20 10 CHCDMO CCCC[N@@H+](CC)Cc1cc(Cl)cc(OC)c1O ZINC000228562357 1121188442 /nfs/dbraw/zinc/18/84/42/1121188442.db2.gz PWCPTUNHCMTQQY-UHFFFAOYSA-N 1 1 271.788 3.676 20 10 CHCDMO CCCC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)CC ZINC000108105760 1121295864 /nfs/dbraw/zinc/29/58/64/1121295864.db2.gz HSGSNHMSFMTNCS-GFCCVEGCSA-N 1 1 279.380 3.522 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC001137837760 1121405420 /nfs/dbraw/zinc/40/54/20/1121405420.db2.gz TWZDCFPZOYRIAL-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC001137837760 1121405426 /nfs/dbraw/zinc/40/54/26/1121405426.db2.gz TWZDCFPZOYRIAL-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc(F)cc(F)c1O ZINC000708408276 1121464131 /nfs/dbraw/zinc/46/41/31/1121464131.db2.gz FFKYRBREDFYIKY-UHFFFAOYSA-N 1 1 293.304 3.832 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000708485198 1121468689 /nfs/dbraw/zinc/46/86/89/1121468689.db2.gz JDPQWOXHOPUFNO-MRXNPFEDSA-N 1 1 259.393 3.937 20 10 CHCDMO CC(C)[C@H]1[N@@H+](Cc2ccccc2O)CC12CC=CC2 ZINC000843432060 1121531102 /nfs/dbraw/zinc/53/11/02/1121531102.db2.gz PIZNLDJHCQNOQL-MRXNPFEDSA-N 1 1 257.377 3.569 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)s1 ZINC000728048619 1121760546 /nfs/dbraw/zinc/76/05/46/1121760546.db2.gz XLYXZDJYUDIIBA-UHFFFAOYSA-N 1 1 287.428 3.883 20 10 CHCDMO CC1(C)C[C@]1(C)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001179468896 1121880897 /nfs/dbraw/zinc/88/08/97/1121880897.db2.gz SHDWWEOFNFLSKN-CQSZACIVSA-N 1 1 271.763 3.711 20 10 CHCDMO CCc1cccc(C[N@@H+](C)Cc2ccccc2)c1O ZINC001179845202 1121916476 /nfs/dbraw/zinc/91/64/76/1121916476.db2.gz MUIZVWKWOHWCOL-UHFFFAOYSA-N 1 1 255.361 3.587 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](OC)[C@@H](C)CC ZINC001180194736 1121964619 /nfs/dbraw/zinc/96/46/19/1121964619.db2.gz MAEQHOWKZHSHKO-WMLDXEAASA-N 1 1 279.424 3.665 20 10 CHCDMO CC[C@@H](C)C[N@@H+](C)Cc1c([O-])ccc(Cl)c1F ZINC001180262002 1121970039 /nfs/dbraw/zinc/97/00/39/1121970039.db2.gz HCTJODSXRJZLOH-SECBINFHSA-N 1 1 259.752 3.663 20 10 CHCDMO CC[C@@H](C)C[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC001180262002 1121970044 /nfs/dbraw/zinc/97/00/44/1121970044.db2.gz HCTJODSXRJZLOH-SECBINFHSA-N 1 1 259.752 3.663 20 10 CHCDMO CC[C@@H](C)C[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC001180262002 1121970048 /nfs/dbraw/zinc/97/00/48/1121970048.db2.gz HCTJODSXRJZLOH-SECBINFHSA-N 1 1 259.752 3.663 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC000779604353 1129032209 /nfs/dbraw/zinc/03/22/09/1129032209.db2.gz JTSQGFWSNQUBND-CQSZACIVSA-N 1 1 289.419 3.803 20 10 CHCDMO CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2O)CCO1 ZINC000273354413 1122229296 /nfs/dbraw/zinc/22/92/96/1122229296.db2.gz CHUHSRZFOXEGLI-AEGPPILISA-N 1 1 295.398 3.776 20 10 CHCDMO COCC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000273407492 1122231918 /nfs/dbraw/zinc/23/19/18/1122231918.db2.gz HJXGRWPGWAKHCE-BXUZGUMPSA-N 1 1 293.338 3.553 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(F)cc1O ZINC000273528123 1122238050 /nfs/dbraw/zinc/23/80/50/1122238050.db2.gz VVBMXAJOQJMKTF-GHJWDPDVSA-N 1 1 295.398 3.776 20 10 CHCDMO CCCCCC[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183919231 1122248059 /nfs/dbraw/zinc/24/80/59/1122248059.db2.gz HMCPRUNWOACNCQ-LBPRGKRZSA-N 1 1 253.361 3.980 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+]C1(C2CCCCC2)CC1 ZINC001184239378 1122264511 /nfs/dbraw/zinc/26/45/11/1122264511.db2.gz MOMBSWOBJIHOGO-UHFFFAOYSA-N 1 1 281.346 3.873 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[Si](C)(C)C ZINC001190436273 1122538213 /nfs/dbraw/zinc/53/82/13/1122538213.db2.gz COMNNOOQTQJFGE-UHFFFAOYSA-N 1 1 278.516 3.840 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)ccc1N(C)C ZINC001193210176 1122681156 /nfs/dbraw/zinc/68/11/56/1122681156.db2.gz KTKOIHIUQMEDGE-HNNXBMFYSA-N 1 1 274.452 3.929 20 10 CHCDMO Cc1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC000775650343 1122865675 /nfs/dbraw/zinc/86/56/75/1122865675.db2.gz YNRSZSYUDPHYCR-KRWDZBQOSA-N 1 1 299.439 3.991 20 10 CHCDMO Cc1cccc(C[N@H+](Cc2ccccn2)C(C)C)c1O ZINC000775658405 1122868715 /nfs/dbraw/zinc/86/87/15/1122868715.db2.gz OBJCVRLKABKPDF-UHFFFAOYSA-N 1 1 270.376 3.506 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)CCCCc2ccccc2)c1 ZINC000775655863 1122870225 /nfs/dbraw/zinc/87/02/25/1122870225.db2.gz LUAIKHGKEDOQJJ-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3C)C2)c1 ZINC000775670889 1122888211 /nfs/dbraw/zinc/88/82/11/1122888211.db2.gz SKKWMBYEJDXAFE-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1cccc(C[N@H+](C)C[C@@H](C)c2ccccc2)c1O ZINC000775678193 1122900903 /nfs/dbraw/zinc/90/09/03/1122900903.db2.gz BESDXDMUBUYFSA-OAHLLOKOSA-N 1 1 269.388 3.936 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)C[C@@H](C)c2ccccc2)c1 ZINC000775679263 1122900936 /nfs/dbraw/zinc/90/09/36/1122900936.db2.gz SWEPNDKEWFYQNW-CQSZACIVSA-N 1 1 285.387 3.636 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000775698160 1122912242 /nfs/dbraw/zinc/91/22/42/1122912242.db2.gz KGVBQQCOKPGHFN-SFHVURJKSA-N 1 1 287.403 3.723 20 10 CHCDMO C[C@@H]1c2sccc2CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001197432372 1122956697 /nfs/dbraw/zinc/95/66/97/1122956697.db2.gz ULQSXQWRZBCEJO-CYBMUJFWSA-N 1 1 286.444 3.933 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000776014985 1123036122 /nfs/dbraw/zinc/03/61/22/1123036122.db2.gz SYMWJTFJCBEVLB-UHFFFAOYSA-N 1 1 279.383 3.748 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)C1CCCC1 ZINC000105993657 1123096161 /nfs/dbraw/zinc/09/61/61/1123096161.db2.gz VWELODQCARVCRY-UHFFFAOYSA-N 1 1 255.361 3.920 20 10 CHCDMO CCCCC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201735029 1123149272 /nfs/dbraw/zinc/14/92/72/1123149272.db2.gz MUJACETUIUJBIX-UHFFFAOYSA-N 1 1 260.425 3.909 20 10 CHCDMO COC[C@H]1CCCC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000825536687 1123221658 /nfs/dbraw/zinc/22/16/58/1123221658.db2.gz LHYYMPVRSDDNLB-ZDUSSCGKSA-N 1 1 297.826 3.603 20 10 CHCDMO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000850501207 1123274942 /nfs/dbraw/zinc/27/49/42/1123274942.db2.gz KTZOFTOREKMQDA-LBPRGKRZSA-N 1 1 297.414 3.759 20 10 CHCDMO Cc1ccncc1CC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000850505181 1123276302 /nfs/dbraw/zinc/27/63/02/1123276302.db2.gz ORTUADGTPBTACF-GFCCVEGCSA-N 1 1 290.794 3.642 20 10 CHCDMO CC[C@H]([NH2+]CCCOC(C)(C)C)c1ccc(F)cc1O ZINC000850526345 1123281955 /nfs/dbraw/zinc/28/19/55/1123281955.db2.gz PSSXQXDELISROM-AWEZNQCLSA-N 1 1 283.387 3.777 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1CCC[C@H](C)O1)c1ccc(F)cc1O ZINC000850535694 1123287012 /nfs/dbraw/zinc/28/70/12/1123287012.db2.gz ZJKJLVBCAYZLHI-WHOFXGATSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@@H]([NH2+][C@H](CC)C1CC1)c1ccc(F)cc1O ZINC000850540437 1123288337 /nfs/dbraw/zinc/28/83/37/1123288337.db2.gz MTKJVTAEJNIDLQ-ZIAGYGMSSA-N 1 1 251.345 3.761 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cc(F)cc(F)c1O ZINC000850553612 1123290040 /nfs/dbraw/zinc/29/00/40/1123290040.db2.gz ZMNDCSVJXLXHIP-HQJQHLMTSA-N 1 1 291.288 3.612 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(Cl)cc1O ZINC000850571700 1123294927 /nfs/dbraw/zinc/29/49/27/1123294927.db2.gz UBUUVTHZKOGOFD-WDEREUQCSA-N 1 1 283.799 3.511 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000852083359 1123395792 /nfs/dbraw/zinc/39/57/92/1123395792.db2.gz DRDSXBFBCBRQCI-KRWDZBQOSA-N 1 1 295.430 3.527 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H]3C[C@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000853581674 1123443742 /nfs/dbraw/zinc/44/37/42/1123443742.db2.gz WXKUMFXQRUFFGC-STQMWFEESA-N 1 1 289.419 3.540 20 10 CHCDMO Cc1cc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)ccn1 ZINC000856721763 1123565747 /nfs/dbraw/zinc/56/57/47/1123565747.db2.gz NMZUDRXALRQHCN-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)CC2)c1O ZINC000228631217 1123634238 /nfs/dbraw/zinc/63/42/38/1123634238.db2.gz HLIBFECXFGVBKI-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO CC[C@H]([NH2+]CC(F)(F)CC)c1ccc(C)cc1O ZINC000858507552 1123659389 /nfs/dbraw/zinc/65/93/89/1123659389.db2.gz PIENVDIJOAYSEM-LBPRGKRZSA-N 1 1 257.324 3.787 20 10 CHCDMO CO[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858584936 1123665606 /nfs/dbraw/zinc/66/56/06/1123665606.db2.gz YKIGWETXJPITFR-CIUDSAMLSA-N 1 1 290.190 3.527 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCc2ccsc2C1 ZINC000127062318 1123690512 /nfs/dbraw/zinc/69/05/12/1123690512.db2.gz UAKQHKZGKWIGLO-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1 ZINC000859545914 1123700686 /nfs/dbraw/zinc/70/06/86/1123700686.db2.gz YPXJOOVJXUVNQW-SJORKVTESA-N 1 1 290.476 3.613 20 10 CHCDMO CC[C@@H]([NH2+]C1CCC(OC)CC1)c1ccc(F)cc1O ZINC000840792792 1123811483 /nfs/dbraw/zinc/81/14/83/1123811483.db2.gz REILIBRNNRSMND-SSDMNJCBSA-N 1 1 281.371 3.530 20 10 CHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000794653801 1123924888 /nfs/dbraw/zinc/92/48/88/1123924888.db2.gz FSIISGPUAJZOLR-SFHVURJKSA-N 1 1 291.435 3.825 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC3(CCC3)C[C@H]2C)c(O)c1 ZINC000763645533 1129154054 /nfs/dbraw/zinc/15/40/54/1129154054.db2.gz HQHWAQLPKPULPW-CYBMUJFWSA-N 1 1 275.392 3.555 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000783593269 1123998380 /nfs/dbraw/zinc/99/83/80/1123998380.db2.gz OVPWXOLRKLXXNO-CWRNSKLLSA-N 1 1 259.393 3.711 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCCO1)c1ccc(F)cc1O ZINC000866491202 1124072431 /nfs/dbraw/zinc/07/24/31/1124072431.db2.gz NKJLSIULAKYXNE-MZPVMMEZSA-N 1 1 293.382 3.530 20 10 CHCDMO CCCOc1ccc(C[NH2+]Cc2ncccc2F)cc1C ZINC000873095679 1124738308 /nfs/dbraw/zinc/73/83/08/1124738308.db2.gz HYJHJJONEQUBHD-UHFFFAOYSA-N 1 1 288.366 3.608 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000124974027 1124829039 /nfs/dbraw/zinc/82/90/39/1124829039.db2.gz JBWLLZJLGZPBRF-QGZVFWFLSA-N 1 1 297.398 3.608 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC000825943686 1125017624 /nfs/dbraw/zinc/01/76/24/1125017624.db2.gz ICNAORPGZAGYCI-JTQLQIEISA-N 1 1 289.753 3.831 20 10 CHCDMO Cc1ccc(CNc2cccc(C3CC3)[nH+]2)c(O)c1 ZINC000877549495 1125043532 /nfs/dbraw/zinc/04/35/32/1125043532.db2.gz DNGXOFIFEUFXSJ-UHFFFAOYSA-N 1 1 254.333 3.585 20 10 CHCDMO C[N@H+](Cc1ccccc1O)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000878242895 1125133900 /nfs/dbraw/zinc/13/39/00/1125133900.db2.gz WSHAYIXOLUHZTA-IEBWSBKVSA-N 1 1 297.398 3.744 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000211470078 1125306344 /nfs/dbraw/zinc/30/63/44/1125306344.db2.gz XOXFXVWVMDAPGB-RISCZKNCSA-N 1 1 265.784 3.810 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H](C(C)C)CC2)c1O ZINC000211444554 1125306410 /nfs/dbraw/zinc/30/64/10/1125306410.db2.gz DWCIERARVWVHHH-AWEZNQCLSA-N 1 1 277.408 3.659 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](CC(C)C)C2CCCC2)c1 ZINC000211653088 1125314864 /nfs/dbraw/zinc/31/48/64/1125314864.db2.gz MBXKEAPNNMIGHD-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000131066122 1125373196 /nfs/dbraw/zinc/37/31/96/1125373196.db2.gz XPIHOVLKKGRNRC-LBPRGKRZSA-N 1 1 276.355 3.678 20 10 CHCDMO CC[C@H]([NH2+][C@@H](CC)[C@@H]1CCCOC1)c1ccc(F)cc1O ZINC000883352973 1125400348 /nfs/dbraw/zinc/40/03/48/1125400348.db2.gz LVDSUBYHAJTGGN-KCXAZCMYSA-N 1 1 295.398 3.777 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000131994401 1125412631 /nfs/dbraw/zinc/41/26/31/1125412631.db2.gz SLXRACAULUNPFG-KRWDZBQOSA-N 1 1 283.371 3.520 20 10 CHCDMO CCCC[N@@H+](Cc1ccc(F)cn1)Cc1ccccc1O ZINC000282571515 1129272913 /nfs/dbraw/zinc/27/29/13/1129272913.db2.gz ZQDAQGOMFHPKNP-UHFFFAOYSA-N 1 1 288.366 3.729 20 10 CHCDMO C[N@@H+](Cc1ccc(F)c(Cl)c1)Cc1ccccc1O ZINC000091956663 1129375617 /nfs/dbraw/zinc/37/56/17/1129375617.db2.gz NWUPDNRRUCJKHT-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000092485803 1129395531 /nfs/dbraw/zinc/39/55/31/1129395531.db2.gz SAQDSZMRMKUTLL-CJNGLKHVSA-N 1 1 275.392 3.555 20 10 CHCDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132212 1129418071 /nfs/dbraw/zinc/41/80/71/1129418071.db2.gz DDCVSRMFIRZMLL-STQMWFEESA-N 1 1 277.408 3.800 20 10 CHCDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093315174 1129421316 /nfs/dbraw/zinc/42/13/16/1129421316.db2.gz UAPRILXXCJYTEN-AWEZNQCLSA-N 1 1 284.403 3.651 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](CCO)c2ccccc2)cc1C ZINC000093442495 1129424026 /nfs/dbraw/zinc/42/40/26/1129424026.db2.gz PQIHTQRLYRWRTI-GOSISDBHSA-N 1 1 299.414 3.565 20 10 CHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868897 1129428723 /nfs/dbraw/zinc/42/87/23/1129428723.db2.gz PTYRMXCXPXMXPZ-LSDHHAIUSA-N 1 1 279.449 3.807 20 10 CHCDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154178 1129468407 /nfs/dbraw/zinc/46/84/07/1129468407.db2.gz FBUNGRJJXAUDBA-ZIAGYGMSSA-N 1 1 284.403 3.951 20 10 CHCDMO CC1(C)[C@@H]2C[N@H+](Cc3c(O)ccc4ccccc43)C[C@@H]21 ZINC000742166382 1129468483 /nfs/dbraw/zinc/46/84/83/1129468483.db2.gz MLERNMQTJMCHAZ-IYBDPMFKSA-N 1 1 267.372 3.633 20 10 CHCDMO Cc1ccc(C)c(OCC[N@H+](C)Cc2ccccc2O)c1 ZINC000303429789 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Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2ccccc2O)cc1 ZINC000770509479 1129948747 /nfs/dbraw/zinc/94/87/47/1129948747.db2.gz AESDQDZTFVJWJS-SFHVURJKSA-N 1 1 281.399 3.908 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000770509480 1129948777 /nfs/dbraw/zinc/94/87/77/1129948777.db2.gz AIVHNIIWIMJLSJ-UHFFFAOYSA-N 1 1 259.393 3.939 20 10 CHCDMO FC1=CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770665171 1129954043 /nfs/dbraw/zinc/95/40/43/1129954043.db2.gz CAMGXIMTKYHYSY-UHFFFAOYSA-N 1 1 274.383 3.736 20 10 CHCDMO FC1=CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770665171 1129954047 /nfs/dbraw/zinc/95/40/47/1129954047.db2.gz CAMGXIMTKYHYSY-UHFFFAOYSA-N 1 1 274.383 3.736 20 10 CHCDMO CCCC[N@@H+](CCCC(=O)CC)Cc1ccccc1O ZINC000829516067 1131423028 /nfs/dbraw/zinc/42/30/28/1131423028.db2.gz OOMFLJCYHTZVIZ-UHFFFAOYSA-N 1 1 277.408 3.754 20 10 CHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1cccnc1 ZINC000771924992 1129994907 /nfs/dbraw/zinc/99/49/07/1129994907.db2.gz SMIXERSYFRSXOB-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccnc1 ZINC000771924992 1129994909 /nfs/dbraw/zinc/99/49/09/1129994909.db2.gz SMIXERSYFRSXOB-UHFFFAOYSA-N 1 1 294.354 3.583 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc3cc[nH]c32)cc1 ZINC000771935140 1129996985 /nfs/dbraw/zinc/99/69/85/1129996985.db2.gz KDEWRRMIVZBOEK-UHFFFAOYSA-N 1 1 293.414 3.866 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c(O)c1 ZINC000903313731 1130152797 /nfs/dbraw/zinc/15/27/97/1130152797.db2.gz XXVYKSJDRVYNTP-GFCCVEGCSA-N 1 1 288.391 3.837 20 10 CHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC(C)(C)C2)cc1F ZINC001462095128 1130191466 /nfs/dbraw/zinc/19/14/66/1130191466.db2.gz RJPCYABWVKMDNF-UHFFFAOYSA-N 1 1 282.378 3.653 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788806990 1130209961 /nfs/dbraw/zinc/20/99/61/1130209961.db2.gz RAIDYMSIHLKDRC-IUCAKERBSA-N 1 1 291.338 3.567 20 10 CHCDMO C[C@H](CC[N@@H+](C)Cc1ccccc1O)OCc1ccccc1 ZINC000789348823 1130242834 /nfs/dbraw/zinc/24/28/34/1130242834.db2.gz REVBUVQUWVBABC-MRXNPFEDSA-N 1 1 299.414 3.819 20 10 CHCDMO C[C@H](CCc1ccco1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790946523 1130340149 /nfs/dbraw/zinc/34/01/49/1130340149.db2.gz DEBZKLHBMCGLLK-SNVBAGLBSA-N 1 1 297.757 3.889 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1CCCCS1 ZINC000790986793 1130341235 /nfs/dbraw/zinc/34/12/35/1130341235.db2.gz VIFAHYXNYRVXEM-SECBINFHSA-N 1 1 289.803 3.560 20 10 CHCDMO CCC1([NH2+]Cc2c(O)ccc(Cl)c2F)CCC1 ZINC000790974438 1130344045 /nfs/dbraw/zinc/34/40/45/1130344045.db2.gz VQHHXRMEMBUPBB-UHFFFAOYSA-N 1 1 257.736 3.607 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000790977056 1130345100 /nfs/dbraw/zinc/34/51/00/1130345100.db2.gz FQZCODSPHUUYKE-QMMMGPOBSA-N 1 1 293.716 3.852 20 10 CHCDMO CC[C@@H]1CCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792166996 1130436332 /nfs/dbraw/zinc/43/63/32/1130436332.db2.gz JYWDMLLWWAOPSI-SECBINFHSA-N 1 1 257.736 3.559 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792166996 1130436334 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C[C@@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2[O-])CCC1(F)F ZINC001237808582 1131142007 /nfs/dbraw/zinc/14/20/07/1131142007.db2.gz UJONMWLTXJNADC-MRVPVSSYSA-N 1 1 293.716 3.662 20 10 CHCDMO C[C@@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CCC1(F)F ZINC001237808582 1131142011 /nfs/dbraw/zinc/14/20/11/1131142011.db2.gz UJONMWLTXJNADC-MRVPVSSYSA-N 1 1 293.716 3.662 20 10 CHCDMO [O-]c1c(Cl)cc(F)cc1C[N@H+]1CCC12CCCC2 ZINC001237807496 1131142588 /nfs/dbraw/zinc/14/25/88/1131142588.db2.gz KKTNOHKISLEHJQ-UHFFFAOYSA-N 1 1 269.747 3.703 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2[O-])C2(CC2)C1 ZINC001237807221 1131142717 /nfs/dbraw/zinc/14/27/17/1131142717.db2.gz ZICLBXMEPGYRPJ-VIFPVBQESA-N 1 1 269.747 3.559 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001237948682 1131155239 /nfs/dbraw/zinc/15/52/39/1131155239.db2.gz GKLCIEMLKVGLBA-IINYFYTJSA-N 1 1 283.774 3.949 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001237948682 1131155240 /nfs/dbraw/zinc/15/52/40/1131155240.db2.gz GKLCIEMLKVGLBA-IINYFYTJSA-N 1 1 283.774 3.949 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(F)CC2)c1O ZINC001238058202 1131164869 /nfs/dbraw/zinc/16/48/69/1131164869.db2.gz PHDSAZZHLTUDGB-OAHLLOKOSA-N 1 1 269.335 3.554 20 10 CHCDMO Cc1cc(F)cc(C[N@H+](C)C2CCCCC2)c1O ZINC001238055734 1131165302 /nfs/dbraw/zinc/16/53/02/1131165302.db2.gz CRYWVIRKRIGGIY-UHFFFAOYSA-N 1 1 251.345 3.604 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCc3ccc(F)cc3C2)c1O ZINC001238070813 1131167775 /nfs/dbraw/zinc/16/77/75/1131167775.db2.gz PMBZCRRDEYZDOO-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccc2ccccc2c1[O-] ZINC000817959527 1131191091 /nfs/dbraw/zinc/19/10/91/1131191091.db2.gz GWOAORHKKNAPMV-JOQOYGCGSA-N 1 1 298.430 3.714 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817966261 1131193548 /nfs/dbraw/zinc/19/35/48/1131193548.db2.gz JWJQNTROTYSNNT-IFXJQAMLSA-N 1 1 298.430 3.586 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](c3cccnc3)C2)cc1 ZINC000829522484 1131423074 /nfs/dbraw/zinc/42/30/74/1131423074.db2.gz JOSBONHCGNKALK-GOSISDBHSA-N 1 1 295.430 3.527 20 10 CHCDMO CCCCC1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC001138123913 1131470026 /nfs/dbraw/zinc/47/00/26/1131470026.db2.gz RHLXJMUWDDTCFQ-UHFFFAOYSA-N 1 1 265.372 3.934 20 10 CHCDMO Cc1c(C[N@@H+](C)Cc2ccncc2)c2ccccc2n1C ZINC001138252543 1131481994 /nfs/dbraw/zinc/48/19/94/1131481994.db2.gz KSRMYZYNGOMEAN-UHFFFAOYSA-N 1 1 279.387 3.514 20 10 CHCDMO Cc1c(C[N@@H+](C)Cc2cncs2)c2ccccc2n1C ZINC001138259975 1131483188 /nfs/dbraw/zinc/48/31/88/1131483188.db2.gz UAICVDIIYSQWSB-UHFFFAOYSA-N 1 1 285.416 3.575 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCCC1(F)F ZINC000824799193 1131484727 /nfs/dbraw/zinc/48/47/27/1131484727.db2.gz LUJVDGJOYRCJRO-SECBINFHSA-N 1 1 293.716 3.710 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc3c(c2)CCCN3C)CCC1(F)F ZINC001138354472 1131493849 /nfs/dbraw/zinc/49/38/49/1131493849.db2.gz LBLOURMGAJOALT-CYBMUJFWSA-N 1 1 294.389 3.546 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000825104528 1131495546 /nfs/dbraw/zinc/49/55/46/1131495546.db2.gz ZKMQXUVEDRRGOY-KRWDZBQOSA-N 1 1 299.370 3.721 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC001138387787 1131496766 /nfs/dbraw/zinc/49/67/66/1131496766.db2.gz LGNUQCRVAICUNB-HNNXBMFYSA-N 1 1 290.451 3.916 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N(CC)CC)cc2OC)C1 ZINC001138391948 1131498584 /nfs/dbraw/zinc/49/85/84/1131498584.db2.gz KGEBADYZKZCUIA-OAHLLOKOSA-N 1 1 290.451 3.773 20 10 CHCDMO Cc1c2cc(F)ccc2[nH]c1C[N@H+](C)Cc1ccccc1O ZINC001138414268 1131501174 /nfs/dbraw/zinc/50/11/74/1131501174.db2.gz UUXGAIHATBEBAQ-UHFFFAOYSA-N 1 1 298.361 3.953 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000825214927 1131502665 /nfs/dbraw/zinc/50/26/65/1131502665.db2.gz BFBPCGLVCMWBSN-HNNXBMFYSA-N 1 1 297.851 3.765 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC001140179503 1131672952 /nfs/dbraw/zinc/67/29/52/1131672952.db2.gz LEEVTNQHLDLRJD-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc(F)cc2)c1O ZINC001140178148 1131673598 /nfs/dbraw/zinc/67/35/98/1131673598.db2.gz APANZTGNDSRPJN-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC23CCCC3)c1O ZINC000846000538 1131677055 /nfs/dbraw/zinc/67/70/55/1131677055.db2.gz SNWHPTKRNCLAED-UHFFFAOYSA-N 1 1 281.783 3.573 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846103845 1131690569 /nfs/dbraw/zinc/69/05/69/1131690569.db2.gz ACTZHHBFJHXHIP-MRXNPFEDSA-N 1 1 294.389 3.682 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C(F)F ZINC000834827007 1131707880 /nfs/dbraw/zinc/70/78/80/1131707880.db2.gz HCEFKLXJLZOWAR-XVKPBYJWSA-N 1 1 263.715 3.740 20 10 CHCDMO C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)c1ccc(F)cc1O ZINC000846184647 1131697651 /nfs/dbraw/zinc/69/76/51/1131697651.db2.gz MMSZVTYLWKZWRY-QCZZGDTMSA-N 1 1 289.753 3.887 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC12CCCCC2 ZINC001140337901 1131702770 /nfs/dbraw/zinc/70/27/70/1131702770.db2.gz MBEKGGWZBGRRGX-UHFFFAOYSA-N 1 1 265.784 3.954 20 10 CHCDMO CCc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000846210381 1131703358 /nfs/dbraw/zinc/70/33/58/1131703358.db2.gz ZLFKLWXYRDEIQE-LBPRGKRZSA-N 1 1 273.351 3.945 20 10 CHCDMO C[N@@H+](CCc1cccc(F)c1)Cc1c(O)cccc1Cl ZINC001140342248 1131703684 /nfs/dbraw/zinc/70/36/84/1131703684.db2.gz ZULZQZZQDGMRRH-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(O)cccc1Cl ZINC001140341668 1131703857 /nfs/dbraw/zinc/70/38/57/1131703857.db2.gz BDUJNKVISOSSAQ-UHFFFAOYSA-N 1 1 291.778 3.773 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001140465399 1131751344 /nfs/dbraw/zinc/75/13/44/1131751344.db2.gz LWEBDLVWLCVVOD-OAHLLOKOSA-N 1 1 273.763 3.993 20 10 CHCDMO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)Cc1ccccn1 ZINC000835030386 1131759079 /nfs/dbraw/zinc/75/90/79/1131759079.db2.gz XQXLOLXXLPTNTQ-FPLPWBNLSA-N 1 1 295.430 3.683 20 10 CHCDMO Cc1ccc(C[N@H+](C)C/C=C/c2ccc(N(C)C)cc2)nc1 ZINC000835051248 1131766880 /nfs/dbraw/zinc/76/68/80/1131766880.db2.gz XQDITESJYQEAOI-AATRIKPKSA-N 1 1 295.430 3.601 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c1 ZINC001140623620 1131833093 /nfs/dbraw/zinc/83/30/93/1131833093.db2.gz YHSZRMVDAUNEJD-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@H]2c2ccccc2)c1O ZINC001140745546 1131906055 /nfs/dbraw/zinc/90/60/55/1131906055.db2.gz KHMQAGQAWLAMJX-INIZCTEOSA-N 1 1 283.371 3.743 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)c(O)c1 ZINC001140855225 1131947856 /nfs/dbraw/zinc/94/78/56/1131947856.db2.gz SKADXVOFYZGION-CABCVRRESA-N 1 1 290.451 3.859 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CC2(C)C)c(O)c1 ZINC001140855608 1131949673 /nfs/dbraw/zinc/94/96/73/1131949673.db2.gz FIRZPOBWHPFFTP-OAHLLOKOSA-N 1 1 290.451 3.716 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140925525 1131966483 /nfs/dbraw/zinc/96/64/83/1131966483.db2.gz CLUBJBDVVGQACI-GFCCVEGCSA-N 1 1 266.816 3.638 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001140948108 1131969068 /nfs/dbraw/zinc/96/90/68/1131969068.db2.gz TZALAMBINABZCS-UHFFFAOYSA-N 1 1 259.393 3.857 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2csc(C(C)C)n2)c(O)c1 ZINC001140950845 1131971235 /nfs/dbraw/zinc/97/12/35/1131971235.db2.gz KPXNKLCTHQJXMI-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2csc(C(C)C)n2)c(O)c1 ZINC001140950845 1131971237 /nfs/dbraw/zinc/97/12/37/1131971237.db2.gz KPXNKLCTHQJXMI-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO COc1ccc(NCc2cc3ccccc3cc2O)[nH+]c1C ZINC001171407914 1131976278 /nfs/dbraw/zinc/97/62/78/1131976278.db2.gz YKPGEULXOKHMBP-UHFFFAOYSA-N 1 1 294.354 3.870 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074770 1132005658 /nfs/dbraw/zinc/00/56/58/1132005658.db2.gz BCTUTZBLZBWXQT-CQSZACIVSA-N 1 1 272.436 3.616 20 10 CHCDMO CC(C)N(CC[NH2+][C@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000037188685 1132009766 /nfs/dbraw/zinc/00/97/66/1132009766.db2.gz KHYZTVMWXYZFEA-MRXNPFEDSA-N 1 1 291.483 3.522 20 10 CHCDMO C[N@@H+](Cc1ccc2ccccc2c1)Cc1cc(O)ccc1O ZINC001141161848 1132030873 /nfs/dbraw/zinc/03/08/73/1132030873.db2.gz FZWOUPAQOJJHPE-UHFFFAOYSA-N 1 1 293.366 3.883 20 10 CHCDMO C[C@@H]1CC[C@@H]([N@H+]2CCc3cccc(O)c3C2)C[C@H]1C ZINC001172379577 1132171247 /nfs/dbraw/zinc/17/12/47/1132171247.db2.gz ORFCPCVCZOOULJ-UMVBOHGHSA-N 1 1 259.393 3.575 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](F)C1)oc1ccccc12 ZINC000840103272 1132247414 /nfs/dbraw/zinc/24/74/14/1132247414.db2.gz AQGKLZRJBKSPMH-GFCCVEGCSA-N 1 1 285.318 3.835 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+]2Cc3cccc(F)c3C2)c1 ZINC000840160682 1132247929 /nfs/dbraw/zinc/24/79/29/1132247929.db2.gz CBZOZRLHCMVMRR-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2Cc3cccc(F)c3C2)c1 ZINC000840160682 1132247931 /nfs/dbraw/zinc/24/79/31/1132247931.db2.gz CBZOZRLHCMVMRR-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc2cncn2c1)c1ccc(C)cc1O ZINC000840779552 1132286740 /nfs/dbraw/zinc/28/67/40/1132286740.db2.gz MYUPMZXICHMCCC-QGZVFWFLSA-N 1 1 295.386 3.589 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(F)cc1O ZINC000840820096 1132290846 /nfs/dbraw/zinc/29/08/46/1132290846.db2.gz JVFUHXDKFBVTTN-KJEVXHAQSA-N 1 1 263.356 3.761 20 10 CHCDMO C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(F)cc1O ZINC000840811148 1132291214 /nfs/dbraw/zinc/29/12/14/1132291214.db2.gz GYZNIRPFKZTAQH-LLVKDONJSA-N 1 1 263.356 3.905 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)[C@](C)(OC)C1CC1)c1ccc(F)cc1O ZINC000840858652 1132295792 /nfs/dbraw/zinc/29/57/92/1132295792.db2.gz FURVOAHOPLMRLP-KCTSRDHCSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCC[C@]1(C)O ZINC001231586956 1132317300 /nfs/dbraw/zinc/31/73/00/1132317300.db2.gz NTLNOTIRAQHSDX-KUHUBIRLSA-N 1 1 299.414 3.528 20 10 CHCDMO Cc1cccc(C[N@@H+](C)CCc2cccc(F)c2)c1O ZINC001231594423 1132320354 /nfs/dbraw/zinc/32/03/54/1132320354.db2.gz HJZKMYKXQXSUFQ-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@@H](OC)C1 ZINC001172950291 1132374105 /nfs/dbraw/zinc/37/41/05/1132374105.db2.gz MGPWCMBGCOZFRU-QZTJIDSGSA-N 1 1 290.451 3.532 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@@H+](C)Cc1ccccc1C ZINC001231851772 1132377645 /nfs/dbraw/zinc/37/76/45/1132377645.db2.gz HPHNFYWXIYGDSF-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001231845638 1132378157 /nfs/dbraw/zinc/37/81/57/1132378157.db2.gz DVYXICYBVHSDRM-MRXNPFEDSA-N 1 1 296.414 3.784 20 10 CHCDMO COCC[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870805 1132383567 /nfs/dbraw/zinc/38/35/67/1132383567.db2.gz UTRSHPHHPWRDPH-CQSZACIVSA-N 1 1 297.826 3.745 20 10 CHCDMO COCCCC[N@@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000841690847 1132384456 /nfs/dbraw/zinc/38/44/56/1132384456.db2.gz MZKSPTAIYCWRSS-UHFFFAOYSA-N 1 1 293.451 3.857 20 10 CHCDMO Cc1cccc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841750803 1132388817 /nfs/dbraw/zinc/38/88/17/1132388817.db2.gz BPQYPYXEBILQQK-GFCCVEGCSA-N 1 1 290.794 3.642 20 10 CHCDMO CCSCCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841750784 1132389250 /nfs/dbraw/zinc/38/92/50/1132389250.db2.gz BEDKSSQVCXHOKY-SNVBAGLBSA-N 1 1 273.829 3.839 20 10 CHCDMO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841747821 1132389376 /nfs/dbraw/zinc/38/93/76/1132389376.db2.gz DVJGUFRBVBXVGN-UEKVPHQBSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@]1(CF)CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231879668 1132389916 /nfs/dbraw/zinc/38/99/16/1132389916.db2.gz MZSVACGCKVMYGW-QGZVFWFLSA-N 1 1 273.351 3.727 20 10 CHCDMO C[C@@]1(F)CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC001231879902 1132390519 /nfs/dbraw/zinc/39/05/19/1132390519.db2.gz VLDMJLURPAWOLT-DOTOQJQBSA-N 1 1 291.341 3.817 20 10 CHCDMO CC(C)C[C@H](CCO)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841754088 1132391574 /nfs/dbraw/zinc/39/15/74/1132391574.db2.gz HRVGPWAZKKWCBC-OLZOCXBDSA-N 1 1 299.842 3.741 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Cl)cc1O ZINC000841753074 1132391624 /nfs/dbraw/zinc/39/16/24/1132391624.db2.gz DVDMNYDFUWOUHU-QPUJVOFHSA-N 1 1 275.726 3.884 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1ccc(Cl)cc1O ZINC000841755378 1132391685 /nfs/dbraw/zinc/39/16/85/1132391685.db2.gz ZHQDWHTZEGGNRM-JQWIXIFHSA-N 1 1 285.840 3.982 20 10 CHCDMO CSC(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841754061 1132393026 /nfs/dbraw/zinc/39/30/26/1132393026.db2.gz HLRWTXFRZNGWSQ-VIFPVBQESA-N 1 1 273.829 3.838 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2cc(F)c(F)cc2O)cc1C ZINC001142530310 1132404939 /nfs/dbraw/zinc/40/49/39/1132404939.db2.gz CNWDRRRCEPUJNE-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(F)c(F)cc2O)cc1C ZINC001142530310 1132404944 /nfs/dbraw/zinc/40/49/44/1132404944.db2.gz CNWDRRRCEPUJNE-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO CCC(CC)[N@@H+](CC)Cc1cc(Cl)c(O)cc1O ZINC001232262866 1132444113 /nfs/dbraw/zinc/44/41/13/1132444113.db2.gz UGNUEXRNRWYJOV-UHFFFAOYSA-N 1 1 271.788 3.762 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccccc2)cc1Cl ZINC001232263640 1132445160 /nfs/dbraw/zinc/44/51/60/1132445160.db2.gz CARHQDXOWPLHSQ-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1csc(Cl)c1)CC2 ZINC001142775362 1132445985 /nfs/dbraw/zinc/44/59/85/1132445985.db2.gz BJEFRPSJJJBGHO-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1csc(Cl)c1)CC2 ZINC001142775362 1132445989 /nfs/dbraw/zinc/44/59/89/1132445989.db2.gz BJEFRPSJJJBGHO-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(OC)cc1O ZINC001232269871 1132446980 /nfs/dbraw/zinc/44/69/80/1132446980.db2.gz LNFGNGMVTAFWNY-LBPRGKRZSA-N 1 1 283.799 3.819 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@@H]2C)cc1Cl ZINC001232264947 1132447614 /nfs/dbraw/zinc/44/76/14/1132447614.db2.gz PDNGOFVVJKSUEY-MNOVXSKESA-N 1 1 283.799 3.675 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@H](C)C2)cc1Cl ZINC001232267102 1132447703 /nfs/dbraw/zinc/44/77/03/1132447703.db2.gz WIXUZAURVWWOFK-VXGBXAGGSA-N 1 1 297.826 3.922 20 10 CHCDMO 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CCOc1cccc(C[N@@H+](C)[C@H]2CC[C@H](C)CC2)c1O ZINC001203617856 1133345477 /nfs/dbraw/zinc/34/54/77/1133345477.db2.gz VSBBRZDQVDHNNU-CTYIDZIISA-N 1 1 277.408 3.801 20 10 CHCDMO CC[N@@H+](Cc1ccc(OC)c(F)c1)Cc1ccccc1O ZINC001203791920 1133370089 /nfs/dbraw/zinc/37/00/89/1133370089.db2.gz IPKIDSRNSLMBPV-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)cc1O ZINC001203878572 1133378125 /nfs/dbraw/zinc/37/81/25/1133378125.db2.gz CVVXHNURZYWJGR-KRWDZBQOSA-N 1 1 297.398 3.868 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1O ZINC001203881095 1133378714 /nfs/dbraw/zinc/37/87/14/1133378714.db2.gz DHHVMNLSLIXJEC-HNNXBMFYSA-N 1 1 287.334 3.574 20 10 CHCDMO Cc1ccc(CC[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001203934349 1133386096 /nfs/dbraw/zinc/38/60/96/1133386096.db2.gz RMVDHKZOUJGYIW-UHFFFAOYSA-N 1 1 282.431 3.736 20 10 CHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203930317 1133386685 /nfs/dbraw/zinc/38/66/85/1133386685.db2.gz RUDYCILAFFBEKS-HNNXBMFYSA-N 1 1 280.415 3.872 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)CCC1(F)F ZINC001203930322 1133387031 /nfs/dbraw/zinc/38/70/31/1133387031.db2.gz RZPYFDIXSWYJMT-CYBMUJFWSA-N 1 1 282.378 3.620 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC001203945985 1133387987 /nfs/dbraw/zinc/38/79/87/1133387987.db2.gz QYWJQLGBSPKSBI-OAHLLOKOSA-N 1 1 260.425 3.765 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@@H](C)CC23CC3)cc1 ZINC001203942448 1133388073 /nfs/dbraw/zinc/38/80/73/1133388073.db2.gz QUIMZFCMFAIJHL-HNNXBMFYSA-N 1 1 272.436 3.907 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001204274758 1133426906 /nfs/dbraw/zinc/42/69/06/1133426906.db2.gz INGKCADYLKSOLU-MRXNPFEDSA-N 1 1 287.334 3.574 20 10 CHCDMO C[N@@H+](Cc1ccc2ccccc2c1)Cc1ccc(O)cc1O ZINC001204277702 1133427387 /nfs/dbraw/zinc/42/73/87/1133427387.db2.gz IPVIMECFKVYDNH-UHFFFAOYSA-N 1 1 293.366 3.883 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204329332 1133438591 /nfs/dbraw/zinc/43/85/91/1133438591.db2.gz MOTNHTYVNVUJMF-OAHLLOKOSA-N 1 1 258.409 3.519 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001204388369 1133441884 /nfs/dbraw/zinc/44/18/84/1133441884.db2.gz BKANOOCJZIKCSB-LLVKDONJSA-N 1 1 253.773 3.586 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(Cl)cc1[O-] ZINC001204401657 1133442697 /nfs/dbraw/zinc/44/26/97/1133442697.db2.gz KRUQUKNGYUXCTF-LLVKDONJSA-N 1 1 255.789 3.914 20 10 CHCDMO CC[C@@H](C)C[N@H+](CC)Cc1ccc(Cl)cc1O ZINC001204401657 1133442699 /nfs/dbraw/zinc/44/26/99/1133442699.db2.gz KRUQUKNGYUXCTF-LLVKDONJSA-N 1 1 255.789 3.914 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(Cl)cc1O ZINC001204401657 1133442703 /nfs/dbraw/zinc/44/27/03/1133442703.db2.gz KRUQUKNGYUXCTF-LLVKDONJSA-N 1 1 255.789 3.914 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204657192 1133472194 /nfs/dbraw/zinc/47/21/94/1133472194.db2.gz BKNCCABSYFLBDD-HNNXBMFYSA-N 1 1 282.378 3.651 20 10 CHCDMO CCC[C@H](C[N@@H+](Cc1ccccc1O)C1CCCC1)OC ZINC001204923354 1133499926 /nfs/dbraw/zinc/49/99/26/1133499926.db2.gz KUJHFNJBBCJQAQ-QGZVFWFLSA-N 1 1 291.435 3.952 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)c1O ZINC001205298884 1133556911 /nfs/dbraw/zinc/55/69/11/1133556911.db2.gz JREWYIKVTWWOSZ-LLVKDONJSA-N 1 1 297.826 3.922 20 10 CHCDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc(C(C)C)ccc1O ZINC001205589534 1133591312 /nfs/dbraw/zinc/59/13/12/1133591312.db2.gz QKBNOYMEGCODME-GOSISDBHSA-N 1 1 291.435 3.643 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH+](C1CCC1)C1CCC1 ZINC001206064143 1133652424 /nfs/dbraw/zinc/65/24/24/1133652424.db2.gz WZAHTORFSDOCOX-UHFFFAOYSA-N 1 1 267.319 3.577 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001207707943 1133840811 /nfs/dbraw/zinc/84/08/11/1133840811.db2.gz JVUMRPIFZSBCHT-INIZCTEOSA-N 1 1 285.362 3.569 20 10 CHCDMO Cc1ccc(CCC[N@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC001207950759 1133870215 /nfs/dbraw/zinc/87/02/15/1133870215.db2.gz RFHVLEIIRVYVDQ-UHFFFAOYSA-N 1 1 286.419 3.719 20 10 CHCDMO Cc1ccc([C@H](C)CC[N@@H+](C)Cc2ccccc2O)o1 ZINC001208169755 1133894340 /nfs/dbraw/zinc/89/43/40/1133894340.db2.gz VDSUCJRIKIEFQH-CYBMUJFWSA-N 1 1 273.376 3.919 20 10 CHCDMO C[N@@H+]1CC=C(Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC001208836794 1133950344 /nfs/dbraw/zinc/95/03/44/1133950344.db2.gz BCBCDMDACYXBOQ-UHFFFAOYSA-N 1 1 292.382 3.549 20 10 CHCDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209517418 1134033937 /nfs/dbraw/zinc/03/39/37/1134033937.db2.gz DVIJFTRRZSDLAV-IBGZPJMESA-N 1 1 298.430 3.705 20 10 CHCDMO Oc1cccc(Cl)c1Nc1cc[nH+]cc1C(F)(F)F ZINC001215981649 1134740463 /nfs/dbraw/zinc/74/04/63/1134740463.db2.gz AQBUDTHIUHVMPI-UHFFFAOYSA-N 1 1 288.656 3.625 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(C)o2)c1O ZINC000184673343 262026152 /nfs/dbraw/zinc/02/61/52/262026152.db2.gz CHXXWQFXBTUSPP-UHFFFAOYSA-N 1 1 295.766 3.588 20 10 CHCDMO C[C@H]([NH2+]CC1(CCO)CCCCC1)c1ccc(F)cc1O ZINC000185669289 262065623 /nfs/dbraw/zinc/06/56/23/262065623.db2.gz MSKCUZQLBKAWRN-ZDUSSCGKSA-N 1 1 295.398 3.515 20 10 CHCDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000186156169 262081798 /nfs/dbraw/zinc/08/17/98/262081798.db2.gz VPGRKLAADQVIIB-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO CC[N@@H+](Cc1cc(C)ccc1O)[C@@H](C)c1cccnc1 ZINC000290447203 263116905 /nfs/dbraw/zinc/11/69/05/263116905.db2.gz MCLYBFKEUYZPAS-AWEZNQCLSA-N 1 1 270.376 3.679 20 10 CHCDMO CC[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(F)cc1O ZINC000293827244 263150471 /nfs/dbraw/zinc/15/04/71/263150471.db2.gz WJJGTRUJCGPXES-GFCCVEGCSA-N 1 1 273.298 3.617 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccn1 ZINC000299195118 519655076 /nfs/dbraw/zinc/65/50/76/519655076.db2.gz MQZZEFIXZMZPJD-UHFFFAOYSA-N 1 1 283.419 3.558 20 10 CHCDMO CCCCN1CCC([NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000037150533 520576396 /nfs/dbraw/zinc/57/63/96/520576396.db2.gz HVTMTOSDLPAVAR-OAHLLOKOSA-N 1 1 290.451 3.616 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)c2ccco2)c1O ZINC000131075368 521333045 /nfs/dbraw/zinc/33/30/45/521333045.db2.gz IHBODAFKZSEZOV-GFCCVEGCSA-N 1 1 275.348 3.577 20 10 CHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@@H](C)c1cccnc1 ZINC000290519859 521338934 /nfs/dbraw/zinc/33/89/34/521338934.db2.gz PZWCNROIBMBHCC-AWEZNQCLSA-N 1 1 270.376 3.679 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)Cc1ccc(F)nc1C ZINC000278498059 521690088 /nfs/dbraw/zinc/69/00/88/521690088.db2.gz VBOATOQQVDYISQ-UHFFFAOYSA-N 1 1 288.366 3.647 20 10 CHCDMO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062747712 524157151 /nfs/dbraw/zinc/15/71/51/524157151.db2.gz BPUPEQRGQUJLDO-NWDGAFQWSA-N 1 1 289.350 3.952 20 10 CHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1O ZINC000292757603 524385768 /nfs/dbraw/zinc/38/57/68/524385768.db2.gz JDIBQWRDVSUTHH-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)s1 ZINC000062748406 524605911 /nfs/dbraw/zinc/60/59/11/524605911.db2.gz AIKRVMPLVXGLTE-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1C ZINC000289868712 525316889 /nfs/dbraw/zinc/31/68/89/525316889.db2.gz RBWUMLQNNICMLV-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Br)[C@@H]1C ZINC000707147310 1118648207 /nfs/dbraw/zinc/64/82/07/1118648207.db2.gz YHBHIUDHHFLRGD-GHMZBOCLSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1c(O)cccc1Br ZINC000707145802 1118648215 /nfs/dbraw/zinc/64/82/15/1118648215.db2.gz HJJZHDSLWDVUJY-WDEREUQCSA-N 1 1 298.224 3.775 20 10 CHCDMO C[N@H+](CCC1CCCCC1)Cc1cccc(F)c1O ZINC001180093730 1121940746 /nfs/dbraw/zinc/94/07/46/1121940746.db2.gz VRBXXZGPPHCGGY-UHFFFAOYSA-N 1 1 265.372 3.934 20 10 CHCDMO C[N@@H+](CCC1CCCCC1)Cc1cccc(F)c1O ZINC001180093730 1121940748 /nfs/dbraw/zinc/94/07/48/1121940748.db2.gz VRBXXZGPPHCGGY-UHFFFAOYSA-N 1 1 265.372 3.934 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)cc1 ZINC001192481863 1122649363 /nfs/dbraw/zinc/64/93/63/1122649363.db2.gz QXPOPQQWZZCIBO-OAHLLOKOSA-N 1 1 260.425 3.621 20 10 CHCDMO C[C@@H]([NH2+][C@H]1C=CCC1)c1cccc(C(F)(F)F)c1O ZINC000850510698 1123277971 /nfs/dbraw/zinc/27/79/71/1123277971.db2.gz WNLRUCNEZAEXAC-ZJUUUORDSA-N 1 1 271.282 3.780 20 10 CHCDMO CC(C)c1nc(C[N@@H+](C)Cc2ccccc2O)cs1 ZINC000111235436 1123432444 /nfs/dbraw/zinc/43/24/44/1123432444.db2.gz NFRCGQONZJEQAJ-UHFFFAOYSA-N 1 1 276.405 3.604 20 10 CHCDMO CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000019915128 1124769746 /nfs/dbraw/zinc/76/97/46/1124769746.db2.gz WZSICAPSZOSLRM-ZDUSSCGKSA-N 1 1 298.858 3.646 20 10 CHCDMO CCC(O)(CC)CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752873 1132392385 /nfs/dbraw/zinc/39/23/85/1132392385.db2.gz QQTPMLFMXOHIRF-NSHDSACASA-N 1 1 285.815 3.637 20 10 CHCDMO C[C@H]1CCCC[N@@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233415908 1132617622 /nfs/dbraw/zinc/61/76/22/1132617622.db2.gz NXGVJULQIXYLRM-JTQLQIEISA-N 1 1 273.298 3.785 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233415908 1132617626 /nfs/dbraw/zinc/61/76/26/1132617626.db2.gz NXGVJULQIXYLRM-JTQLQIEISA-N 1 1 273.298 3.785 20 10 CHCDMO Oc1c(C[N@@H+]2CCC[C@@H](CF)C2)cccc1C(F)(F)F ZINC001233418321 1132617702 /nfs/dbraw/zinc/61/77/02/1132617702.db2.gz BMROIXANRGXZGU-JTQLQIEISA-N 1 1 291.288 3.593 20 10 CHCDMO Oc1c(C[N@H+]2CCC[C@@H](CF)C2)cccc1C(F)(F)F ZINC001233418321 1132617704 /nfs/dbraw/zinc/61/77/04/1132617704.db2.gz BMROIXANRGXZGU-JTQLQIEISA-N 1 1 291.288 3.593 20 10 CHCDMO CC[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)N1CCCC1 ZINC000841746194 1125569619 /nfs/dbraw/zinc/56/96/19/1125569619.db2.gz WFZMOZYWQBVEDD-GXTWGEPZSA-N 1 1 296.842 3.571 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccc(Cl)cc1O ZINC000841756641 1125592172 /nfs/dbraw/zinc/59/21/72/1125592172.db2.gz ZIPQPPXILXGHDY-UVBJJODRSA-N 1 1 297.826 3.637 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1c(O)cccc1F ZINC000886489432 1125680649 /nfs/dbraw/zinc/68/06/49/1125680649.db2.gz IPICTNKGCNBYFF-NWDGAFQWSA-N 1 1 259.324 3.943 20 10 CHCDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886526544 1125684572 /nfs/dbraw/zinc/68/45/72/1125684572.db2.gz NQMPQDODLARULH-IUCAKERBSA-N 1 1 278.327 3.548 20 10 CHCDMO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1c(O)cccc1F ZINC000886557255 1125689876 /nfs/dbraw/zinc/68/98/76/1125689876.db2.gz XAJDPAQIHMDLAY-APPDUMDISA-N 1 1 286.350 3.728 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(F)c1 ZINC000886552065 1125689924 /nfs/dbraw/zinc/68/99/24/1125689924.db2.gz TUSIEWSVMNWBND-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1c(O)cccc1F ZINC000886558706 1125690348 /nfs/dbraw/zinc/69/03/48/1125690348.db2.gz QFOTUYYSMUSEEW-ZOWXZIJZSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)CO2 ZINC000886551850 1125690476 /nfs/dbraw/zinc/69/04/76/1125690476.db2.gz PNKAGUCEVNUQQB-FZMZJTMJSA-N 1 1 287.334 3.624 20 10 CHCDMO CC(C)[C@H]1C[C@@H](C[NH2+][C@@H](C)c2c(O)cccc2F)CCO1 ZINC000886618945 1125699100 /nfs/dbraw/zinc/69/91/00/1125699100.db2.gz PDOVTXGDVSGKJN-HEHGZKQESA-N 1 1 295.398 3.633 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1c(O)cccc1F ZINC000886619164 1125699460 /nfs/dbraw/zinc/69/94/60/1125699460.db2.gz VGXNAVZDGBQMTC-UFBFGSQYSA-N 1 1 292.181 3.766 20 10 CHCDMO COCc1csc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886637691 1125700800 /nfs/dbraw/zinc/70/08/00/1125700800.db2.gz CJDIZYUEIWTQEG-SNVBAGLBSA-N 1 1 295.379 3.590 20 10 CHCDMO CSCC1(CC[NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886636201 1125701089 /nfs/dbraw/zinc/70/10/89/1125701089.db2.gz HQIUSLSIFYOSHD-NSHDSACASA-N 1 1 283.412 3.715 20 10 CHCDMO COc1cccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1O ZINC000092483930 1125758762 /nfs/dbraw/zinc/75/87/62/1125758762.db2.gz PAHAUMCHAQDNEF-GFCCVEGCSA-N 1 1 287.359 3.719 20 10 CHCDMO CCC[N@@H+](Cc1cccs1)Cc1ccccc1O ZINC000092705068 1129405024 /nfs/dbraw/zinc/40/50/24/1129405024.db2.gz RVCFUWWWZVRIAN-UHFFFAOYSA-N 1 1 261.390 3.866 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000302740033 1126741142 /nfs/dbraw/zinc/74/11/42/1126741142.db2.gz NEAPPETXNJMJJC-UHFFFAOYSA-N 1 1 268.404 3.693 20 10 CHCDMO CCC(CC)[N@@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001236811307 1131012082 /nfs/dbraw/zinc/01/20/82/1131012082.db2.gz OIEAYWZVDXMXHJ-UHFFFAOYSA-N 1 1 265.397 3.720 20 10 CHCDMO CC[N@H+](Cc1ncc(C)s1)Cc1ccc(N(C)C)cc1 ZINC000271555366 1127091799 /nfs/dbraw/zinc/09/17/99/1127091799.db2.gz RITBXXZCQGVSDP-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CC[N@@H+](Cc1ncc(C)s1)Cc1ccc(N(C)C)cc1 ZINC000271555366 1127091803 /nfs/dbraw/zinc/09/18/03/1127091803.db2.gz RITBXXZCQGVSDP-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237116206 1131053006 /nfs/dbraw/zinc/05/30/06/1131053006.db2.gz YPEYPMFKKIEBJT-SNVBAGLBSA-N 1 1 289.297 3.665 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000163860969 1127145513 /nfs/dbraw/zinc/14/55/13/1127145513.db2.gz DHPONHLPQVYZJZ-CQSZACIVSA-N 1 1 277.408 3.659 20 10 CHCDMO CSCCC[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816599408 1131114550 /nfs/dbraw/zinc/11/45/50/1131114550.db2.gz LOFFWDYTPIMFPA-UHFFFAOYSA-N 1 1 275.417 3.730 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cncc2F)cc1C ZINC000285520405 1127235098 /nfs/dbraw/zinc/23/50/98/1127235098.db2.gz OXSGPRZYVGMREO-LLVKDONJSA-N 1 1 292.329 3.528 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1O ZINC000285630606 1127240159 /nfs/dbraw/zinc/24/01/59/1127240159.db2.gz LGIFGFNBZNEOPQ-OAHLLOKOSA-N 1 1 277.314 3.911 20 10 CHCDMO CC[C@H]([NH2+]Cc1cccs1)c1ccc(F)cc1O ZINC000285732736 1127241403 /nfs/dbraw/zinc/24/14/03/1127241403.db2.gz QRLHCUNCRZSTRP-ZDUSSCGKSA-N 1 1 265.353 3.834 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237947509 1131155066 /nfs/dbraw/zinc/15/50/66/1131155066.db2.gz QIUVRLSLORTTJW-AOOOYVTPSA-N 1 1 271.763 3.948 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237947509 1131155070 /nfs/dbraw/zinc/15/50/70/1131155070.db2.gz QIUVRLSLORTTJW-AOOOYVTPSA-N 1 1 271.763 3.948 20 10 CHCDMO CC[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000285899790 1127246402 /nfs/dbraw/zinc/24/64/02/1127246402.db2.gz BHCVFBZYYQBWLO-GOEBONIOSA-N 1 1 295.398 3.921 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)C)C1)c1ccc(F)cc1O ZINC000286160211 1127260991 /nfs/dbraw/zinc/26/09/91/1127260991.db2.gz PWBHGADTXDQOIC-QRTARXTBSA-N 1 1 295.398 3.776 20 10 CHCDMO CC[C@H]([NH2+]CCC1(COC)CCC1)c1ccc(F)cc1O ZINC000293759311 1127518006 /nfs/dbraw/zinc/51/80/06/1127518006.db2.gz RDMVUTDLHKYTFJ-HNNXBMFYSA-N 1 1 295.398 3.779 20 10 CHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1O ZINC000294050993 1127545548 /nfs/dbraw/zinc/54/55/48/1127545548.db2.gz WZMBGAKWXKMAHF-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1O ZINC000295094366 1127619566 /nfs/dbraw/zinc/61/95/66/1127619566.db2.gz UFQDSKBQSVPTJX-CMPLNLGQSA-N 1 1 273.298 3.555 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121215 1127650547 /nfs/dbraw/zinc/65/05/47/1127650547.db2.gz WEZAQJGVAMVYNT-GWCFXTLKSA-N 1 1 283.799 3.817 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)cc1 ZINC000296047779 1127661038 /nfs/dbraw/zinc/66/10/38/1127661038.db2.gz TWGRUOZOUYLELO-GOSISDBHSA-N 1 1 295.430 3.527 20 10 CHCDMO CC(C)[N@H+](Cc1cscn1)Cc1ccc(N(C)C)cc1 ZINC000298720522 1127730457 /nfs/dbraw/zinc/73/04/57/1127730457.db2.gz ODJVYSNILZDAIV-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO CC(C)[N@@H+](Cc1cscn1)Cc1ccc(N(C)C)cc1 ZINC000298720522 1127730460 /nfs/dbraw/zinc/73/04/60/1127730460.db2.gz ODJVYSNILZDAIV-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001138128692 1127772369 /nfs/dbraw/zinc/77/23/69/1127772369.db2.gz UXJOQXUEOOMVTH-ZDUSSCGKSA-N 1 1 281.346 3.636 20 10 CHCDMO Cc1cccc(OCC[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062748308 1127773673 /nfs/dbraw/zinc/77/36/73/1127773673.db2.gz FHDIAQJZTZVARO-CYBMUJFWSA-N 1 1 289.350 3.569 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc(F)cc1O ZINC000062748437 1127773882 /nfs/dbraw/zinc/77/38/82/1127773882.db2.gz DVPLQYDGDYCSFP-BLLLJJGKSA-N 1 1 285.362 3.739 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccncc1Cl ZINC000174374074 1127889777 /nfs/dbraw/zinc/88/97/77/1127889777.db2.gz OFDIMUPKZSIBMZ-UHFFFAOYSA-N 1 1 290.794 3.853 20 10 CHCDMO CCC[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152486424 1128128358 /nfs/dbraw/zinc/12/83/58/1128128358.db2.gz YBWVWEUMHDGABE-HNNXBMFYSA-N 1 1 285.387 3.546 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCCC2(CCC2)O1)c1c(O)cccc1F ZINC000927010245 1128207470 /nfs/dbraw/zinc/20/74/70/1128207470.db2.gz JKJQCJZRXQHVPG-CHWSQXEVSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(F)cc1O ZINC000927064479 1128214460 /nfs/dbraw/zinc/21/44/60/1128214460.db2.gz VMZZNKTWAQRLAV-ABAIWWIYSA-N 1 1 286.350 3.655 20 10 CHCDMO CCC[C@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001257308418 1128217982 /nfs/dbraw/zinc/21/79/82/1128217982.db2.gz RWVIQTIJWPRBFB-JTQLQIEISA-N 1 1 278.783 3.872 20 10 CHCDMO Cn1cccc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000153301609 1128228803 /nfs/dbraw/zinc/22/88/03/1128228803.db2.gz JQHOGWVVMKRJBV-UHFFFAOYSA-N 1 1 297.446 3.647 20 10 CHCDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000762140520 1128273170 /nfs/dbraw/zinc/27/31/70/1128273170.db2.gz FFTRNNUIWUZICA-CYBMUJFWSA-N 1 1 271.404 3.645 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC000777970827 1128351031 /nfs/dbraw/zinc/35/10/31/1128351031.db2.gz WGQRSYNCWHOPDA-MLGOLLRUSA-N 1 1 273.351 3.725 20 10 CHCDMO CC(C)[N@@H+](CCc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000917075493 1128474716 /nfs/dbraw/zinc/47/47/16/1128474716.db2.gz XKDRQUWFVZRWBC-UHFFFAOYSA-N 1 1 297.446 3.601 20 10 CHCDMO CC[N@@H+](CCc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000917466736 1128500988 /nfs/dbraw/zinc/50/09/88/1128500988.db2.gz NAVRJNJFPXZFFZ-UHFFFAOYSA-N 1 1 295.426 3.946 20 10 CHCDMO CCCCOCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917973709 1128528583 /nfs/dbraw/zinc/52/85/83/1128528583.db2.gz YACKJGFVHZHKGA-UHFFFAOYSA-N 1 1 292.467 3.780 20 10 CHCDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(C)ccc1O ZINC000154673058 1128540137 /nfs/dbraw/zinc/54/01/37/1128540137.db2.gz JPJBTUZBOILYRQ-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO Cn1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000156411763 1128635738 /nfs/dbraw/zinc/63/57/38/1128635738.db2.gz AYSQEOLQOJOYDK-UHFFFAOYSA-N 1 1 296.370 3.526 20 10 CHCDMO CC[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccccc1O ZINC000158113014 1128664169 /nfs/dbraw/zinc/66/41/69/1128664169.db2.gz JFECLRKVTSLRNK-MRXNPFEDSA-N 1 1 290.451 3.555 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000778995540 1128674578 /nfs/dbraw/zinc/67/45/78/1128674578.db2.gz BIVYPFZXWZREFX-HNNXBMFYSA-N 1 1 285.362 3.596 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000779015862 1128682001 /nfs/dbraw/zinc/68/20/01/1128682001.db2.gz XJAYMJYMWDASGE-ZDUSSCGKSA-N 1 1 289.325 3.660 20 10 CHCDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1cc(F)ccc1O ZINC000779022677 1128685118 /nfs/dbraw/zinc/68/51/18/1128685118.db2.gz FTTMQSNWRPCOEN-CXAGYDPISA-N 1 1 285.362 3.909 20 10 CHCDMO Clc1c[nH+]ccc1NCc1ccc(N2CCCC2)cc1 ZINC000175024417 1128713764 /nfs/dbraw/zinc/71/37/64/1128713764.db2.gz SBRXXMLRMUFCBR-UHFFFAOYSA-N 1 1 287.794 3.947 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000159859236 1128733787 /nfs/dbraw/zinc/73/37/87/1128733787.db2.gz JYCZHPPADLWWMN-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cccc(OC)c1O ZINC000179523250 1128746272 /nfs/dbraw/zinc/74/62/72/1128746272.db2.gz ZFDNJLNTHZYCPV-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO CCC(=O)C(C)(C)C[N@@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001208921460 1117966444 /nfs/dbraw/zinc/96/64/44/1117966444.db2.gz JZSDFTWSHULKJO-UHFFFAOYSA-N 1 1 290.451 3.580 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000186017600 1117968617 /nfs/dbraw/zinc/96/86/17/1117968617.db2.gz LXMQAZPRFXKISJ-SUYBPPKGSA-N 1 1 285.362 3.986 20 10 CHCDMO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccc(F)cc1O ZINC000186040835 1117974284 /nfs/dbraw/zinc/97/42/84/1117974284.db2.gz FTCDHGUPITYGAP-QWHCGFSZSA-N 1 1 289.350 3.649 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000179804584 1128760799 /nfs/dbraw/zinc/76/07/99/1128760799.db2.gz MNHXQPHBZBIBMQ-UHFFFAOYSA-N 1 1 295.382 3.696 20 10 CHCDMO C[C@@H]([NH2+]CC1(C2CC2)CCC1)c1ccc(F)cc1O ZINC000186156519 1118198306 /nfs/dbraw/zinc/19/83/06/1118198306.db2.gz XLZFLJVOZUSZHC-LLVKDONJSA-N 1 1 263.356 3.762 20 10 CHCDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000179893773 1128764287 /nfs/dbraw/zinc/76/42/87/1128764287.db2.gz KZGWAULFKDECOT-LLVKDONJSA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccc(F)cc1O ZINC000188667784 1128764558 /nfs/dbraw/zinc/76/45/58/1128764558.db2.gz XZKRVNIBKCFOLZ-SJCJKPOMSA-N 1 1 295.398 3.513 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1c(C)noc1C ZINC000186186858 1118291516 /nfs/dbraw/zinc/29/15/16/1118291516.db2.gz UWBKAWCRPHGNTB-LKFCYVNXSA-N 1 1 292.354 3.938 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000180021694 1128772416 /nfs/dbraw/zinc/77/24/16/1128772416.db2.gz LVPSTXSRHAIHQG-MAUKXSAKSA-N 1 1 297.398 3.663 20 10 CHCDMO CCc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000084199923 1118371522 /nfs/dbraw/zinc/37/15/22/1118371522.db2.gz VKHFKJZDRZWFHB-LBPRGKRZSA-N 1 1 273.351 3.945 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1cccc(OC)c1O ZINC000160479170 1118438500 /nfs/dbraw/zinc/43/85/00/1118438500.db2.gz ZKEBVHQUWINUAK-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)oc1C ZINC001204538363 1118452508 /nfs/dbraw/zinc/45/25/08/1118452508.db2.gz BJFCPAXPWILEMN-UHFFFAOYSA-N 1 1 272.392 3.594 20 10 CHCDMO CCc1cccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1O ZINC001204542811 1118476044 /nfs/dbraw/zinc/47/60/44/1118476044.db2.gz IOVUFLHBEHDGKE-HZPDHXFCSA-N 1 1 291.460 3.815 20 10 CHCDMO CCc1cccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC001204542809 1118476077 /nfs/dbraw/zinc/47/60/77/1118476077.db2.gz IOVUFLHBEHDGKE-HOTGVXAUSA-N 1 1 291.460 3.815 20 10 CHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000180250090 1128782958 /nfs/dbraw/zinc/78/29/58/1128782958.db2.gz XKEFECGUDUDGFX-UONOGXRCSA-N 1 1 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C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc(F)cc1O ZINC000252817225 1119466874 /nfs/dbraw/zinc/46/68/74/1119466874.db2.gz XTKDPJQCGFXZLM-GVXVVHGQSA-N 1 1 251.345 3.761 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000179556803 1119752031 /nfs/dbraw/zinc/75/20/31/1119752031.db2.gz MITZQWWQOQBQLL-UHFFFAOYSA-N 1 1 271.335 3.696 20 10 CHCDMO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(N2CCCCCC2)cc1 ZINC000177956594 1119890989 /nfs/dbraw/zinc/89/09/89/1119890989.db2.gz QSMPDMFPGAEKKM-HNNXBMFYSA-N 1 1 298.434 3.641 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cc3ccccc3[nH]2)c1 ZINC001116445614 1120121834 /nfs/dbraw/zinc/12/18/34/1120121834.db2.gz PDKGWXITKGBDGL-UHFFFAOYSA-N 1 1 280.371 3.814 20 10 CHCDMO CC[C@H]1CCCC[N@@H+]1Cc1ccc(OC)c(Cl)c1O ZINC001236808672 1128896881 /nfs/dbraw/zinc/89/68/81/1128896881.db2.gz IALIQJCLNQWDKP-LBPRGKRZSA-N 1 1 283.799 3.819 20 10 CHCDMO CC[C@H]1CCCC[N@H+]1Cc1ccc(OC)c(Cl)c1O ZINC001236808672 1128896885 /nfs/dbraw/zinc/89/68/85/1128896885.db2.gz IALIQJCLNQWDKP-LBPRGKRZSA-N 1 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/nfs/dbraw/zinc/94/61/08/1128946108.db2.gz AQJDXLGUQOQEFO-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO CCN(C[C@@H]1CCCC[N@H+]1C(C)C)c1ccc(OC)cc1 ZINC001167835453 1121035079 /nfs/dbraw/zinc/03/50/79/1121035079.db2.gz QQPDEMYLAHFNSK-KRWDZBQOSA-N 1 1 290.451 3.784 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001237077817 1128965125 /nfs/dbraw/zinc/96/51/25/1128965125.db2.gz KJVQZDMWFARTQD-UWVGGRQHSA-N 1 1 286.202 3.931 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000766116894 1121266720 /nfs/dbraw/zinc/26/67/20/1121266720.db2.gz JBZIPMLOAJAIIN-GFCCVEGCSA-N 1 1 287.325 3.783 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000124514019 1121303170 /nfs/dbraw/zinc/30/31/70/1121303170.db2.gz KNWOWXNPUULPSH-SNVBAGLBSA-N 1 1 293.716 3.820 20 10 CHCDMO C[N@H+](C/C=C/c1ccccc1)Cc1c(O)cccc1F ZINC001137838687 1121421230 /nfs/dbraw/zinc/42/12/30/1121421230.db2.gz HNIBNQYBDQXERW-RMKNXTFCSA-N 1 1 271.335 3.677 20 10 CHCDMO C[N@@H+](C/C=C/c1ccccc1)Cc1c(O)cccc1F ZINC001137838687 1121421231 /nfs/dbraw/zinc/42/12/31/1121421231.db2.gz HNIBNQYBDQXERW-RMKNXTFCSA-N 1 1 271.335 3.677 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H](C(C)(C)C)C2)c1O ZINC000708455664 1121465038 /nfs/dbraw/zinc/46/50/38/1121465038.db2.gz XSLWAOARBFCHHZ-AWEZNQCLSA-N 1 1 277.408 3.659 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC000727825267 1121750366 /nfs/dbraw/zinc/75/03/66/1121750366.db2.gz XMPMZAAUHCQWDE-CQSZACIVSA-N 1 1 285.387 3.928 20 10 CHCDMO CCc1ccc[nH+]c1NCc1ccc(N2CCCC2)cc1 ZINC001178267211 1121779130 /nfs/dbraw/zinc/77/91/30/1121779130.db2.gz CUXTYGZCYOYOBD-UHFFFAOYSA-N 1 1 281.403 3.856 20 10 CHCDMO Cc1csc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC001178758677 1121814051 /nfs/dbraw/zinc/81/40/51/1121814051.db2.gz DKQFLQDFCWYQAD-UHFFFAOYSA-N 1 1 285.771 3.844 20 10 CHCDMO C[C@@H](CCc1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000731842773 1121888021 /nfs/dbraw/zinc/88/80/21/1121888021.db2.gz AIDZHBKQDDNZMV-HNNXBMFYSA-N 1 1 269.388 3.845 20 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UPGFFRFPBHMXCZ-CYBMUJFWSA-N 1 1 294.389 3.653 20 10 CHCDMO COc1cccc([C@@H](C)[N@@H+](C)Cc2ccccc2O)c1 ZINC000079433193 1129033697 /nfs/dbraw/zinc/03/36/97/1129033697.db2.gz LGVCJECAYKNVIM-CYBMUJFWSA-N 1 1 271.360 3.594 20 10 CHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000271896623 1122181454 /nfs/dbraw/zinc/18/14/54/1122181454.db2.gz YGMUHIVRLBVJAI-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(F)cc1O ZINC000273527178 1122237817 /nfs/dbraw/zinc/23/78/17/1122237817.db2.gz VORDSUMCVOJNIF-GFCCVEGCSA-N 1 1 271.335 3.871 20 10 CHCDMO CCCCCC[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183919230 1122248501 /nfs/dbraw/zinc/24/85/01/1122248501.db2.gz HMCPRUNWOACNCQ-GFCCVEGCSA-N 1 1 253.361 3.980 20 10 CHCDMO CCn1c2ccc(C)cc2[nH+]c1NCc1cccc(F)c1O ZINC001184461451 1122277793 /nfs/dbraw/zinc/27/77/93/1122277793.db2.gz AGHIOXANEZMRJY-UHFFFAOYSA-N 1 1 299.349 3.821 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC=CO1 ZINC000774832730 1122319337 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CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232479 1122586691 /nfs/dbraw/zinc/58/66/91/1122586691.db2.gz IAEMVYMARYNBJA-ZBFHGGJFSA-N 1 1 260.425 3.763 20 10 CHCDMO COC1(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CCCCC1 ZINC000775562686 1122675772 /nfs/dbraw/zinc/67/57/72/1122675772.db2.gz NPPUZZZZSQELEF-NSHDSACASA-N 1 1 299.361 3.670 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(C)c1O ZINC000775636796 1122842755 /nfs/dbraw/zinc/84/27/55/1122842755.db2.gz HAALRZPBMLJBRP-UHFFFAOYSA-N 1 1 298.430 3.789 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1cc(OC)ccc1O ZINC000775643425 1122852412 /nfs/dbraw/zinc/85/24/12/1122852412.db2.gz XSKHOBPDLSFSOC-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCCc3ccccc32)c1 ZINC000775646190 1122853977 /nfs/dbraw/zinc/85/39/77/1122853977.db2.gz HQQBSSFIESPHJW-SFHVURJKSA-N 1 1 297.398 3.910 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC2(C1)CCOCC2 ZINC000266444520 1129086073 /nfs/dbraw/zinc/08/60/73/1129086073.db2.gz MQLUHUIZHOFQGL-UHFFFAOYSA-N 1 1 297.398 3.548 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1O ZINC000775698992 1122912178 /nfs/dbraw/zinc/91/21/78/1122912178.db2.gz WXYBTZICQABJNJ-INIZCTEOSA-N 1 1 299.389 3.904 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)CCCOC(C)C)c1O ZINC000775708216 1122916095 /nfs/dbraw/zinc/91/60/95/1122916095.db2.gz AJTGBUPADDMQPU-UHFFFAOYSA-N 1 1 285.815 3.601 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000775723021 1122924504 /nfs/dbraw/zinc/92/45/04/1122924504.db2.gz BNKFRYHACYFYLN-RDTXWAMCSA-N 1 1 297.398 3.779 20 10 CHCDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775724828 1122926186 /nfs/dbraw/zinc/92/61/86/1122926186.db2.gz RDAOTVLLRSWCQW-ZDUSSCGKSA-N 1 1 285.840 3.681 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1O ZINC000775737449 1122928576 /nfs/dbraw/zinc/92/85/76/1122928576.db2.gz HGFXAOBDWUZTNV-HNNXBMFYSA-N 1 1 297.826 3.601 20 10 CHCDMO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccc(N(C)C)cc1 ZINC000775830483 1122985246 /nfs/dbraw/zinc/98/52/46/1122985246.db2.gz KAONJBUKQIHSOM-UVIKPUKZSA-N 1 1 273.207 3.722 20 10 CHCDMO COc1cc(C)cc(CNc2cccc(C3CC3)[nH+]2)c1O ZINC000894857360 1122991373 /nfs/dbraw/zinc/99/13/73/1122991373.db2.gz GHXLCCSSFOKVKR-UHFFFAOYSA-N 1 1 284.359 3.594 20 10 CHCDMO C[C@@H](CO)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000776002600 1123034662 /nfs/dbraw/zinc/03/46/62/1123034662.db2.gz GGWQZZKIGGHXHD-CVEARBPZSA-N 1 1 299.414 3.584 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCn3cccc3[C@H]2C)cc1 ZINC001203942460 1123041644 /nfs/dbraw/zinc/04/16/44/1123041644.db2.gz RFKUMPNIGOWQMR-MRXNPFEDSA-N 1 1 297.446 3.911 20 10 CHCDMO CC[C@H](C)C[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001201511337 1123113838 /nfs/dbraw/zinc/11/38/38/1123113838.db2.gz JIELUBMRVDDWHH-ZDUSSCGKSA-N 1 1 286.419 3.591 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846108293 1123146729 /nfs/dbraw/zinc/14/67/29/1123146729.db2.gz OHZLJXOEWGRYEP-CYBMUJFWSA-N 1 1 287.737 3.667 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccc(F)cc1O ZINC000696623619 1123245796 /nfs/dbraw/zinc/24/57/96/1123245796.db2.gz ZETZANKPUFEINF-SECBINFHSA-N 1 1 275.314 3.863 20 10 CHCDMO CC[C@H](COCC1CC1)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000850494987 1123274816 /nfs/dbraw/zinc/27/48/16/1123274816.db2.gz UTTOFTYDXRJESL-ZBFHGGJFSA-N 1 1 295.398 3.777 20 10 CHCDMO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000850501205 1123275437 /nfs/dbraw/zinc/27/54/37/1123275437.db2.gz KTZOFTOREKMQDA-GFCCVEGCSA-N 1 1 297.414 3.759 20 10 CHCDMO CC(C)C[N@@H+](Cc1cc2c(cc1O)OCO2)C1CCCC1 ZINC000110362239 1123395263 /nfs/dbraw/zinc/39/52/63/1123395263.db2.gz VCTXTUDMHLSPNL-UHFFFAOYSA-N 1 1 291.391 3.522 20 10 CHCDMO CC(C)c1nc(C[N@H+](C)Cc2ccccc2O)cs1 ZINC000111235436 1123432442 /nfs/dbraw/zinc/43/24/42/1123432442.db2.gz NFRCGQONZJEQAJ-UHFFFAOYSA-N 1 1 276.405 3.604 20 10 CHCDMO CC[C@H]1COCC[N@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000738084048 1123518203 /nfs/dbraw/zinc/51/82/03/1123518203.db2.gz JTGDMTKJTTWKLK-HNNXBMFYSA-N 1 1 291.435 3.609 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000194155225 1129130861 /nfs/dbraw/zinc/13/08/61/1129130861.db2.gz WFMYSGLJMLICFC-CYBMUJFWSA-N 1 1 286.341 3.527 20 10 CHCDMO C/C=C/C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000858536948 1123660854 /nfs/dbraw/zinc/66/08/54/1123660854.db2.gz LGSJCHDQVJEBDS-NWALNABHSA-N 1 1 259.271 3.638 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3c(C)cc(C)cc3C2)c1O ZINC000777220427 1123785574 /nfs/dbraw/zinc/78/55/74/1123785574.db2.gz QYQPDLCBCVOKOJ-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1C ZINC000862540819 1123817806 /nfs/dbraw/zinc/81/78/06/1123817806.db2.gz KOJWCEPTDBEEHW-MRXNPFEDSA-N 1 1 297.398 3.704 20 10 CHCDMO Cc1cc[nH+]c(NCc2ccc(N3CCSCC3)cc2)c1 ZINC000301630041 1123919360 /nfs/dbraw/zinc/91/93/60/1123919360.db2.gz IJECXGGIVRKBAJ-UHFFFAOYSA-N 1 1 299.443 3.555 20 10 CHCDMO CCc1cnc(C[N@H+](C)Cc2cccc(CC)c2O)s1 ZINC000848888716 1123921324 /nfs/dbraw/zinc/92/13/24/1123921324.db2.gz AYTYDPJESVSGMY-UHFFFAOYSA-N 1 1 290.432 3.606 20 10 CHCDMO CCc1cnc(C[N@@H+](C)Cc2cccc(CC)c2O)s1 ZINC000848888716 1123921326 /nfs/dbraw/zinc/92/13/26/1123921326.db2.gz AYTYDPJESVSGMY-UHFFFAOYSA-N 1 1 290.432 3.606 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000794654507 1123925030 /nfs/dbraw/zinc/92/50/30/1123925030.db2.gz CSDUHSSWUPNHKO-WCQYABFASA-N 1 1 287.325 3.782 20 10 CHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1c(O)cccc1Cl ZINC000763646852 1129156184 /nfs/dbraw/zinc/15/61/84/1129156184.db2.gz KVQUSRQEDAUHMV-NSHDSACASA-N 1 1 265.784 3.810 20 10 CHCDMO CCCc1ncc(C[NH2+]Cc2c(O)cc(C)cc2Cl)o1 ZINC000840950325 1124036441 /nfs/dbraw/zinc/03/64/41/1124036441.db2.gz JCZKIROTDQYSOR-UHFFFAOYSA-N 1 1 294.782 3.584 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(F)cc1O ZINC000866405183 1124063569 /nfs/dbraw/zinc/06/35/69/1124063569.db2.gz YODSXFDJFHWYIH-RISCZKNCSA-N 1 1 283.412 3.715 20 10 CHCDMO CC[N@@H+](Cc1ccc(N)cc1)[C@@H](C)c1ccc(F)cc1 ZINC001120370775 1131274325 /nfs/dbraw/zinc/27/43/25/1131274325.db2.gz DYGCXEDXHSADSW-ZDUSSCGKSA-N 1 1 272.367 3.991 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1[O-])C1CC[NH2+]CC1 ZINC000873268622 1124757695 /nfs/dbraw/zinc/75/76/95/1124757695.db2.gz FXOCVWWSDDCGIQ-KGLIPLIRSA-N 1 1 298.430 3.584 20 10 CHCDMO Cc1cccc(O)c1C[N@H+](C)C1CCC(F)(F)CC1 ZINC000877533647 1125041232 /nfs/dbraw/zinc/04/12/32/1125041232.db2.gz UUVIHAUGHCDXRI-UHFFFAOYSA-N 1 1 269.335 3.710 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000877547074 1125042408 /nfs/dbraw/zinc/04/24/08/1125042408.db2.gz WLLAHJZTQNJWPJ-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)C1CC(OCc2ccccc2)C1 ZINC000821391554 1131327554 /nfs/dbraw/zinc/32/75/54/1131327554.db2.gz OBZWJBNAPPFLDA-UHFFFAOYSA-N 1 1 297.398 3.572 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(OC(F)F)cc1)C2 ZINC000877704006 1125066143 /nfs/dbraw/zinc/06/61/43/1125066143.db2.gz VYXLZRHKILSRNT-UHFFFAOYSA-N 1 1 291.297 3.509 20 10 CHCDMO COc1cccc(C[N@@H+](CC(C)C)C2CCCC2)c1O ZINC000211538888 1125308435 /nfs/dbraw/zinc/30/84/35/1125308435.db2.gz MIXFFJXPIWLWTA-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000882881355 1125360123 /nfs/dbraw/zinc/36/01/23/1125360123.db2.gz JMXPVFLLOAGPAZ-CQSZACIVSA-N 1 1 295.354 3.973 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000882881667 1125360142 /nfs/dbraw/zinc/36/01/42/1125360142.db2.gz YEAOBOOTCHWDTN-MRXNPFEDSA-N 1 1 289.325 3.911 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882905703 1125361032 /nfs/dbraw/zinc/36/10/32/1125361032.db2.gz QBKVTDTYPUMWQW-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)o1 ZINC000882903819 1125361498 /nfs/dbraw/zinc/36/14/98/1125361498.db2.gz KKZLPNCKDXWDNS-RNCFNFMXSA-N 1 1 293.313 3.677 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]CC[C@@H]1CCCC1(F)F ZINC000883264506 1125388018 /nfs/dbraw/zinc/38/80/18/1125388018.db2.gz CMNYVWRMXQSDGS-JTQLQIEISA-N 1 1 291.288 3.586 20 10 CHCDMO C[C@H]([NH2+]C1CCC2(COC2)CC1)c1ccc(Cl)cc1O ZINC000883383240 1125407540 /nfs/dbraw/zinc/40/75/40/1125407540.db2.gz VYGPMJRRZICZOL-NSHDSACASA-N 1 1 295.810 3.655 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000131805139 1125410330 /nfs/dbraw/zinc/41/03/30/1125410330.db2.gz BOROYMXAMWCWCW-PHIMTYICSA-N 1 1 253.773 3.524 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCc3ccsc3C1)CCC2 ZINC000132604244 1125419669 /nfs/dbraw/zinc/41/96/69/1125419669.db2.gz XQFMBEQOLHALGP-UHFFFAOYSA-N 1 1 285.412 3.501 20 10 CHCDMO COc1cccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1O ZINC000245713028 1129221180 /nfs/dbraw/zinc/22/11/80/1129221180.db2.gz GHZOTOPTAGAWBR-VNHYZAJKSA-N 1 1 275.392 3.554 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc2O1 ZINC000795428725 1129274181 /nfs/dbraw/zinc/27/41/81/1129274181.db2.gz BAEXMVXAMQLEQK-OAHLLOKOSA-N 1 1 296.414 3.536 20 10 CHCDMO COC1CCC([N@@H+](C)Cc2c(O)ccc3ccccc32)CC1 ZINC000734475706 1129310227 /nfs/dbraw/zinc/31/02/27/1129310227.db2.gz YCZDRWYYSUEKAV-UHFFFAOYSA-N 1 1 299.414 3.935 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCCOC(C)(C)C2)cc1C(C)C ZINC000735298399 1129339112 /nfs/dbraw/zinc/33/91/12/1129339112.db2.gz RLWUFZCWQDEBPK-UHFFFAOYSA-N 1 1 291.435 3.825 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccon2)c(O)c(C(C)(C)C)c1 ZINC000739885171 1129408285 /nfs/dbraw/zinc/40/82/85/1129408285.db2.gz ODUAPCJFPVTSHV-UHFFFAOYSA-N 1 1 288.391 3.618 20 10 CHCDMO Cc1cc(C[N@@H+](C)Cc2ccon2)c(O)c(C(C)(C)C)c1 ZINC000739885171 1129408287 /nfs/dbraw/zinc/40/82/87/1129408287.db2.gz ODUAPCJFPVTSHV-UHFFFAOYSA-N 1 1 288.391 3.618 20 10 CHCDMO CCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000093319228 1129421002 /nfs/dbraw/zinc/42/10/02/1129421002.db2.gz XTLYRPRJEGGMHV-UHFFFAOYSA-N 1 1 299.418 3.553 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](CCO)c2ccccc2)cc1C ZINC000093442494 1129424031 /nfs/dbraw/zinc/42/40/31/1129424031.db2.gz PQIHTQRLYRWRTI-SFHVURJKSA-N 1 1 299.414 3.565 20 10 CHCDMO COc1cccc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1O ZINC000093689636 1129426645 /nfs/dbraw/zinc/42/66/45/1129426645.db2.gz SEURTYUTNDHCMB-WMLDXEAASA-N 1 1 297.398 3.779 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)C2(C)CCCC2)c1O ZINC000720387844 1129526927 /nfs/dbraw/zinc/52/69/27/1129526927.db2.gz PRVNINWBWVQRTR-UHFFFAOYSA-N 1 1 283.799 3.819 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccncc1 ZINC000743870146 1129541678 /nfs/dbraw/zinc/54/16/78/1129541678.db2.gz IUHSQPSOZKLXJY-AWEZNQCLSA-N 1 1 270.376 3.760 20 10 CHCDMO CC[NH+](CC)c1ccc(Nc2cccc(O)c2O)cc1 ZINC001212969886 1129642244 /nfs/dbraw/zinc/64/22/44/1129642244.db2.gz HEADENPQDHXHAQ-UHFFFAOYSA-N 1 1 272.348 3.688 20 10 CHCDMO CCC[N@H+](CC)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000766402857 1129662772 /nfs/dbraw/zinc/66/27/72/1129662772.db2.gz YSXFBJMOHQMIRI-INIZCTEOSA-N 1 1 291.483 3.525 20 10 CHCDMO CCC[N@@H+](CC)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000766402857 1129662773 /nfs/dbraw/zinc/66/27/73/1129662773.db2.gz YSXFBJMOHQMIRI-INIZCTEOSA-N 1 1 291.483 3.525 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCCC(C)(C)C2)cc1 ZINC001169300989 1129717464 /nfs/dbraw/zinc/71/74/64/1129717464.db2.gz QOCLVUYLORZGQO-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@@H]2CC)c1 ZINC000768137500 1129835291 /nfs/dbraw/zinc/83/52/91/1129835291.db2.gz DIAAGRAIYDZEGR-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccccc2Cl)c1 ZINC000768170730 1129839303 /nfs/dbraw/zinc/83/93/03/1129839303.db2.gz VDNGEABLJNYHAJ-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000768192864 1129843035 /nfs/dbraw/zinc/84/30/35/1129843035.db2.gz GBYFGFWHZLNCDH-QGZVFWFLSA-N 1 1 297.398 3.910 20 10 CHCDMO Cc1c[nH+]c(NCc2ccc(O)c(O)c2)c2ccccc12 ZINC001169990203 1129847508 /nfs/dbraw/zinc/84/75/08/1129847508.db2.gz BWSSNCDUVQSNNK-UHFFFAOYSA-N 1 1 280.327 3.567 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c(O)c1 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VTRQQIRJRWMGJO-SOFGYWHQSA-N 1 1 295.430 3.601 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](c3ccncc3)C2)cc1 ZINC000846907815 1131760753 /nfs/dbraw/zinc/76/07/53/1131760753.db2.gz KDUBEDJCWIGEEE-GOSISDBHSA-N 1 1 295.430 3.527 20 10 CHCDMO CC1(C)C[N@@H+](Cc2c([O-])cc(F)cc2F)CCC1(F)F ZINC001140582082 1131808063 /nfs/dbraw/zinc/80/80/63/1131808063.db2.gz BWNFSUWQNABAMG-UHFFFAOYSA-N 1 1 291.288 3.538 20 10 CHCDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2c([O-])cc(F)cc2F)CC1 ZINC001140585211 1131810091 /nfs/dbraw/zinc/81/00/91/1131810091.db2.gz ZNJBTZUBMAZNBX-UMSPYCQHSA-N 1 1 269.335 3.681 20 10 CHCDMO CC[N@@H+](Cc1cccc(F)c1)Cc1cc(C)ccc1O ZINC001140623568 1131833354 /nfs/dbraw/zinc/83/33/54/1131833354.db2.gz VVHSGDYAEOMRQN-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC001140749130 1131906305 /nfs/dbraw/zinc/90/63/05/1131906305.db2.gz QUCDOJHEZKCANS-DZGCQCFKSA-N 1 1 275.392 3.561 20 10 CHCDMO Cc1cc(F)ccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001140780615 1131913934 /nfs/dbraw/zinc/91/39/34/1131913934.db2.gz FZROOVPNBZFKJB-UHFFFAOYSA-N 1 1 286.394 3.832 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H](F)C2)c(O)c1 ZINC001140851015 1131948022 /nfs/dbraw/zinc/94/80/22/1131948022.db2.gz YJONHSMRHSFGAJ-OAHLLOKOSA-N 1 1 294.414 3.562 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2C)c(O)c1 ZINC001140856345 1131948509 /nfs/dbraw/zinc/94/85/09/1131948509.db2.gz YNPDZGGLYAEWFX-HUUCEWRRSA-N 1 1 290.451 3.859 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1ccc(N(CC)CC)cc1O ZINC001140855707 1131948623 /nfs/dbraw/zinc/94/86/23/1131948623.db2.gz JEWSCPOYIYUNQX-UHFFFAOYSA-N 1 1 278.440 3.859 20 10 CHCDMO Cc1ccc(NCc2cc3ccccc3cc2O)[nH+]c1 ZINC001171399512 1131966604 /nfs/dbraw/zinc/96/66/04/1131966604.db2.gz ISOHFEASGBSZJC-UHFFFAOYSA-N 1 1 264.328 3.861 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(O)c1 ZINC001140948056 1131969120 /nfs/dbraw/zinc/96/91/20/1131969120.db2.gz RBIUYRBEBWMLBV-AWEZNQCLSA-N 1 1 267.372 3.820 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c1 ZINC001141161186 1132031723 /nfs/dbraw/zinc/03/17/23/1132031723.db2.gz OFSAMVQHNUQFGZ-INIZCTEOSA-N 1 1 297.398 3.868 20 10 CHCDMO Cc1cccc2c1CC[C@@H]([N@H+]1CCc3cccc(O)c3C1)C2 ZINC001171572194 1132058611 /nfs/dbraw/zinc/05/86/11/1132058611.db2.gz ABTMTTNVWGLVKX-QGZVFWFLSA-N 1 1 293.410 3.616 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1C[C@@H](OC)C12CCC2)c1ccc(F)cc1O ZINC000840807214 1132288934 /nfs/dbraw/zinc/28/89/34/1132288934.db2.gz RGLDLWDNWVKPOD-NUEKZKHPSA-N 1 1 293.382 3.530 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)[C@@](C)(OC)C1CC1)c1ccc(F)cc1O ZINC000840858658 1132295644 /nfs/dbraw/zinc/29/56/44/1132295644.db2.gz FURVOAHOPLMRLP-XNJJOIOASA-N 1 1 295.398 3.776 20 10 CHCDMO CSc1ccc(C[N@H+]2CCc3cccc(O)c3C2)s1 ZINC001142029095 1132302751 /nfs/dbraw/zinc/30/27/51/1132302751.db2.gz KEKAINFJPSPHEU-UHFFFAOYSA-N 1 1 291.441 3.734 20 10 CHCDMO CCc1cnc(C[NH2+]Cc2c(O)cc(C)cc2Cl)s1 ZINC000840903437 1132308916 /nfs/dbraw/zinc/30/89/16/1132308916.db2.gz COVUXJJGZRGZNT-UHFFFAOYSA-N 1 1 296.823 3.663 20 10 CHCDMO CCOC[C@H]1CCC[N@@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840914759 1132308978 /nfs/dbraw/zinc/30/89/78/1132308978.db2.gz FUWBTAULMUBLRO-ZDUSSCGKSA-N 1 1 297.826 3.603 20 10 CHCDMO CCc1ccc(C[N@H+]2CCc3cccc(O)c3C2)s1 ZINC001231502376 1132309144 /nfs/dbraw/zinc/30/91/44/1132309144.db2.gz BQBMMVIFAVFEJB-UHFFFAOYSA-N 1 1 273.401 3.574 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000840918021 1132309855 /nfs/dbraw/zinc/30/98/55/1132309855.db2.gz OCFGHIMLGNYIPY-INIZCTEOSA-N 1 1 284.403 3.644 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000840918458 1132310450 /nfs/dbraw/zinc/31/04/50/1132310450.db2.gz UDFFULFFMQBHEE-HNNXBMFYSA-N 1 1 298.430 3.960 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000840918022 1132310594 /nfs/dbraw/zinc/31/05/94/1132310594.db2.gz OCFGHIMLGNYIPY-MRXNPFEDSA-N 1 1 284.403 3.644 20 10 CHCDMO C[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)CC(F)(F)F ZINC000840963238 1132314048 /nfs/dbraw/zinc/31/40/48/1132314048.db2.gz JHSODNULRUEUBE-SSDOTTSWSA-N 1 1 299.695 3.863 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](F)CC1 ZINC001231588817 1132317323 /nfs/dbraw/zinc/31/73/23/1132317323.db2.gz VLEDFCGDWCZFRD-AWEZNQCLSA-N 1 1 273.351 3.869 20 10 CHCDMO C[C@]1(F)CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC001231587627 1132319329 /nfs/dbraw/zinc/31/93/29/1132319329.db2.gz WSISTPCOUCEPBE-IRXDYDNUSA-N 1 1 291.341 3.817 20 10 CHCDMO CC[N@@H+](Cc1cccc(F)c1)Cc1cccc(C)c1O ZINC001231594185 1132321312 /nfs/dbraw/zinc/32/13/12/1132321312.db2.gz VSZZDBXLHGQLQF-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO Cc1ccc2c(c1)C[C@H]([N@H+]1CCc3cccc(O)c3C1)CC2 ZINC001172844361 1132335854 /nfs/dbraw/zinc/33/58/54/1132335854.db2.gz RPEZLCJMYFTFSZ-GOSISDBHSA-N 1 1 293.410 3.616 20 10 CHCDMO COc1cccc2c1C[N@@H+](Cc1c(C)cc(C)cc1O)CC2 ZINC001231842500 1132376108 /nfs/dbraw/zinc/37/61/08/1132376108.db2.gz NNTDCGCKQVMPDZ-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO Cc1cc(C)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001231842580 1132376903 /nfs/dbraw/zinc/37/69/03/1132376903.db2.gz OTSGATUJFREGPB-GASCZTMLSA-N 1 1 259.393 3.631 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001231845930 1132379520 /nfs/dbraw/zinc/37/95/20/1132379520.db2.gz VGLBWQNPNNKPJR-GFCCVEGCSA-N 1 1 287.325 3.783 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@H+]1CCC12CCCCC2 ZINC001231852266 1132379569 /nfs/dbraw/zinc/37/95/69/1132379569.db2.gz STCFDHLNVSZEBY-UHFFFAOYSA-N 1 1 288.435 3.670 20 10 CHCDMO CCC[N@H+](Cc1ccc(N(C)C)cc1OC)CC(C)C ZINC001231854314 1132379629 /nfs/dbraw/zinc/37/96/29/1132379629.db2.gz CKXQJHQUZYTOSN-UHFFFAOYSA-N 1 1 278.440 3.629 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccccc1O)c1ccc(Cl)cc1O ZINC000841747006 1132388889 /nfs/dbraw/zinc/38/88/89/1132388889.db2.gz MQMXHECMDRMSRY-LLVKDONJSA-N 1 1 291.778 3.645 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(Cl)cc1O ZINC000841747551 1132389227 /nfs/dbraw/zinc/38/92/27/1132389227.db2.gz CLCOWCLOJCMSSL-CMPLNLGQSA-N 1 1 283.799 3.654 20 10 CHCDMO Oc1c(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)ccc2ccccc21 ZINC001231879359 1132389343 /nfs/dbraw/zinc/38/93/43/1132389343.db2.gz CLTHLDPGQOKVGS-HIFRSBDPSA-N 1 1 289.325 3.632 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)ccc2ccccc21 ZINC001231879346 1132390312 /nfs/dbraw/zinc/39/03/12/1132390312.db2.gz CGPTXAFTCKNZNF-CRAIPNDOSA-N 1 1 297.398 3.546 20 10 CHCDMO Oc1c(C[N@@H+](CC2CC2)C2CC2)ccc2ccccc21 ZINC001231883328 1132391464 /nfs/dbraw/zinc/39/14/64/1132391464.db2.gz OJDKDTYDOUDZEX-UHFFFAOYSA-N 1 1 267.372 3.920 20 10 CHCDMO C[C@H]([NH2+]CC1(CCO)CCCC1)c1ccc(Cl)cc1O ZINC000841756638 1132392034 /nfs/dbraw/zinc/39/20/34/1132392034.db2.gz ZFZZXTPLEXWNRE-LBPRGKRZSA-N 1 1 297.826 3.639 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H]1C)c1ccc(Cl)cc1O ZINC000841755612 1132392181 /nfs/dbraw/zinc/39/21/81/1132392181.db2.gz KHOGTDDHPJLKAL-WRWGMCAJSA-N 1 1 283.799 3.510 20 10 CHCDMO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(Cl)cc2O)C1 ZINC000841756611 1132392824 /nfs/dbraw/zinc/39/28/24/1132392824.db2.gz YTJNTHIUQNNHNN-YUSALJHKSA-N 1 1 285.840 3.980 20 10 CHCDMO CC[C@H](CSC)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841752270 1132392978 /nfs/dbraw/zinc/39/29/78/1132392978.db2.gz RZECZPFSEPMZTK-MWLCHTKSSA-N 1 1 273.829 3.838 20 10 CHCDMO C[C@H](C[C@@H]1CCOC1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841760717 1132393303 /nfs/dbraw/zinc/39/33/03/1132393303.db2.gz UJVPJNKERJKOPP-UTUOFQBUSA-N 1 1 283.799 3.511 20 10 CHCDMO C[N@@H+](Cc1ccnc(C(C)(C)C)c1)Cc1ccccc1O ZINC001232220186 1132438909 /nfs/dbraw/zinc/43/89/09/1132438909.db2.gz GJJLCTYUSPFXFB-UHFFFAOYSA-N 1 1 284.403 3.717 20 10 CHCDMO CC[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC001173297192 1132445330 /nfs/dbraw/zinc/44/53/30/1132445330.db2.gz XJWFQEVVYIGLPU-WMLDXEAASA-N 1 1 260.425 3.763 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C)[C@H]2C)cc1Cl ZINC001232264949 1132446614 /nfs/dbraw/zinc/44/66/14/1132446614.db2.gz PDNGOFVVJKSUEY-WDEREUQCSA-N 1 1 283.799 3.675 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1ccc(Cl)cc1O ZINC000842930026 1132478019 /nfs/dbraw/zinc/47/80/19/1132478019.db2.gz RONWXWMBIGYYSU-SBMIAAHKSA-N 1 1 271.813 3.590 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCS[C@H]1C)c1ccc(Cl)cc1O ZINC000842930022 1132477812 /nfs/dbraw/zinc/47/78/12/1132477812.db2.gz RONWXWMBIGYYSU-AUTRQRHGSA-N 1 1 271.813 3.590 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)[C@@H](C)C1 ZINC001143117059 1132504136 /nfs/dbraw/zinc/50/41/36/1132504136.db2.gz RAPMIYMVUNJDBL-ZFWWWQNUSA-N 1 1 291.435 3.689 20 10 CHCDMO CC(C)(C)c1cccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1O ZINC001143111867 1132504315 /nfs/dbraw/zinc/50/43/15/1132504315.db2.gz GXRORHQPTBKBJF-GASCZTMLSA-N 1 1 273.420 3.778 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001143159345 1132510676 /nfs/dbraw/zinc/51/06/76/1132510676.db2.gz ATOBZKMTKMOHRZ-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cccc3ncsc31)CC2 ZINC001232735726 1132512886 /nfs/dbraw/zinc/51/28/86/1132512886.db2.gz AKBJRXRUWZZOPP-UHFFFAOYSA-N 1 1 296.395 3.560 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC001232840210 1132528878 /nfs/dbraw/zinc/52/88/78/1132528878.db2.gz PKJVCDMMVOAQMA-UHFFFAOYSA-N 1 1 296.414 3.623 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC3(C2)CCCCC3)c(O)c1 ZINC001232841578 1132529243 /nfs/dbraw/zinc/52/92/43/1132529243.db2.gz KLSDEJYAYMZAJE-UHFFFAOYSA-N 1 1 288.435 3.614 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC000843416458 1132531060 /nfs/dbraw/zinc/53/10/60/1132531060.db2.gz SDLJIBDLYLDQRF-BBRMVZONSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H]3CCC[C@H]3C2)c1O ZINC001233288002 1132597088 /nfs/dbraw/zinc/59/70/88/1132597088.db2.gz RARWCJXRHNXHJH-NEPJUHHUSA-N 1 1 295.810 3.676 20 10 CHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1c(O)cccc1Cl ZINC000133716298 1132602907 /nfs/dbraw/zinc/60/29/07/1132602907.db2.gz KBABVAXFGHJEAR-WDEREUQCSA-N 1 1 253.773 3.666 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001233332249 1132603112 /nfs/dbraw/zinc/60/31/12/1132603112.db2.gz FCHKYGZZVGWHNM-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC001233332249 1132603115 /nfs/dbraw/zinc/60/31/15/1132603115.db2.gz FCHKYGZZVGWHNM-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO C[N@H+](CCCc1ccccc1)Cc1c(O)ccc(F)c1F ZINC001233334396 1132604266 /nfs/dbraw/zinc/60/42/66/1132604266.db2.gz FCEGDRYQNSCFTI-UHFFFAOYSA-N 1 1 291.341 3.735 20 10 CHCDMO C[N@@H+](CCCc1ccccc1)Cc1c(O)ccc(F)c1F ZINC001233334396 1132604268 /nfs/dbraw/zinc/60/42/68/1132604268.db2.gz FCEGDRYQNSCFTI-UHFFFAOYSA-N 1 1 291.341 3.735 20 10 CHCDMO CC[N@H+](Cc1c(O)ccc(F)c1F)C1CCCCC1 ZINC001233331632 1132604434 /nfs/dbraw/zinc/60/44/34/1132604434.db2.gz DUDPPQJHWQJPMK-UHFFFAOYSA-N 1 1 269.335 3.825 20 10 CHCDMO CC[N@@H+](Cc1c(O)ccc(F)c1F)C1CCCCC1 ZINC001233331632 1132604437 /nfs/dbraw/zinc/60/44/37/1132604437.db2.gz DUDPPQJHWQJPMK-UHFFFAOYSA-N 1 1 269.335 3.825 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001233332641 1132605107 /nfs/dbraw/zinc/60/51/07/1132605107.db2.gz SAZMKZMQWGHPHZ-UHFFFAOYSA-N 1 1 281.346 3.827 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001233332641 1132605113 /nfs/dbraw/zinc/60/51/13/1132605113.db2.gz SAZMKZMQWGHPHZ-UHFFFAOYSA-N 1 1 281.346 3.827 20 10 CHCDMO Oc1c(C[NH+]2CCCCCC2)cccc1C(F)(F)F ZINC001233416143 1132618397 /nfs/dbraw/zinc/61/83/97/1132618397.db2.gz XTHZBOKJWFTRTL-UHFFFAOYSA-N 1 1 273.298 3.787 20 10 CHCDMO CCCC[N@@H+](CC)Cc1cccc(OC(F)(F)F)c1O ZINC001233727127 1132671619 /nfs/dbraw/zinc/67/16/19/1132671619.db2.gz IZCVYTIXLGHZND-UHFFFAOYSA-N 1 1 291.313 3.913 20 10 CHCDMO COc1cc(NCc2cccc(C)c2O)[nH+]c2ccccc21 ZINC001160770161 1132980998 /nfs/dbraw/zinc/98/09/98/1132980998.db2.gz SFAZKLPSBNNIKW-UHFFFAOYSA-N 1 1 294.354 3.870 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCc3ccc(C)cc3C2)c1O ZINC001203602216 1133344429 /nfs/dbraw/zinc/34/44/29/1133344429.db2.gz JISHOTHXNTVRLN-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC001203651383 1133347651 /nfs/dbraw/zinc/34/76/51/1133347651.db2.gz NCDUBLWAZGLSCS-UHFFFAOYSA-N 1 1 289.753 3.913 20 10 CHCDMO Oc1ccc(Br)cc1C[N@@H+](CC1CC1)C1CC1 ZINC001203650253 1133347863 /nfs/dbraw/zinc/34/78/63/1133347863.db2.gz OZGHOAUXLMFPTF-UHFFFAOYSA-N 1 1 296.208 3.529 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccccc2)C2CCC2)c1 ZINC001203680695 1133352980 /nfs/dbraw/zinc/35/29/80/1133352980.db2.gz BXWSJXBUAQAZQH-UHFFFAOYSA-N 1 1 297.398 3.956 20 10 CHCDMO COc1ccc(C[N@H+]2CCc3cccc(O)c3C2)c(C)c1C ZINC001203723055 1133359005 /nfs/dbraw/zinc/35/90/05/1133359005.db2.gz CUZQYIWGLKLATG-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203880455 1133378169 /nfs/dbraw/zinc/37/81/69/1133378169.db2.gz SFDQIJLSKGNLPI-MRXNPFEDSA-N 1 1 283.371 3.607 20 10 CHCDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879959 1133378359 /nfs/dbraw/zinc/37/83/59/1133378359.db2.gz KWGJXACMQVVZFX-NSHDSACASA-N 1 1 291.778 3.944 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)s1)Cc1ccccc1O ZINC001204033593 1133401659 /nfs/dbraw/zinc/40/16/59/1133401659.db2.gz JDGVJMUTCABVSN-UHFFFAOYSA-N 1 1 261.390 3.784 20 10 CHCDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001204164131 1133411606 /nfs/dbraw/zinc/41/16/06/1133411606.db2.gz YNCPEHMOBPNXPL-MNOVXSKESA-N 1 1 253.773 3.666 20 10 CHCDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204273039 1133427266 /nfs/dbraw/zinc/42/72/66/1133427266.db2.gz JWYFCNSLAKCZAL-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204281616 1133428402 /nfs/dbraw/zinc/42/84/02/1133428402.db2.gz XGFULBUOECYOGY-MRXNPFEDSA-N 1 1 271.360 3.681 20 10 CHCDMO CC[N@@H+](Cc1cn(C)c2ccccc12)Cc1ccccc1O ZINC001204318826 1133436916 /nfs/dbraw/zinc/43/69/16/1133436916.db2.gz CPCANHJWFCIALH-UHFFFAOYSA-N 1 1 294.398 3.906 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c(O)c1 ZINC001204960502 1133508437 /nfs/dbraw/zinc/50/84/37/1133508437.db2.gz BKWKRMORVLXZSM-INIZCTEOSA-N 1 1 297.398 3.602 20 10 CHCDMO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(F)c1O ZINC001205254344 1133550389 /nfs/dbraw/zinc/55/03/89/1133550389.db2.gz ZGJORNOSLBMNMM-INIZCTEOSA-N 1 1 285.362 3.868 20 10 CHCDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cccc(F)c1O ZINC001205254344 1133550394 /nfs/dbraw/zinc/55/03/94/1133550394.db2.gz ZGJORNOSLBMNMM-INIZCTEOSA-N 1 1 285.362 3.868 20 10 CHCDMO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2O)C[C@@H]1C ZINC001205320636 1133559941 /nfs/dbraw/zinc/55/99/41/1133559941.db2.gz LPXRYPJTQWSZQQ-SUNKGSAMSA-N 1 1 267.800 3.960 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC(C)=C(C)C1 ZINC001205560511 1133588546 /nfs/dbraw/zinc/58/85/46/1133588546.db2.gz BMZNEKGJKCBALS-UHFFFAOYSA-N 1 1 258.409 3.603 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CC2(C)C)c1O ZINC001206809788 1133751422 /nfs/dbraw/zinc/75/14/22/1133751422.db2.gz MFAJTXYPYVOGEI-LLVKDONJSA-N 1 1 283.799 3.532 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207131871 1133770393 /nfs/dbraw/zinc/77/03/93/1133770393.db2.gz MTZCZNSNRMSEDT-UHFFFAOYSA-N 1 1 289.325 3.888 20 10 CHCDMO C[C@H](CC[NH2+]Cc1c(O)cccc1F)c1ccccc1 ZINC001207621271 1133832370 /nfs/dbraw/zinc/83/23/70/1133832370.db2.gz CQOGCWBSZDZFMT-CYBMUJFWSA-N 1 1 273.351 3.815 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207626754 1133832829 /nfs/dbraw/zinc/83/28/29/1133832829.db2.gz KZSPEFAPBJYXPB-OTWHNJEPSA-N 1 1 296.458 3.931 20 10 CHCDMO CC[N@@H+](CCc1cccc(F)c1)Cc1ccccc1O ZINC001208198532 1133905695 /nfs/dbraw/zinc/90/56/95/1133905695.db2.gz JXUMFPGUUYSPSA-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+](C)C(C)C)cc1 ZINC001209519452 1134034835 /nfs/dbraw/zinc/03/48/35/1134034835.db2.gz VAWPUHWXDOXUTB-UHFFFAOYSA-N 1 1 256.393 3.934 20 10 CHCDMO COC[C@H]1CC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209516137 1134033391 /nfs/dbraw/zinc/03/33/91/1134033391.db2.gz ARMINCKOYMCUHP-SFHVURJKSA-N 1 1 298.430 3.562 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000301398928 1134472022 /nfs/dbraw/zinc/47/20/22/1134472022.db2.gz LLTIYZWCTJQVSR-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](CC(C)C)C2)c1O ZINC000307778486 1134947383 /nfs/dbraw/zinc/94/73/83/1134947383.db2.gz RDQGNVFRJIZQDY-GFCCVEGCSA-N 1 1 297.826 3.922 20 10 CHCDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000274273975 328210608 /nfs/dbraw/zinc/21/06/08/328210608.db2.gz XBSCIZOHKHYCDB-SFYZADRCSA-N 1 1 297.811 3.617 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)n1 ZINC000180162941 329218281 /nfs/dbraw/zinc/21/82/81/329218281.db2.gz RKUFFXUZOCJKFJ-MRXNPFEDSA-N 1 1 286.350 3.572 20 10 CHCDMO CCC([NH2+]Cc1cccc(F)c1O)(C1CC1)C1CC1 ZINC000529646407 333503472 /nfs/dbraw/zinc/50/34/72/333503472.db2.gz ZMBOPXZKYSOFBM-UHFFFAOYSA-N 1 1 263.356 3.590 20 10 CHCDMO CCC[N@H+](Cc1nccn1C(C)C)Cc1ccccc1O ZINC000263902968 521694678 /nfs/dbraw/zinc/69/46/78/521694678.db2.gz BSMQKSVKMAJERH-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO CCC[N@@H+](Cc1nccn1C(C)C)Cc1ccccc1O ZINC000263902968 521694681 /nfs/dbraw/zinc/69/46/81/521694681.db2.gz BSMQKSVKMAJERH-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCCO1 ZINC000281106056 523282895 /nfs/dbraw/zinc/28/28/95/523282895.db2.gz AVDUXTWIUZEHEU-HNNXBMFYSA-N 1 1 285.387 3.546 20 10 CHCDMO Cc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062747669 525168441 /nfs/dbraw/zinc/16/84/41/525168441.db2.gz PTRDXHAFBIYCEO-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO C[C@@H]([NH2+]CCCCCO)c1cc(Cl)c(Cl)cc1O ZINC000280124944 525432763 /nfs/dbraw/zinc/43/27/63/525432763.db2.gz PUINUHFVXMQSCT-SECBINFHSA-N 1 1 292.206 3.512 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1nccs1 ZINC000070942452 525444829 /nfs/dbraw/zinc/44/48/29/525444829.db2.gz WLLZWONKALZTRY-ZDUSSCGKSA-N 1 1 287.432 3.594 20 10 CHCDMO Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1ccccc1O ZINC000292819642 526667414 /nfs/dbraw/zinc/66/74/14/526667414.db2.gz NWYXIHCDKWHEMJ-UHFFFAOYSA-N 1 1 284.403 3.851 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)[C@H]1C ZINC000251608592 1125469103 /nfs/dbraw/zinc/46/91/03/1125469103.db2.gz BZRFDNOIEJTVHA-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)[C@H]1C ZINC000251608592 1125469109 /nfs/dbraw/zinc/46/91/09/1125469109.db2.gz BZRFDNOIEJTVHA-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000092438580 1120478664 /nfs/dbraw/zinc/47/86/64/1120478664.db2.gz JJNKBLBXUGWPSP-UHFFFAOYSA-N 1 1 259.349 3.542 20 10 CHCDMO CC[C@H](C)C[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000732183404 1121911001 /nfs/dbraw/zinc/91/10/01/1121911001.db2.gz PBKWQDMWWGGIDE-LBPRGKRZSA-N 1 1 279.424 3.873 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001180029870 1121940080 /nfs/dbraw/zinc/94/00/80/1121940080.db2.gz GSAOPCGWERGJPN-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001180029870 1121940084 /nfs/dbraw/zinc/94/00/84/1121940084.db2.gz GSAOPCGWERGJPN-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001179974144 1121932909 /nfs/dbraw/zinc/93/29/09/1121932909.db2.gz KIFNRMAJLXERPS-LLVKDONJSA-N 1 1 253.773 3.524 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC001203650915 1122414872 /nfs/dbraw/zinc/41/48/72/1122414872.db2.gz GGXNRNZVOLMGER-JTQLQIEISA-N 1 1 289.753 3.913 20 10 CHCDMO CCC(F)(F)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000858506286 1123658708 /nfs/dbraw/zinc/65/87/08/1123658708.db2.gz FPATVLHCBUJXOT-SCZZXKLOSA-N 1 1 273.298 3.715 20 10 CHCDMO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883099209 1125371512 /nfs/dbraw/zinc/37/15/12/1125371512.db2.gz MVHFLFXLRJMEAK-NSHDSACASA-N 1 1 297.267 3.737 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)cc1O)CC1CCCC1 ZINC001140465595 1131750717 /nfs/dbraw/zinc/75/07/17/1131750717.db2.gz NYTXJAUGRZGBIS-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO C[N@H+](Cc1ccc(Cl)cc1O)CC1CCCC1 ZINC001140465595 1131750724 /nfs/dbraw/zinc/75/07/24/1131750724.db2.gz NYTXJAUGRZGBIS-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO CC[C@H](C)OCC[C@H](C)[N@@H+](CC)Cc1ccccc1O ZINC001172356435 1132185565 /nfs/dbraw/zinc/18/55/65/1132185565.db2.gz YKXOLRLMJKCTNS-GJZGRUSLSA-N 1 1 279.424 3.808 20 10 CHCDMO COCCC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841753093 1132391929 /nfs/dbraw/zinc/39/19/29/1132391929.db2.gz YCGUXYVNUUXFLI-LLVKDONJSA-N 1 1 283.799 3.513 20 10 CHCDMO Oc1cc(C(F)(F)F)ccc1C[N@H+]1CCCC12CC2 ZINC001233451393 1132624524 /nfs/dbraw/zinc/62/45/24/1132624524.db2.gz IWTIKLMBULJMHY-UHFFFAOYSA-N 1 1 271.282 3.539 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000841755014 1125591950 /nfs/dbraw/zinc/59/19/50/1125591950.db2.gz XLNCJYKOLAKZNY-SDDRHHMPSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841755645 1125592005 /nfs/dbraw/zinc/59/20/05/1125592005.db2.gz QNUSSZUZCVDYSK-MWLCHTKSSA-N 1 1 271.813 3.592 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCSC1)c1ccc(Cl)cc1O ZINC000841755646 1125592696 /nfs/dbraw/zinc/59/26/96/1125592696.db2.gz QNUSSZUZCVDYSK-ONGXEEELSA-N 1 1 271.813 3.592 20 10 CHCDMO Cc1cccnc1CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757973 1125597923 /nfs/dbraw/zinc/59/79/23/1125597923.db2.gz QKZLIAUSORHJGI-LBPRGKRZSA-N 1 1 290.794 3.642 20 10 CHCDMO Cc1ccc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841765310 1125602211 /nfs/dbraw/zinc/60/22/11/1125602211.db2.gz XUOZTUVDNJKVLJ-GFCCVEGCSA-N 1 1 290.794 3.642 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(Cl)ccc1O ZINC000136819854 1125647546 /nfs/dbraw/zinc/64/75/46/1125647546.db2.gz ANPCJPKVEYGTCG-MFKMUULPSA-N 1 1 253.773 3.809 20 10 CHCDMO Cc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886495011 1125680345 /nfs/dbraw/zinc/68/03/45/1125680345.db2.gz DTLFERJFKNASCX-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO COCc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886497060 1125681378 /nfs/dbraw/zinc/68/13/78/1125681378.db2.gz QFUWZLIJTHWMRL-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO COCc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886505083 1125681500 /nfs/dbraw/zinc/68/15/00/1125681500.db2.gz JIGVUESOETUWFX-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1c(O)cccc1F ZINC000886501304 1125681803 /nfs/dbraw/zinc/68/18/03/1125681803.db2.gz FFDGNWLPNCCGPU-MFKMUULPSA-N 1 1 275.323 3.853 20 10 CHCDMO C[C@H]([NH2+]CCCOC1CCCC1)c1c(O)cccc1F ZINC000886518731 1125682801 /nfs/dbraw/zinc/68/28/01/1125682801.db2.gz DWJKCRIRDQXMQB-LBPRGKRZSA-N 1 1 281.371 3.531 20 10 CHCDMO C[C@@H]([NH2+]CCCOC1CCCC1)c1c(O)cccc1F ZINC000886518730 1125683274 /nfs/dbraw/zinc/68/32/74/1125683274.db2.gz DWJKCRIRDQXMQB-GFCCVEGCSA-N 1 1 281.371 3.531 20 10 CHCDMO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cn1 ZINC000886526885 1125684517 /nfs/dbraw/zinc/68/45/17/1125684517.db2.gz ULNWNUIFMJUYMZ-VXGBXAGGSA-N 1 1 291.370 3.721 20 10 CHCDMO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886554858 1125690717 /nfs/dbraw/zinc/69/07/17/1125690717.db2.gz FBPIZHBJABQGCU-VHSXEESVSA-N 1 1 292.354 3.590 20 10 CHCDMO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2c(O)cccc2F)n1 ZINC000886587923 1125694505 /nfs/dbraw/zinc/69/45/05/1125694505.db2.gz IITCVSVEEOLSSR-KOLCDFICSA-N 1 1 294.395 3.751 20 10 CHCDMO COCC(C)(C)CCC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886608819 1125696535 /nfs/dbraw/zinc/69/65/35/1125696535.db2.gz GIHNUDUTLCDZQZ-GFCCVEGCSA-N 1 1 283.387 3.635 20 10 CHCDMO C[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1c(O)cccc1F ZINC000886607550 1125696987 /nfs/dbraw/zinc/69/69/87/1125696987.db2.gz UIYBLGOWIBWZBY-UPJWGTAASA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1c(O)cccc1F ZINC000886605765 1125697203 /nfs/dbraw/zinc/69/72/03/1125697203.db2.gz YDPADUFDGCQDGM-NXEZZACHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)c1c(O)cccc1F ZINC000886625583 1125699597 /nfs/dbraw/zinc/69/95/97/1125699597.db2.gz VHTWNCROOSKYOO-DTWKUNHWSA-N 1 1 279.277 3.770 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@@H]1CCCCO1 ZINC000886634870 1125701034 /nfs/dbraw/zinc/70/10/34/1125701034.db2.gz OSLDHLPNNGFJNI-ZLDLUXBVSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1c(O)cccc1F ZINC000886640380 1125701069 /nfs/dbraw/zinc/70/10/69/1125701069.db2.gz XXOMTEZLKCGDHZ-BDAKNGLRSA-N 1 1 292.181 3.766 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1c(O)cccc1F ZINC000886638682 1125701160 /nfs/dbraw/zinc/70/11/60/1125701160.db2.gz ZPUMHDVHMQSFBF-MEBBXXQBSA-N 1 1 287.334 3.575 20 10 CHCDMO CC(C)OC1(C[NH2+][C@@H](C)c2c(O)cccc2F)CCC1 ZINC000886649571 1125701876 /nfs/dbraw/zinc/70/18/76/1125701876.db2.gz DLXFUWQVBKMLJK-LBPRGKRZSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1c(O)cccc1F ZINC000886647725 1125702418 /nfs/dbraw/zinc/70/24/18/1125702418.db2.gz AEQNZJRNZXSXEW-SECBINFHSA-N 1 1 275.314 3.863 20 10 CHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)CC1 ZINC000093316594 1125765754 /nfs/dbraw/zinc/76/57/54/1125765754.db2.gz BJUZTCZJXAPXSP-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)c2ccco2)c1O ZINC000175605862 1126784410 /nfs/dbraw/zinc/78/44/10/1126784410.db2.gz ZAUQRKYIGAYHND-JTQLQIEISA-N 1 1 291.322 3.520 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)c2ccco2)c1O ZINC000175605862 1126784413 /nfs/dbraw/zinc/78/44/13/1126784413.db2.gz ZAUQRKYIGAYHND-JTQLQIEISA-N 1 1 291.322 3.520 20 10 CHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc(C)c2O)s1 ZINC000180153887 1126840388 /nfs/dbraw/zinc/84/03/88/1126840388.db2.gz RLMJADHIDHPGOC-LBPRGKRZSA-N 1 1 290.432 3.967 20 10 CHCDMO Cc1ccncc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000269582157 1127042382 /nfs/dbraw/zinc/04/23/82/1127042382.db2.gz QBFKHJKMRCKDSF-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236801121 1131012301 /nfs/dbraw/zinc/01/23/01/1131012301.db2.gz DDZIJPNIZQHODW-LLVKDONJSA-N 1 1 283.799 3.676 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000028890772 1127096581 /nfs/dbraw/zinc/09/65/81/1127096581.db2.gz WKDYXUGHDSLNJQ-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+](C)Cc2cc(Cl)cn2C)c1 ZINC000164485940 1127167879 /nfs/dbraw/zinc/16/78/79/1127167879.db2.gz MXMWMCJLSVOZQT-UHFFFAOYSA-N 1 1 292.810 3.633 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000284016706 1127170209 /nfs/dbraw/zinc/17/02/09/1127170209.db2.gz HXVXPPMESBQCPZ-IEBWSBKVSA-N 1 1 297.398 3.689 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])[C@H]1C ZINC001237812478 1131143144 /nfs/dbraw/zinc/14/31/44/1131143144.db2.gz HDXKEVIFHKNFRX-UWVGGRQHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])[C@H](C)C1 ZINC001237936570 1131153886 /nfs/dbraw/zinc/15/38/86/1131153886.db2.gz KPBCSRGMOGNYDQ-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2O)[C@H](C)C1 ZINC001237936570 1131153888 /nfs/dbraw/zinc/15/38/88/1131153888.db2.gz KPBCSRGMOGNYDQ-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2O)[C@H](C)C1 ZINC001237936570 1131153891 /nfs/dbraw/zinc/15/38/91/1131153891.db2.gz KPBCSRGMOGNYDQ-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@H]([NH2+]Cc1cccc(F)c1)c1ccc(F)cc1O ZINC000285581166 1127238078 /nfs/dbraw/zinc/23/80/78/1127238078.db2.gz IPESEAPJEDTDJS-HNNXBMFYSA-N 1 1 277.314 3.911 20 10 CHCDMO CCC(CC)[N@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237950693 1131154537 /nfs/dbraw/zinc/15/45/37/1131154537.db2.gz YYPYWJNNLBUPJU-UHFFFAOYSA-N 1 1 259.752 3.805 20 10 CHCDMO CCC(CC)[N@@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237950693 1131154540 /nfs/dbraw/zinc/15/45/40/1131154540.db2.gz YYPYWJNNLBUPJU-UHFFFAOYSA-N 1 1 259.752 3.805 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc(F)cc1O ZINC000286002748 1127252594 /nfs/dbraw/zinc/25/25/94/1127252594.db2.gz HRBRAKOTHIYCRK-IOASZLSFSA-N 1 1 295.398 3.777 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001238058763 1131165676 /nfs/dbraw/zinc/16/56/76/1131165676.db2.gz VKNHJNAQXLEKER-DGCLKSJQSA-N 1 1 265.372 3.708 20 10 CHCDMO C[C@@H]1[C@H](C)C[N@@H+](Cc2cc(Cl)cc(F)c2[O-])[C@H]1C ZINC001308826179 1127498312 /nfs/dbraw/zinc/49/83/12/1127498312.db2.gz UTIAKTMPTBTGRI-BBBLOLIVSA-N 1 1 271.763 3.661 20 10 CHCDMO CCC[N@H+](Cc1csc(Cl)n1)Cc1ccccc1O ZINC000294901676 1127607026 /nfs/dbraw/zinc/60/70/26/1127607026.db2.gz HDTZWHUMQFCUEW-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO CCC[N@@H+](Cc1csc(Cl)n1)Cc1ccccc1O ZINC000294901676 1127607029 /nfs/dbraw/zinc/60/70/29/1127607029.db2.gz HDTZWHUMQFCUEW-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)CC1CCC(=O)CC1 ZINC000295411305 1127642081 /nfs/dbraw/zinc/64/20/81/1127642081.db2.gz SPTHBQGUQVLJBE-UHFFFAOYSA-N 1 1 289.419 3.754 20 10 CHCDMO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(F)cc1O ZINC000170788875 1127650183 /nfs/dbraw/zinc/65/01/83/1127650183.db2.gz KDMUSDDDPFKUBL-GFCCVEGCSA-N 1 1 298.361 3.906 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@@H]2C)cc1Cl ZINC001232264056 1127653692 /nfs/dbraw/zinc/65/36/92/1127653692.db2.gz DPFLEONZJDKBBX-NSHDSACASA-N 1 1 283.799 3.819 20 10 CHCDMO CCCC[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000296556826 1127676193 /nfs/dbraw/zinc/67/61/93/1127676193.db2.gz PGMCTNQFOYVDEZ-UHFFFAOYSA-N 1 1 290.451 3.534 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001138128557 1127767540 /nfs/dbraw/zinc/76/75/40/1127767540.db2.gz RFTWUZGRKGYQDY-UHFFFAOYSA-N 1 1 283.346 3.821 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001138128557 1127767542 /nfs/dbraw/zinc/76/75/42/1127767542.db2.gz RFTWUZGRKGYQDY-UHFFFAOYSA-N 1 1 283.346 3.821 20 10 CHCDMO C[C@H]([NH2+]CCc1ccc(F)cc1)c1ccc(F)cc1O ZINC000062744754 1127772582 /nfs/dbraw/zinc/77/25/82/1127772582.db2.gz NBMPUQLORVIUEZ-NSHDSACASA-N 1 1 277.314 3.564 20 10 CHCDMO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000230663409 1127771568 /nfs/dbraw/zinc/77/15/68/1127771568.db2.gz UACCZZSLTSDLRK-PSOPSSQASA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@H]([NH2+]C1CCCCCC1)c1ccc(F)cc1O ZINC000062744994 1127772381 /nfs/dbraw/zinc/77/23/81/1127772381.db2.gz LVAHQWKPZZFHPD-NSHDSACASA-N 1 1 251.345 3.905 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1ccc(F)cc1O ZINC000062748205 1127773741 /nfs/dbraw/zinc/77/37/41/1127773741.db2.gz KZHFJCYPMUHVDP-WDEREUQCSA-N 1 1 279.380 3.875 20 10 CHCDMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)CO2 ZINC000373265913 1127830498 /nfs/dbraw/zinc/83/04/98/1127830498.db2.gz LBGYHTASWYQPKZ-IAQYHMDHSA-N 1 1 287.334 3.624 20 10 CHCDMO CCC[C@@H]1CCCC[N@@H+]1Cc1c(O)ccc(F)c1F ZINC001233334874 1127953061 /nfs/dbraw/zinc/95/30/61/1127953061.db2.gz XKMDKISJGPHUFX-LLVKDONJSA-N 1 1 269.335 3.825 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1c(O)ccc(F)c1F ZINC001233334874 1127953064 /nfs/dbraw/zinc/95/30/64/1127953064.db2.gz XKMDKISJGPHUFX-LLVKDONJSA-N 1 1 269.335 3.825 20 10 CHCDMO Oc1c(F)cccc1C[NH2+]C1(Cc2ccc(F)cc2)CC1 ZINC000825017124 1128005613 /nfs/dbraw/zinc/00/56/13/1128005613.db2.gz MCVHTKXNFOLMKQ-UHFFFAOYSA-N 1 1 289.325 3.535 20 10 CHCDMO CC1(C)[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138219851 1128145974 /nfs/dbraw/zinc/14/59/74/1128145974.db2.gz RBLDYINKKVLRSO-HDICACEKSA-N 1 1 284.447 3.765 20 10 CHCDMO CC[C@@H](c1cc(Cl)ccc1[O-])[NH+]1CCC([NH3+])(CC)CC1 ZINC000925760350 1128141223 /nfs/dbraw/zinc/14/12/23/1128141223.db2.gz PULSAAMBASORHK-AWEZNQCLSA-N 1 1 296.842 3.700 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC3(CCC3)C[C@H]2C)cc1C ZINC000762146156 1128273724 /nfs/dbraw/zinc/27/37/24/1128273724.db2.gz VEWVNZQSFPLMIL-CQSZACIVSA-N 1 1 259.393 3.774 20 10 CHCDMO CCC[N@@H+](CCCc1cccnc1)Cc1ccccc1O ZINC000929752886 1128285229 /nfs/dbraw/zinc/28/52/29/1128285229.db2.gz HBFGFNXHJLDQSR-UHFFFAOYSA-N 1 1 284.403 3.632 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@H](C(F)(F)F)C2)c2ccccc2n1C ZINC001138256810 1128303064 /nfs/dbraw/zinc/30/30/64/1128303064.db2.gz LMLMOZDSVBETCA-LBPRGKRZSA-N 1 1 296.336 3.871 20 10 CHCDMO CCCC[N@@H+](Cc1[nH]c(C)nc1C)Cc1ccccc1O ZINC000930350081 1128315653 /nfs/dbraw/zinc/31/56/53/1128315653.db2.gz FJMCQFZVFSKEJV-UHFFFAOYSA-N 1 1 287.407 3.534 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC000777970835 1128351403 /nfs/dbraw/zinc/35/14/03/1128351403.db2.gz WGQRSYNCWHOPDA-WBMJQRKESA-N 1 1 273.351 3.725 20 10 CHCDMO Cc1cccc(CCC[N@H+](C)Cc2ccccc2O)c1 ZINC000778220194 1128451214 /nfs/dbraw/zinc/45/12/14/1128451214.db2.gz RTVPCNRBACPSQV-UHFFFAOYSA-N 1 1 269.388 3.765 20 10 CHCDMO Cc1cc(C[N@@H+]2CC=CCC2)c(O)c(C(C)(C)C)c1 ZINC000778577662 1128561544 /nfs/dbraw/zinc/56/15/44/1128561544.db2.gz UMHGUPVFKDTLCZ-UHFFFAOYSA-N 1 1 259.393 3.760 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC001202779142 1128560434 /nfs/dbraw/zinc/56/04/34/1128560434.db2.gz RSGYIFIUFQMXNI-TZMCWYRMSA-N 1 1 283.362 3.975 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)c1 ZINC000042910986 1128588973 /nfs/dbraw/zinc/58/89/73/1128588973.db2.gz IBHSXQVERIZBMA-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO C[N@@H+](Cc1ccco1)Cc1ccc(N2CCCCC2)cc1 ZINC000155244572 1128602971 /nfs/dbraw/zinc/60/29/71/1128602971.db2.gz HTIPNXMJFUIBND-UHFFFAOYSA-N 1 1 284.403 3.902 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccccn1)CCC2 ZINC000919952295 1128653637 /nfs/dbraw/zinc/65/36/37/1128653637.db2.gz TXVVVKRAANTHOY-GOSISDBHSA-N 1 1 294.398 3.613 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000158027412 1128663626 /nfs/dbraw/zinc/66/36/26/1128663626.db2.gz BLTMXCTTXHQDQU-INIZCTEOSA-N 1 1 267.372 3.690 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000778994783 1128674982 /nfs/dbraw/zinc/67/49/82/1128674982.db2.gz LCTIYQQKNCGNQM-QGZVFWFLSA-N 1 1 285.362 3.738 20 10 CHCDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1cc(F)ccc1O ZINC000779022680 1128685134 /nfs/dbraw/zinc/68/51/34/1128685134.db2.gz FTTMQSNWRPCOEN-SUMWQHHRSA-N 1 1 285.362 3.909 20 10 CHCDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1cc(F)ccc1O ZINC000779023405 1128686029 /nfs/dbraw/zinc/68/60/29/1128686029.db2.gz RGVVAXFULNMKOX-UHFFFAOYSA-N 1 1 285.318 3.910 20 10 CHCDMO C[C@H]([NH2+]CCc1c(F)cccc1F)c1ccc(F)cc1O ZINC000185067631 1117759688 /nfs/dbraw/zinc/75/96/88/1117759688.db2.gz OMEWLELCFFRPOW-JTQLQIEISA-N 1 1 295.304 3.703 20 10 CHCDMO COCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179646616 1128752334 /nfs/dbraw/zinc/75/23/34/1128752334.db2.gz DSALDWSMZQOSCQ-INIZCTEOSA-N 1 1 299.414 3.992 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(F)cc2)c1 ZINC000179646955 1128752717 /nfs/dbraw/zinc/75/27/17/1128752717.db2.gz SOIPVGVGDGZPCJ-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1F ZINC000779151209 1128752904 /nfs/dbraw/zinc/75/29/04/1128752904.db2.gz VSMHNPYEGFYKIQ-MAUKXSAKSA-N 1 1 290.426 3.857 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1F ZINC000779151206 1128753103 /nfs/dbraw/zinc/75/31/03/1128753103.db2.gz VSMHNPYEGFYKIQ-CRAIPNDOSA-N 1 1 290.426 3.857 20 10 CHCDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564784 1118074258 /nfs/dbraw/zinc/07/42/58/1118074258.db2.gz DIVBQGAHOYJBMM-GHMZBOCLSA-N 1 1 253.773 3.666 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000179701979 1128754092 /nfs/dbraw/zinc/75/40/92/1128754092.db2.gz NXIWGCZTWXAAFN-AWEZNQCLSA-N 1 1 255.361 3.894 20 10 CHCDMO CC[C@@H](NCCC[N@H+](C)C(C)C)c1ccc(N(C)C)cc1 ZINC000764806228 1118116922 /nfs/dbraw/zinc/11/69/22/1118116922.db2.gz LRAIIWWTSJXPMW-GOSISDBHSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](NCCC[N@@H+](C)C(C)C)c1ccc(N(C)C)cc1 ZINC000764806228 1118116924 /nfs/dbraw/zinc/11/69/24/1118116924.db2.gz LRAIIWWTSJXPMW-GOSISDBHSA-N 1 1 291.483 3.524 20 10 CHCDMO C[N@H+](Cc1cccc(Cl)c1)Cc1cc(F)cc(F)c1O ZINC001205215200 1118184796 /nfs/dbraw/zinc/18/47/96/1118184796.db2.gz DJTCWZOVEVXNHR-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@@H+](Cc1cccc(Cl)c1)Cc1cc(F)cc(F)c1O ZINC001205215200 1118184801 /nfs/dbraw/zinc/18/48/01/1118184801.db2.gz DJTCWZOVEVXNHR-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCc3c(F)cccc3C2)c1O ZINC001140184399 1118254959 /nfs/dbraw/zinc/25/49/59/1118254959.db2.gz RUMDZLUXBIQXHA-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO CCC(CC)[C@@H](CNCc1c(O)cccc1Cl)[NH+](C)C ZINC000083551805 1118356593 /nfs/dbraw/zinc/35/65/93/1118356593.db2.gz CXBKKVDQXSKUEC-OAHLLOKOSA-N 1 1 298.858 3.502 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccccc2C)c1O ZINC000160521593 1118467745 /nfs/dbraw/zinc/46/77/45/1118467745.db2.gz VIOZMIXFCGDZQX-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)c1O ZINC000088706268 1118524731 /nfs/dbraw/zinc/52/47/31/1118524731.db2.gz UMQRYLJWAMOUMB-QWRGUYRKSA-N 1 1 295.810 3.869 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c1O ZINC000088706268 1118524733 /nfs/dbraw/zinc/52/47/33/1118524733.db2.gz UMQRYLJWAMOUMB-QWRGUYRKSA-N 1 1 295.810 3.869 20 10 CHCDMO C[C@H](c1cccnc1)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835048543 1118823450 /nfs/dbraw/zinc/82/34/50/1118823450.db2.gz UJMVUKKRJVRYRS-FYCOFBDGSA-N 1 1 295.430 3.854 20 10 CHCDMO CCC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C1CCC1 ZINC000708390543 1119424237 /nfs/dbraw/zinc/42/42/37/1119424237.db2.gz QTLSCSPXLXOBBP-AWEZNQCLSA-N 1 1 269.335 3.729 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(F)cc1O ZINC000694374468 1119891694 /nfs/dbraw/zinc/89/16/94/1119891694.db2.gz LLTNCINYXDVEDF-OXIQGZBJSA-N 1 1 263.356 3.618 20 10 CHCDMO Nc1ccc(N(c2ccccc2)c2ccc[nH+]c2N)cc1 ZINC001212404275 1120066263 /nfs/dbraw/zinc/06/62/63/1120066263.db2.gz VLCMUHHJUKIAIT-UHFFFAOYSA-N 1 1 276.343 3.716 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)c1nccs1 ZINC000078004224 1128891046 /nfs/dbraw/zinc/89/10/46/1128891046.db2.gz NKMDOWHJYDGXJM-CYBMUJFWSA-N 1 1 276.405 3.701 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@@H]2C)c(Cl)c1 ZINC001236797722 1128893396 /nfs/dbraw/zinc/89/33/96/1128893396.db2.gz AIXCYRHFTRZFFB-NSHDSACASA-N 1 1 283.799 3.819 20 10 CHCDMO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(C)cc1O ZINC001140950764 1120136289 /nfs/dbraw/zinc/13/62/89/1120136289.db2.gz HEDSEPRASBPAFY-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000186499807 1120241770 /nfs/dbraw/zinc/24/17/70/1120241770.db2.gz NSSAOMDIZMQTOJ-YGRLFVJLSA-N 1 1 281.371 3.528 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC000179680776 1120252354 /nfs/dbraw/zinc/25/23/54/1120252354.db2.gz XCPSJNLQRAWHAQ-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000180162746 1120267110 /nfs/dbraw/zinc/26/71/10/1120267110.db2.gz AYWCNQIZAUQART-HNNXBMFYSA-N 1 1 285.362 3.596 20 10 CHCDMO CSCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000309883153 1120283204 /nfs/dbraw/zinc/28/32/04/1120283204.db2.gz WOILVXYYMYXAQK-SSDOTTSWSA-N 1 1 280.220 3.713 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CCc3cnccc3C2)c1O ZINC001143104291 1120350602 /nfs/dbraw/zinc/35/06/02/1120350602.db2.gz RRZRNBJYXKBPTH-UHFFFAOYSA-N 1 1 296.414 3.643 20 10 CHCDMO CCCC[N@H+](Cc1cscn1)Cc1ccccc1O ZINC000282326456 1120352933 /nfs/dbraw/zinc/35/29/33/1120352933.db2.gz AMWAIRUKIUSRPH-UHFFFAOYSA-N 1 1 276.405 3.651 20 10 CHCDMO CCCC[N@@H+](Cc1cscn1)Cc1ccccc1O ZINC000282326456 1120352937 /nfs/dbraw/zinc/35/29/37/1120352937.db2.gz AMWAIRUKIUSRPH-UHFFFAOYSA-N 1 1 276.405 3.651 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC000312550712 1120466508 /nfs/dbraw/zinc/46/65/08/1120466508.db2.gz QIDMATFEWFCWNL-GFCCVEGCSA-N 1 1 287.325 3.863 20 10 CHCDMO C[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000191521862 1120524081 /nfs/dbraw/zinc/52/40/81/1120524081.db2.gz DDRQJEJZPBITJE-JTQLQIEISA-N 1 1 295.304 3.703 20 10 CHCDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3cc(F)ccc3O)C2)C1 ZINC000781927307 1120572671 /nfs/dbraw/zinc/57/26/71/1120572671.db2.gz DJJVUXIMGUEQBO-WBMJQRKESA-N 1 1 263.356 3.543 20 10 CHCDMO Cc1cccc(F)c1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756607470 1120599231 /nfs/dbraw/zinc/59/92/31/1120599231.db2.gz FIPODIHSGGEEMK-SNVBAGLBSA-N 1 1 295.304 3.969 20 10 CHCDMO Oc1cccc2c1C[N@H+]([C@H]1Cc3cccc(Cl)c3C1)CC2 ZINC001168737647 1120633057 /nfs/dbraw/zinc/63/30/57/1120633057.db2.gz BQTATGUSJNYJBY-AWEZNQCLSA-N 1 1 299.801 3.571 20 10 CHCDMO CCOc1cccc(C[N@@H+](C(C)C)C2CCC2)c1O ZINC000093608321 1120830751 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ZINC000182638619 1128989754 /nfs/dbraw/zinc/98/97/54/1128989754.db2.gz YTYRBQRDAHMBPU-CYBMUJFWSA-N 1 1 255.365 3.629 20 10 CHCDMO CCc1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc1 ZINC001204178474 1121693944 /nfs/dbraw/zinc/69/39/44/1121693944.db2.gz UJXNXUUAEHLOKF-UHFFFAOYSA-N 1 1 297.398 3.609 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+](C)C[C@H](C)c2nccs2)c1 ZINC000182846410 1129004666 /nfs/dbraw/zinc/00/46/66/1129004666.db2.gz FDEHZTCSFZHJIL-ZDUSSCGKSA-N 1 1 290.432 3.701 20 10 CHCDMO C[C@H]1CC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001178624224 1121800570 /nfs/dbraw/zinc/80/05/70/1121800570.db2.gz KFDSAQFZNAHIBH-UWVGGRQHSA-N 1 1 271.763 3.711 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCCc3sccc3C1)CCC2 ZINC000730454266 1121812207 /nfs/dbraw/zinc/81/22/07/1121812207.db2.gz JQQFPUAPARPPPD-UHFFFAOYSA-N 1 1 299.439 3.891 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC001179850593 1121916303 /nfs/dbraw/zinc/91/63/03/1121916303.db2.gz YQTWEIQTMFWVNM-OAHLLOKOSA-N 1 1 299.418 3.618 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC001180029870 1121940075 /nfs/dbraw/zinc/94/00/75/1121940075.db2.gz GSAOPCGWERGJPN-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](OC)[C@H](C)CC ZINC001180194735 1121964708 /nfs/dbraw/zinc/96/47/08/1121964708.db2.gz MAEQHOWKZHSHKO-RHSMWYFYSA-N 1 1 279.424 3.665 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccccc1NC ZINC001180195079 1121965599 /nfs/dbraw/zinc/96/55/99/1121965599.db2.gz QFYICYDTDXUIHD-UHFFFAOYSA-N 1 1 284.403 3.846 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@@H]12 ZINC001180271335 1121971317 /nfs/dbraw/zinc/97/13/17/1121971317.db2.gz ISFPEDDZHKSMQO-KCXAZCMYSA-N 1 1 277.383 3.932 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180372567 1121984874 /nfs/dbraw/zinc/98/48/74/1121984874.db2.gz VCGBPWKIDGIYSU-CYBMUJFWSA-N 1 1 282.378 3.795 20 10 CHCDMO COc1cc(C)c(C[N@@H+](C)CC2CCCCC2)c(O)c1 ZINC001180539850 1121998148 /nfs/dbraw/zinc/99/81/48/1121998148.db2.gz BRDOCXNGUBLPGX-UHFFFAOYSA-N 1 1 277.408 3.721 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCC3)[C@H]2C(C)C)c1O ZINC001182087044 1122107929 /nfs/dbraw/zinc/10/79/29/1122107929.db2.gz OTHWEOFHYLNVPO-QGZVFWFLSA-N 1 1 289.419 3.720 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1 ZINC000779604417 1129031991 /nfs/dbraw/zinc/03/19/91/1129031991.db2.gz LCYLURBTQHHFRM-AWEZNQCLSA-N 1 1 259.393 3.713 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC000779604335 1129032082 /nfs/dbraw/zinc/03/20/82/1129032082.db2.gz JNPOXNKZISSTHR-CQSZACIVSA-N 1 1 259.393 3.713 20 10 CHCDMO Cc1ccc(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c(O)c1 ZINC001182152740 1122116481 /nfs/dbraw/zinc/11/64/81/1122116481.db2.gz SITSPESKTPYFOQ-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO CC(C)[C@H]1[N@H+](Cc2cccc(F)c2O)CC12CCCC2 ZINC001182336181 1122145975 /nfs/dbraw/zinc/14/59/75/1122145975.db2.gz YDBZVOVGADCZFB-MRXNPFEDSA-N 1 1 277.383 3.932 20 10 CHCDMO CC(C)[C@H]1[N@@H+](Cc2cccc(F)c2O)CC12CCCC2 ZINC001182336181 1122145977 /nfs/dbraw/zinc/14/59/77/1122145977.db2.gz YDBZVOVGADCZFB-MRXNPFEDSA-N 1 1 277.383 3.932 20 10 CHCDMO CO[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774376446 1122157731 /nfs/dbraw/zinc/15/77/31/1122157731.db2.gz YGQIEFWNUPGDGJ-CIUDSAMLSA-N 1 1 292.206 3.773 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CC2(C)C)c(Cl)c1 ZINC001183074290 1122202121 /nfs/dbraw/zinc/20/21/21/1122202121.db2.gz DIKSQLBZMIREMS-LLVKDONJSA-N 1 1 267.800 3.832 20 10 CHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618487 1122218007 /nfs/dbraw/zinc/21/80/07/1122218007.db2.gz LNRUGYBZQLRVPI-MLGOLLRUSA-N 1 1 259.393 3.501 20 10 CHCDMO CC1(C)CCC(C[N@H+]2Cc3cccc(O)c3C2)CC1 ZINC001183453772 1122223557 /nfs/dbraw/zinc/22/35/57/1122223557.db2.gz HEZRSNXTWOSORY-UHFFFAOYSA-N 1 1 259.393 3.924 20 10 CHCDMO CC1(C)C[C@]1(C)C[NH2+]Cc1ccc(Cl)cc1O ZINC001183573848 1122229569 /nfs/dbraw/zinc/22/95/69/1122229569.db2.gz WGLIZCJYBUHPRJ-CQSZACIVSA-N 1 1 253.773 3.571 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](CF)C1 ZINC000711498574 1122296853 /nfs/dbraw/zinc/29/68/53/1122296853.db2.gz QHMUFHXGXCBOAF-ZDUSSCGKSA-N 1 1 273.351 3.727 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CC1(C)C ZINC001203664212 1122432007 /nfs/dbraw/zinc/43/20/07/1122432007.db2.gz RBEFSGWHPLWVLH-NSHDSACASA-N 1 1 253.773 3.524 20 10 CHCDMO C[C@@H]1CC(CC[NH2+]Cc2ccc(Cl)cc2O)C[C@@H](C)O1 ZINC001205506602 1122535551 /nfs/dbraw/zinc/53/55/51/1122535551.db2.gz BTUCMGXPCMZDKI-VXGBXAGGSA-N 1 1 297.826 3.729 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+]([C@H](C)C2CC2)C2CC2)cc1 ZINC001190674160 1122551856 /nfs/dbraw/zinc/55/18/56/1122551856.db2.gz PVOZYLXAUZUVFE-CQSZACIVSA-N 1 1 272.436 3.906 20 10 CHCDMO CC[C@H]([NH2+]CCC[NH+](CC)CC)c1cc(Cl)ccc1[O-] ZINC000775482962 1122615213 /nfs/dbraw/zinc/61/52/13/1122615213.db2.gz JKOYWAQNZJOAPO-HNNXBMFYSA-N 1 1 298.858 3.818 20 10 CHCDMO COc1ccc(N(C)C[C@H]2CCCC[N@H+]2C(C)C)cc1F ZINC001191891260 1122620652 /nfs/dbraw/zinc/62/06/52/1122620652.db2.gz 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ZINC001173885182 1132625161 /nfs/dbraw/zinc/62/51/61/1132625161.db2.gz NAFLHJRDCILKIH-UHFFFAOYSA-N 1 1 289.549 3.913 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1O ZINC001203558699 1133340465 /nfs/dbraw/zinc/34/04/65/1133340465.db2.gz WSJIPFJTPAFAJE-UHFFFAOYSA-N 1 1 259.324 3.553 20 10 CHCDMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cc(OC)ccc1O ZINC001203680373 1133353090 /nfs/dbraw/zinc/35/30/90/1133353090.db2.gz SEXLLIVLFZAXML-QGZVFWFLSA-N 1 1 285.387 3.984 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)C[C@H]1C ZINC001203929410 1133386876 /nfs/dbraw/zinc/38/68/76/1133386876.db2.gz CGZAIGICKOIPPL-HUUCEWRRSA-N 1 1 260.425 3.621 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCn3cccc3[C@@H]2C)cc1 ZINC001203942459 1133387937 /nfs/dbraw/zinc/38/79/37/1133387937.db2.gz RFKUMPNIGOWQMR-INIZCTEOSA-N 1 1 297.446 3.911 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1C[C@H]1C1CCCC1 ZINC001204089790 1133407640 /nfs/dbraw/zinc/40/76/40/1133407640.db2.gz RAEPUQGRAZYYLS-FZMZJTMJSA-N 1 1 281.346 3.586 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](C)CC[C@H]1C ZINC001204163903 1133412199 /nfs/dbraw/zinc/41/21/99/1133412199.db2.gz VLSLZNYUBQQIGF-DZGCQCFKSA-N 1 1 260.425 3.681 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)o1)Cc1ccccc1O ZINC001204539271 1133459342 /nfs/dbraw/zinc/45/93/42/1133459342.db2.gz NALYRWFQSNCARV-UHFFFAOYSA-N 1 1 259.349 3.624 20 10 CHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1CCCC12CCCCC2 ZINC001204580533 1133464715 /nfs/dbraw/zinc/46/47/15/1133464715.db2.gz PAXSEXLKRIYWJB-UHFFFAOYSA-N 1 1 281.346 3.969 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCCC12CCCCC2 ZINC001204580533 1133464719 /nfs/dbraw/zinc/46/47/19/1133464719.db2.gz PAXSEXLKRIYWJB-UHFFFAOYSA-N 1 1 281.346 3.969 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCCC12CCCCC2 ZINC001204580533 1133464722 /nfs/dbraw/zinc/46/47/22/1133464722.db2.gz PAXSEXLKRIYWJB-UHFFFAOYSA-N 1 1 281.346 3.969 20 10 CHCDMO Cc1ncsc1C[N@H+](C)Cc1cc(C(C)C)ccc1O ZINC001204790576 1133485294 /nfs/dbraw/zinc/48/52/94/1133485294.db2.gz NPCDNXKMRPNIGJ-UHFFFAOYSA-N 1 1 290.432 3.913 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C)[C@@H]3CCCC[C@@H]32)c1 ZINC001204880678 1133495499 /nfs/dbraw/zinc/49/54/99/1133495499.db2.gz FGRXADFAOURPCU-JQFCIGGWSA-N 1 1 289.419 3.801 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001204887938 1133495892 /nfs/dbraw/zinc/49/58/92/1133495892.db2.gz CRDDQXWSOWFBGJ-MAUKXSAKSA-N 1 1 272.436 3.826 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2C)o1 ZINC001205185661 1133543203 /nfs/dbraw/zinc/54/32/03/1133543203.db2.gz PTYVBILQLWTPMC-UHFFFAOYSA-N 1 1 272.392 3.594 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Cl)c(C)cc2O)o1 ZINC001205185595 1133543492 /nfs/dbraw/zinc/54/34/92/1133543492.db2.gz OSZCGAOCDXHYSB-UHFFFAOYSA-N 1 1 279.767 3.887 20 10 CHCDMO CCC1(C[NH2+]Cc2cccc(F)c2O)CCCCC1 ZINC001205231150 1133548152 /nfs/dbraw/zinc/54/81/52/1133548152.db2.gz RSAJPRICADBQET-UHFFFAOYSA-N 1 1 265.372 3.981 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC(C)(C)[C@H]2C(C)C)c1O ZINC001206040163 1133646532 /nfs/dbraw/zinc/64/65/32/1133646532.db2.gz OORXHPARJOLGLL-OAHLLOKOSA-N 1 1 297.826 3.921 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC001206049656 1133649475 /nfs/dbraw/zinc/64/94/75/1133649475.db2.gz QHMVFEQJJNSTOA-KRWDZBQOSA-N 1 1 270.351 3.745 20 10 CHCDMO Cc1ccnc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001206854577 1133757365 /nfs/dbraw/zinc/75/73/65/1133757365.db2.gz JFLURKZDQNKYLJ-UHFFFAOYSA-N 1 1 295.430 3.622 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCCCOc1ccccc1)C2 ZINC001207243344 1133782469 /nfs/dbraw/zinc/78/24/69/1133782469.db2.gz JQJBFBXJDNMQAB-UHFFFAOYSA-N 1 1 297.398 3.957 20 10 CHCDMO CC[N@@H+](CCCc1ccc(C)o1)Cc1ccccc1O ZINC001207952060 1133870680 /nfs/dbraw/zinc/87/06/80/1133870680.db2.gz IKAKESSPMBTBRR-UHFFFAOYSA-N 1 1 273.376 3.748 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCCC(=O)CC2)cc1 ZINC001209516766 1134031524 /nfs/dbraw/zinc/03/15/24/1134031524.db2.gz NVKZQQAMLBVQTE-UHFFFAOYSA-N 1 1 296.414 3.649 20 10 CHCDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209517420 1134033690 /nfs/dbraw/zinc/03/36/90/1134033690.db2.gz DVIJFTRRZSDLAV-LJQANCHMSA-N 1 1 298.430 3.705 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001209519447 1134034314 /nfs/dbraw/zinc/03/43/14/1134034314.db2.gz UWQHDFDGOVAQKG-AWEZNQCLSA-N 1 1 296.414 3.505 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001209519447 1134034320 /nfs/dbraw/zinc/03/43/20/1134034320.db2.gz UWQHDFDGOVAQKG-AWEZNQCLSA-N 1 1 296.414 3.505 20 10 CHCDMO CC(C)(C)[C@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217694920 1134987523 /nfs/dbraw/zinc/98/75/23/1134987523.db2.gz GALIZZLDWWSHJT-CQSZACIVSA-N 1 1 296.374 3.573 20 10 CHCDMO CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000019915126 170924879 /nfs/dbraw/zinc/92/48/79/170924879.db2.gz WZSICAPSZOSLRM-CYBMUJFWSA-N 1 1 298.858 3.646 20 10 CHCDMO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000186561833 262098677 /nfs/dbraw/zinc/09/86/77/262098677.db2.gz KFJHPMDAKGYFKS-KOLCDFICSA-N 1 1 294.395 3.751 20 10 CHCDMO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000090339800 327094334 /nfs/dbraw/zinc/09/43/34/327094334.db2.gz ALMSMCNPZWZULZ-NEPJUHHUSA-N 1 1 289.350 3.952 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(F)cc1O ZINC000528037081 330303041 /nfs/dbraw/zinc/30/30/41/330303041.db2.gz BYZINUZFRYNGTP-IINYFYTJSA-N 1 1 292.329 3.867 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@@H]1CCCc2ccccc21 ZINC000164937095 331305414 /nfs/dbraw/zinc/30/54/14/331305414.db2.gz QNXAFHHQDDWNOV-MRXNPFEDSA-N 1 1 271.335 3.699 20 10 CHCDMO CCCCN1CCC([NH2+][C@@H](CC)c2ccccc2O)CC1 ZINC000037150146 520576148 /nfs/dbraw/zinc/57/61/48/520576148.db2.gz DLWBCTWYZFUOQO-KRWDZBQOSA-N 1 1 290.451 3.697 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@@H](C)c1cccnc1 ZINC000290656203 521287232 /nfs/dbraw/zinc/28/72/32/521287232.db2.gz ZJAIZEKOEOIVQA-HNNXBMFYSA-N 1 1 284.403 3.987 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@@H](C)c1cccnc1 ZINC000290425154 521293791 /nfs/dbraw/zinc/29/37/91/521293791.db2.gz KZJKJHPXDNBAAR-LBPRGKRZSA-N 1 1 274.339 3.509 20 10 CHCDMO CCc1nc(C)c(C[NH2+][C@@H](CC)c2ccc(F)cc2O)o1 ZINC000291890484 522207394 /nfs/dbraw/zinc/20/73/94/522207394.db2.gz KKUKIKNJBBXZJZ-ZDUSSCGKSA-N 1 1 292.354 3.631 20 10 CHCDMO COCc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062747692 523106283 /nfs/dbraw/zinc/10/62/83/523106283.db2.gz KDGDBCZOTITEFF-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO CN(C)c1ccc(C[N@H+](C)Cc2nc3ccccc3o2)cc1 ZINC000263825821 523565605 /nfs/dbraw/zinc/56/56/05/523565605.db2.gz ZXMAFBITKAQDAE-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2nc3ccccc3o2)cc1 ZINC000263825821 523565610 /nfs/dbraw/zinc/56/56/10/523565610.db2.gz ZXMAFBITKAQDAE-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO C[N@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccccc1O ZINC000280043645 523575913 /nfs/dbraw/zinc/57/59/13/523575913.db2.gz ZPXJIEMDHBHLHU-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO C[N@@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccccc1O ZINC000280043645 523575929 /nfs/dbraw/zinc/57/59/29/523575929.db2.gz ZPXJIEMDHBHLHU-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(F)cc1O ZINC000281109007 525479664 /nfs/dbraw/zinc/47/96/64/525479664.db2.gz LRCVRDUGFOYXHH-NXEZZACHSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H](O)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278973356 525757062 /nfs/dbraw/zinc/75/70/62/525757062.db2.gz CGPHPSMKYHZUPZ-BDAKNGLRSA-N 1 1 292.206 3.511 20 10 CHCDMO Oc1ccc(C[N@H+](Cc2ccccc2O)CC2CC2)cc1 ZINC000289539734 526345319 /nfs/dbraw/zinc/34/53/19/526345319.db2.gz WRXZJYFHAGWCQK-UHFFFAOYSA-N 1 1 283.371 3.510 20 10 CHCDMO Oc1ccccc1CNc1ccc(C2CCC2)c[nH+]1 ZINC000293220060 526374824 /nfs/dbraw/zinc/37/48/24/526374824.db2.gz YRAKTOQERDIVDK-UHFFFAOYSA-N 1 1 254.333 3.667 20 10 CHCDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564612 1118074098 /nfs/dbraw/zinc/07/40/98/1118074098.db2.gz DIVBQGAHOYJBMM-MNOVXSKESA-N 1 1 253.773 3.666 20 10 CHCDMO CCC[N@@H+](CC)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000727821259 1121749294 /nfs/dbraw/zinc/74/92/94/1121749294.db2.gz XGMREKQZXOWLRC-UHFFFAOYSA-N 1 1 265.397 3.627 20 10 CHCDMO CC1CCC(C)(C[NH2+]Cc2cc(F)c(F)cc2O)CC1 ZINC001181419141 1122052209 /nfs/dbraw/zinc/05/22/09/1122052209.db2.gz UOCUHUOUNVBTTF-UHFFFAOYSA-N 1 1 283.362 3.976 20 10 CHCDMO CC[C@@H]([NH2+]CCC(C)(C)F)c1ccc(F)cc1O ZINC000850531624 1123284872 /nfs/dbraw/zinc/28/48/72/1123284872.db2.gz LPFMSEIVAJOZGR-GFCCVEGCSA-N 1 1 257.324 3.710 20 10 CHCDMO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccc(F)cc1O ZINC000850536216 1123287202 /nfs/dbraw/zinc/28/72/02/1123287202.db2.gz IMVHCEXTBZLGIM-NOZJJQNGSA-N 1 1 273.298 3.617 20 10 CHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)c2csnn2)c1O ZINC000840886142 1123996853 /nfs/dbraw/zinc/99/68/53/1123996853.db2.gz PLTHLMVMKTZCTN-IUCAKERBSA-N 1 1 297.811 3.617 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cc(Cl)cs1)CC2 ZINC001232280047 1132448624 /nfs/dbraw/zinc/44/86/24/1132448624.db2.gz KVFVAQBDHLACEP-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)nc1 ZINC000841752492 1125584698 /nfs/dbraw/zinc/58/46/98/1125584698.db2.gz AZPKZNIMUKGPEH-LBPRGKRZSA-N 1 1 290.794 3.642 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000054495165 1125600919 /nfs/dbraw/zinc/60/09/19/1125600919.db2.gz LNGMLOMANYTXHO-CQSZACIVSA-N 1 1 297.398 3.546 20 10 CHCDMO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886491744 1125680606 /nfs/dbraw/zinc/68/06/06/1125680606.db2.gz OPANHAUOGGXUJG-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1c(O)cccc1F ZINC000886494936 1125680011 /nfs/dbraw/zinc/68/00/11/1125680011.db2.gz AGOKGFJJKTUSIG-IAQYHMDHSA-N 1 1 271.335 3.869 20 10 CHCDMO CCOc1ccccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886510054 1125681407 /nfs/dbraw/zinc/68/14/07/1125681407.db2.gz RLDGBRGWXSWCBS-GFCCVEGCSA-N 1 1 289.350 3.781 20 10 CHCDMO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886522251 1125683399 /nfs/dbraw/zinc/68/33/99/1125683399.db2.gz FVYNJCFRNZTCJE-RYUDHWBXSA-N 1 1 289.350 3.519 20 10 CHCDMO COc1ccc(C)cc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886543013 1125686682 /nfs/dbraw/zinc/68/66/82/1125686682.db2.gz JLNWCAJSJKWHKP-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1c(O)cccc1F ZINC000886558704 1125689746 /nfs/dbraw/zinc/68/97/46/1125689746.db2.gz QFOTUYYSMUSEEW-SLEUVZQESA-N 1 1 295.398 3.776 20 10 CHCDMO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886561798 1125691555 /nfs/dbraw/zinc/69/15/55/1125691555.db2.gz JKODCZZBYJHLKW-NWDGAFQWSA-N 1 1 288.366 3.901 20 10 CHCDMO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2c(O)cccc2F)s1 ZINC000886589838 1125694020 /nfs/dbraw/zinc/69/40/20/1125694020.db2.gz HGYNBFCVIIPRSR-MWLCHTKSSA-N 1 1 294.395 3.751 20 10 CHCDMO C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1c(O)cccc1F ZINC000886609673 1125696934 /nfs/dbraw/zinc/69/69/34/1125696934.db2.gz ZBTPNSZVDOALAA-MRVPVSSYSA-N 1 1 277.261 3.524 20 10 CHCDMO C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)c1c(O)cccc1F ZINC000886630995 1125699468 /nfs/dbraw/zinc/69/94/68/1125699468.db2.gz ABOBZWFZCRZGIM-FZZIBODNSA-N 1 1 289.753 3.887 20 10 CHCDMO C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)c1c(O)cccc1F ZINC000886630997 1125701470 /nfs/dbraw/zinc/70/14/70/1125701470.db2.gz ABOBZWFZCRZGIM-QCZZGDTMSA-N 1 1 289.753 3.887 20 10 CHCDMO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)s1 ZINC000886645391 1125702947 /nfs/dbraw/zinc/70/29/47/1125702947.db2.gz XYGNABXSFYEDBZ-RKDXNWHRSA-N 1 1 280.368 3.708 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)CC(F)F)c1c(O)cccc1F ZINC000886650021 1125702960 /nfs/dbraw/zinc/70/29/60/1125702960.db2.gz NMRPPZDXBZKKDR-SECBINFHSA-N 1 1 275.314 3.863 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(F)cc1O ZINC000886684264 1125707672 /nfs/dbraw/zinc/70/76/72/1125707672.db2.gz IORFJZPPXXBYTM-AWEZNQCLSA-N 1 1 290.338 3.638 20 10 CHCDMO Oc1cc(Br)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000826538745 1125759421 /nfs/dbraw/zinc/75/94/21/1125759421.db2.gz JIYQPRRUDFSFDC-GWCFXTLKSA-N 1 1 296.208 3.529 20 10 CHCDMO CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)C1 ZINC000248483399 1129419490 /nfs/dbraw/zinc/41/94/90/1129419490.db2.gz CRYSXHDDTFNQEC-RAIGVLPGSA-N 1 1 283.412 3.856 20 10 CHCDMO CC1(C[N@@H+](Cc2ccccc2O)C2CCCC2)CC1 ZINC000787164191 1130135167 /nfs/dbraw/zinc/13/51/67/1130135167.db2.gz KJBVEKLFKCSYQG-UHFFFAOYSA-N 1 1 259.393 3.937 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000302739158 1126741063 /nfs/dbraw/zinc/74/10/63/1126741063.db2.gz MGIDBBMZFYSSBI-UHFFFAOYSA-N 1 1 268.404 3.693 20 10 CHCDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cc(F)ccc1O ZINC000179935604 1126836534 /nfs/dbraw/zinc/83/65/34/1126836534.db2.gz PKFXDMQKKHZUSV-JTQLQIEISA-N 1 1 265.353 3.786 20 10 CHCDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000187597006 1126911654 /nfs/dbraw/zinc/91/16/54/1126911654.db2.gz FYNRXXCPMYYWGJ-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO Cc1cc(Br)c([O-])c(C[N@@H+]2CC=C(C)CC2)c1 ZINC000781913969 1130747051 /nfs/dbraw/zinc/74/70/51/1130747051.db2.gz UWCOZXJLNARVBI-UHFFFAOYSA-N 1 1 296.208 3.615 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CC=C(C)CC2)c1 ZINC000781913969 1130747055 /nfs/dbraw/zinc/74/70/55/1130747055.db2.gz UWCOZXJLNARVBI-UHFFFAOYSA-N 1 1 296.208 3.615 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000193456325 1126969283 /nfs/dbraw/zinc/96/92/83/1126969283.db2.gz BRVKRTUQWICIRG-GOSISDBHSA-N 1 1 283.419 3.731 20 10 CHCDMO C[N@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccc1O ZINC000267984121 1127009507 /nfs/dbraw/zinc/00/95/07/1127009507.db2.gz HNJULXWHVRXHDR-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO C[N@@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccc1O ZINC000267984121 1127009510 /nfs/dbraw/zinc/00/95/10/1127009510.db2.gz HNJULXWHVRXHDR-UHFFFAOYSA-N 1 1 290.432 3.778 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)CCSC)c1ccc(F)cc1O ZINC000796770621 1130931110 /nfs/dbraw/zinc/93/11/10/1130931110.db2.gz DWMPDHNVEDXTAI-ZWNOBZJWSA-N 1 1 271.401 3.714 20 10 CHCDMO C[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1cccc(C(F)(F)F)c1O ZINC000815625509 1131011088 /nfs/dbraw/zinc/01/10/88/1131011088.db2.gz 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ZINC001237938236 1131153983 /nfs/dbraw/zinc/15/39/83/1131153983.db2.gz ZUBRAILFURDVSK-JTQLQIEISA-N 1 1 257.736 3.559 20 10 CHCDMO CCOCCC1(C[NH2+][C@H](CC)c2ccc(F)cc2O)CC1 ZINC000286102944 1127258895 /nfs/dbraw/zinc/25/88/95/1127258895.db2.gz MQRUUQLXCAFCHB-OAHLLOKOSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(F)cc1O ZINC000287065894 1127285955 /nfs/dbraw/zinc/28/59/55/1127285955.db2.gz NVLWJXAUCIYTPN-SMDDNHRTSA-N 1 1 283.412 3.715 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC001120370990 1127521549 /nfs/dbraw/zinc/52/15/49/1127521549.db2.gz LWUQCQQQUIUNQB-KRWDZBQOSA-N 1 1 256.393 3.591 20 10 CHCDMO CC[C@H](C)C[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228629760 1127576583 /nfs/dbraw/zinc/57/65/83/1127576583.db2.gz PLRNPRFMKKGAEL-JTQLQIEISA-N 1 1 271.788 3.532 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(F)cc1O ZINC000062748430 1127773715 /nfs/dbraw/zinc/77/37/15/1127773715.db2.gz DTAATWVZKHCAOS-SECBINFHSA-N 1 1 281.277 3.660 20 10 CHCDMO C[C@H](Cc1cccs1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062746783 1127774000 /nfs/dbraw/zinc/77/40/00/1127774000.db2.gz FLSSAROSITXHSS-GHMZBOCLSA-N 1 1 279.380 3.875 20 10 CHCDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)CO2 ZINC000373265914 1127831079 /nfs/dbraw/zinc/83/10/79/1127831079.db2.gz LBGYHTASWYQPKZ-NHYWBVRUSA-N 1 1 287.334 3.624 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000374260489 1127882138 /nfs/dbraw/zinc/88/21/38/1127882138.db2.gz WGKCUTYBZHCLFV-QGZVFWFLSA-N 1 1 285.412 3.682 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168444759 1128098257 /nfs/dbraw/zinc/09/82/57/1128098257.db2.gz GYFSEHOZROBKMK-GOSISDBHSA-N 1 1 299.389 3.911 20 10 CHCDMO CC[C@H]([NH2+]Cc1ncc(C)cc1C)c1ccc(F)cc1O ZINC000926961678 1128206613 /nfs/dbraw/zinc/20/66/13/1128206613.db2.gz WVYYDKSACXPVRQ-HNNXBMFYSA-N 1 1 288.366 3.784 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1ccc(F)cc1O ZINC000927029483 1128209699 /nfs/dbraw/zinc/20/96/99/1128209699.db2.gz 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/nfs/dbraw/zinc/29/51/61/1128295161.db2.gz KJRQHLNCHHSYCN-UHFFFAOYSA-N 1 1 283.362 3.964 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)C2CCCC2)c1 ZINC000153678808 1128332821 /nfs/dbraw/zinc/33/28/21/1128332821.db2.gz OUWWIMYFANJMMI-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO CC[N@@H+](Cc1cc(C)cc(OC)c1O)C1CCCCC1 ZINC000915793496 1128338804 /nfs/dbraw/zinc/33/88/04/1128338804.db2.gz SECFMAUYTHHFII-UHFFFAOYSA-N 1 1 277.408 3.864 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)c2ccccc2)c1O ZINC000917075128 1128474784 /nfs/dbraw/zinc/47/47/84/1128474784.db2.gz HCMDFSPRKZZGQB-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO CC1CCC([N@@H+](C)Cc2c(O)ccc3ccncc32)CC1 ZINC000917456716 1128501211 /nfs/dbraw/zinc/50/12/11/1128501211.db2.gz UTDJLYZSMYMMJX-UHFFFAOYSA-N 1 1 284.403 3.951 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC000156039467 1128623532 /nfs/dbraw/zinc/62/35/32/1128623532.db2.gz HBAIIESLPVJOEN-HIFRSBDPSA-N 1 1 275.392 3.555 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000778993986 1128674426 /nfs/dbraw/zinc/67/44/26/1128674426.db2.gz ZZXRPFYWBMICIW-UHFFFAOYSA-N 1 1 273.351 3.726 20 10 CHCDMO C[N@H+](Cc1cc(F)ccc1O)Cc1ccccc1Cl ZINC000778992864 1128674838 /nfs/dbraw/zinc/67/48/38/1128674838.db2.gz KZVONNFQYJTODC-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000778998139 1128675392 /nfs/dbraw/zinc/67/53/92/1128675392.db2.gz IPWXLVCDWLCLNC-QGZVFWFLSA-N 1 1 285.362 3.738 20 10 CHCDMO C[N@@H+](CCSc1nccs1)Cc1ccc(F)cc1 ZINC000185688561 1117870992 /nfs/dbraw/zinc/87/09/92/1117870992.db2.gz GMLYBEKGRLJNSN-UHFFFAOYSA-N 1 1 282.409 3.506 20 10 CHCDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000179577438 1128748841 /nfs/dbraw/zinc/74/88/41/1128748841.db2.gz FROFYSOOXBEHHE-SFHVURJKSA-N 1 1 296.414 3.795 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](C(C)C)CC2)c1 ZINC000211391275 1118023954 /nfs/dbraw/zinc/02/39/54/1118023954.db2.gz XLJTVNPEDFEVDM-CQSZACIVSA-N 1 1 277.408 3.659 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000211517789 1118069588 /nfs/dbraw/zinc/06/95/88/1118069588.db2.gz NKLVXSIRSZVNIU-NSHDSACASA-N 1 1 253.773 3.668 20 10 CHCDMO CSC1(C[NH2+]Cc2cccc(F)c2O)CCCCC1 ZINC000235286669 1118082379 /nfs/dbraw/zinc/08/23/79/1118082379.db2.gz GAHNZJGSWQRZQJ-UHFFFAOYSA-N 1 1 283.412 3.687 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)Cc2cccs2)c1 ZINC000179720981 1128755840 /nfs/dbraw/zinc/75/58/40/1128755840.db2.gz LFMMLNRPPXFLGS-UHFFFAOYSA-N 1 1 291.416 3.875 20 10 CHCDMO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000765571131 1118172202 /nfs/dbraw/zinc/17/22/02/1118172202.db2.gz YMFYZCOGVVSMEB-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CC[C@H](C)[N@H+](C)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657145 1118188125 /nfs/dbraw/zinc/18/81/25/1118188125.db2.gz VVBXLNISASITFZ-YJBOKZPZSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657145 1118188126 /nfs/dbraw/zinc/18/81/26/1118188126.db2.gz VVBXLNISASITFZ-YJBOKZPZSA-N 1 1 291.483 3.524 20 10 CHCDMO C[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccc(F)cc1O ZINC000188667830 1128764403 /nfs/dbraw/zinc/76/44/03/1128764403.db2.gz XZKRVNIBKCFOLZ-YVEFUNNKSA-N 1 1 295.398 3.513 20 10 CHCDMO CCOC[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000177629876 1118260665 /nfs/dbraw/zinc/26/06/65/1118260665.db2.gz XLCFZZBNDLUBIT-OAHLLOKOSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[C@H](N[C@H](C)C[NH+](CC)CC)c1ccc(N(C)C)cc1 ZINC000765770367 1118322627 /nfs/dbraw/zinc/32/26/27/1118322627.db2.gz WRPBHXRJVVSCTO-QAPCUYQASA-N 1 1 291.483 3.524 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000211671204 1118332598 /nfs/dbraw/zinc/33/25/98/1118332598.db2.gz LEFWWMRNNJAJIH-ZDUSSCGKSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@H]([NH2+]CC(C1CC1)C1CC1)c1ccc(F)cc1O ZINC000088455957 1118521194 /nfs/dbraw/zinc/52/11/94/1118521194.db2.gz AXIVTSUMNWBXPG-JTQLQIEISA-N 1 1 263.356 3.618 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461891 1118720520 /nfs/dbraw/zinc/72/05/20/1118720520.db2.gz WZQVLUYPEDOYFO-SNVBAGLBSA-N 1 1 289.753 3.913 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000782275828 1118735748 /nfs/dbraw/zinc/73/57/48/1118735748.db2.gz IUEHUMKOSNNATG-CWRNSKLLSA-N 1 1 289.419 3.720 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001140466223 1118751581 /nfs/dbraw/zinc/75/15/81/1118751581.db2.gz BUAZNMGEZAUUKW-HNNXBMFYSA-N 1 1 288.778 3.778 20 10 CHCDMO CCC[N@@H+](Cc1ccnn1C1CCC1)Cc1ccccc1O ZINC000891853107 1118803677 /nfs/dbraw/zinc/80/36/77/1118803677.db2.gz BJDZMWDIXVIHSQ-UHFFFAOYSA-N 1 1 299.418 3.726 20 10 CHCDMO CC[C@H]([NH2+]CC(C)(C)[C@H](O)C(C)C)c1ccc(F)cc1O ZINC000796850385 1119643855 /nfs/dbraw/zinc/64/38/55/1119643855.db2.gz ZEEDKAZGIUZYBD-GOEBONIOSA-N 1 1 297.414 3.615 20 10 CHCDMO CC[C@H]([NH2+]CCc1ccccc1)c1ccc(F)cc1O ZINC000796665368 1119737084 /nfs/dbraw/zinc/73/70/84/1119737084.db2.gz HERUIVBSCBKHTI-INIZCTEOSA-N 1 1 273.351 3.815 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccccc2)c1 ZINC000179701991 1119757922 /nfs/dbraw/zinc/75/79/22/1119757922.db2.gz NXIWGCZTWXAAFN-CQSZACIVSA-N 1 1 255.361 3.894 20 10 CHCDMO C[C@@H]([NH2+]C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000309399725 1119984367 /nfs/dbraw/zinc/98/43/67/1119984367.db2.gz HDZRFYNMTMBKMF-SSDOTTSWSA-N 1 1 260.164 3.902 20 10 CHCDMO CCCC[N@@H+](CCc1ccncc1)Cc1ccccc1O ZINC000282340927 1120466454 /nfs/dbraw/zinc/46/64/54/1120466454.db2.gz BTGOKQLYIMETTO-UHFFFAOYSA-N 1 1 284.403 3.632 20 10 CHCDMO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000922668090 1120575964 /nfs/dbraw/zinc/57/59/64/1120575964.db2.gz YTIHMEBFWPHVFJ-SNVBAGLBSA-N 1 1 295.304 3.969 20 10 CHCDMO CC[N@@H+](Cc1cnc(C)s1)Cc1ccc(N(C)C)cc1 ZINC000125697343 1120890376 /nfs/dbraw/zinc/89/03/76/1120890376.db2.gz FIJWLNNAPBBQTB-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1O ZINC000093867483 1120892174 /nfs/dbraw/zinc/89/21/74/1120892174.db2.gz PZVHFWPBAYRNFV-RDTXWAMCSA-N 1 1 297.398 3.984 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccccc2O)CC[C@H]1C(F)(F)F ZINC000191658831 1128950352 /nfs/dbraw/zinc/95/03/52/1128950352.db2.gz WJEIKXSQCOJXBJ-CYBMUJFWSA-N 1 1 287.325 3.803 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)C1CCCC1)c1ccc(F)cc1O ZINC000070305390 1128966279 /nfs/dbraw/zinc/96/62/79/1128966279.db2.gz FLBZLSWRYGZHPS-WDEREUQCSA-N 1 1 251.345 3.761 20 10 CHCDMO Cc1ccc(CC[NH2+]Cc2cc(F)cc(F)c2O)c(C)c1 ZINC001648946112 1121238123 /nfs/dbraw/zinc/23/81/23/1121238123.db2.gz KYKFOYXJMDYRIZ-UHFFFAOYSA-N 1 1 291.341 3.620 20 10 CHCDMO CC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)C1CCC1 ZINC000706723882 1121437789 /nfs/dbraw/zinc/43/77/89/1121437789.db2.gz ROLCJLPQYKCGNB-UHFFFAOYSA-N 1 1 281.783 3.623 20 10 CHCDMO CC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)C1CCC1 ZINC000706723882 1121437795 /nfs/dbraw/zinc/43/77/95/1121437795.db2.gz ROLCJLPQYKCGNB-UHFFFAOYSA-N 1 1 281.783 3.623 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000727825143 1121749902 /nfs/dbraw/zinc/74/99/02/1121749902.db2.gz 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/nfs/dbraw/zinc/94/22/36/1121942236.db2.gz WODWLKMJSVUZQZ-NSHDSACASA-N 1 1 255.789 3.912 20 10 CHCDMO CC[N@@H+](Cc1ccc(Cl)cc1O)[C@@H](C)C(C)C ZINC001180043673 1121942243 /nfs/dbraw/zinc/94/22/43/1121942243.db2.gz WODWLKMJSVUZQZ-NSHDSACASA-N 1 1 255.789 3.912 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCc3ccsc3C2)cc1 ZINC000773827267 1121909268 /nfs/dbraw/zinc/90/92/68/1121909268.db2.gz WGMMTRWFQQESGB-UHFFFAOYSA-N 1 1 286.444 3.763 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](c3ccco3)C2)cc1C ZINC000732182305 1121910430 /nfs/dbraw/zinc/91/04/30/1121910430.db2.gz GFSAASXHYLHSHG-CQSZACIVSA-N 1 1 271.360 3.592 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H](C)O1 ZINC000732184547 1121910545 /nfs/dbraw/zinc/91/05/45/1121910545.db2.gz CLZUIKMRSMHBPQ-GOEBONIOSA-N 1 1 291.435 3.823 20 10 CHCDMO Cc1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)on1 ZINC000732205066 1121912703 /nfs/dbraw/zinc/91/27/03/1121912703.db2.gz YXOGECRMMFNTJW-UHFFFAOYSA-N 1 1 286.375 3.633 20 10 CHCDMO CSC[C@@H]1CCC[N@H+]1Cc1c(O)cc(C)cc1Cl ZINC001179854989 1121916653 /nfs/dbraw/zinc/91/66/53/1121916653.db2.gz LXIJXIZAKLBOJG-NSHDSACASA-N 1 1 285.840 3.681 20 10 CHCDMO CC[N@H+](Cc1ccoc1)Cc1c(O)cc(C)cc1Cl ZINC001179868961 1121921748 /nfs/dbraw/zinc/92/17/48/1121921748.db2.gz MAIMYKUQHJSGLA-UHFFFAOYSA-N 1 1 279.767 3.969 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1c(O)cc(C)cc1Cl ZINC001179868961 1121921750 /nfs/dbraw/zinc/92/17/50/1121921750.db2.gz MAIMYKUQHJSGLA-UHFFFAOYSA-N 1 1 279.767 3.969 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001181205109 1122042494 /nfs/dbraw/zinc/04/24/94/1122042494.db2.gz IXEBGIAHOUTKQM-LBPRGKRZSA-N 1 1 283.362 3.929 20 10 CHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001181205109 1122042498 /nfs/dbraw/zinc/04/24/98/1122042498.db2.gz IXEBGIAHOUTKQM-LBPRGKRZSA-N 1 1 283.362 3.929 20 10 CHCDMO Oc1c(F)cccc1C[NH2+]CCCc1cccc(Cl)c1 ZINC001181348956 1122052772 /nfs/dbraw/zinc/05/27/72/1122052772.db2.gz JDXKXGQJRUCKJX-UHFFFAOYSA-N 1 1 293.769 3.907 20 10 CHCDMO C[C@@H]1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC001181399440 1122053584 /nfs/dbraw/zinc/05/35/84/1122053584.db2.gz IPYVNCWOWUEHSM-ZJUUUORDSA-N 1 1 271.763 3.711 20 10 CHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)cc1O ZINC001181543949 1122061665 /nfs/dbraw/zinc/06/16/65/1122061665.db2.gz IYRNOBWGQURMGT-GWCFXTLKSA-N 1 1 253.773 3.809 20 10 CHCDMO COc1cc(C)c(CNc2ccc(C3CCC3)c[nH+]2)c(O)c1 ZINC001182115656 1122110679 /nfs/dbraw/zinc/11/06/79/1122110679.db2.gz OQSGWCXLWHSVIZ-UHFFFAOYSA-N 1 1 298.386 3.984 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1O ZINC000774284337 1122153594 /nfs/dbraw/zinc/15/35/94/1122153594.db2.gz FDUOHGNAMGTGBI-YUMQZZPRSA-N 1 1 292.206 3.509 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c(O)c1 ZINC001204347844 1122177043 /nfs/dbraw/zinc/17/70/43/1122177043.db2.gz MIALCTZDMSJLGG-MRXNPFEDSA-N 1 1 299.389 3.904 20 10 CHCDMO CCc1cccc(C[N@H+]2CCC[C@@H](C3CCC3)C2)c1O ZINC001182959509 1122197436 /nfs/dbraw/zinc/19/74/36/1122197436.db2.gz JBEVUXDDMPLMHB-MRXNPFEDSA-N 1 1 273.420 3.967 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC001183842784 1122241140 /nfs/dbraw/zinc/24/11/40/1122241140.db2.gz FRZYZZGITIIAQR-MJVIPROJSA-N 1 1 265.784 3.571 20 10 CHCDMO CC[C@@H]1CCC[C@H](C[NH2+]Cc2c(O)cccc2F)C1 ZINC001183920347 1122248266 /nfs/dbraw/zinc/24/82/66/1122248266.db2.gz XBHPSYVFIZGSJW-OLZOCXBDSA-N 1 1 265.372 3.837 20 10 CHCDMO CC[C@H]([NH2+]CCc1ccccc1O)c1ccc(F)cc1O ZINC000285958247 1122528751 /nfs/dbraw/zinc/52/87/51/1122528751.db2.gz GMKZMNZIWXLXON-HNNXBMFYSA-N 1 1 289.350 3.520 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC001191085822 1122576649 /nfs/dbraw/zinc/57/66/49/1122576649.db2.gz TWNJBDKKVAYKSF-AEFFLSMTSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)[C@H]2C)ccc1N1CCCCC1 ZINC001194702080 1122789482 /nfs/dbraw/zinc/78/94/82/1122789482.db2.gz OTGQCBLHNGTCGM-HZPDHXFCSA-N 1 1 272.436 3.826 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2CC(C)(C)C)c1 ZINC000775664842 1122875183 /nfs/dbraw/zinc/87/51/83/1122875183.db2.gz BTOMLEIHDIGAAY-AWEZNQCLSA-N 1 1 277.408 3.801 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)C(C2CC2)C2CC2)c1O ZINC000775667199 1122881389 /nfs/dbraw/zinc/88/13/89/1122881389.db2.gz FKERQQIDJTXWCR-UHFFFAOYSA-N 1 1 279.811 3.974 20 10 CHCDMO Cc1cccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC000775701325 1122911956 /nfs/dbraw/zinc/91/19/56/1122911956.db2.gz KICDQJHAJIBREY-YCPHGPKFSA-N 1 1 259.393 3.854 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC001196253383 1122913172 /nfs/dbraw/zinc/91/31/72/1122913172.db2.gz CWDWRRBRRZMSMT-QGZVFWFLSA-N 1 1 272.436 3.765 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c1O ZINC000775702383 1122914537 /nfs/dbraw/zinc/91/45/37/1122914537.db2.gz RZDMJBLKPBJJJA-MNOVXSKESA-N 1 1 285.840 3.680 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000775723512 1122924885 /nfs/dbraw/zinc/92/48/85/1122924885.db2.gz HICQJELAMBRUPG-ZIAGYGMSSA-N 1 1 297.851 3.906 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2[C@H](C)CC[C@@H]2C)c1O ZINC000775737469 1122928278 /nfs/dbraw/zinc/92/82/78/1122928278.db2.gz HVRAGKHXKSBLLE-PHIMTYICSA-N 1 1 253.773 3.727 20 10 CHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccccc1O ZINC000776014050 1123034873 /nfs/dbraw/zinc/03/48/73/1123034873.db2.gz QGVSAHASFPGBQN-JQWIXIFHSA-N 1 1 273.298 3.555 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC=CCC1 ZINC001201428517 1123100289 /nfs/dbraw/zinc/10/02/89/1123100289.db2.gz QMKRMOGOIMPZHI-INIZCTEOSA-N 1 1 272.436 3.931 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCCc1ccco1 ZINC000850407836 1123264235 /nfs/dbraw/zinc/26/42/35/1123264235.db2.gz PTCSPORQDXUKJS-UHFFFAOYSA-N 1 1 283.730 3.500 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccn1 ZINC000850483058 1123274559 /nfs/dbraw/zinc/27/45/59/1123274559.db2.gz ULSRSWJZDWCYCV-NEPJUHHUSA-N 1 1 290.794 3.895 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1ccc(F)cc1O ZINC000850535692 1123286770 /nfs/dbraw/zinc/28/67/70/1123286770.db2.gz ZJKJLVBCAYZLHI-KYOSRNDESA-N 1 1 281.371 3.530 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](CCF)C2)cc1C ZINC000853564653 1123443554 /nfs/dbraw/zinc/44/35/54/1123443554.db2.gz RJHNEKKNZSULDG-AWEZNQCLSA-N 1 1 265.372 3.581 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CC2=CCCOC2)cc1C(C)C ZINC000853561856 1123443781 /nfs/dbraw/zinc/44/37/81/1123443781.db2.gz SUWJFRIDXNWTAH-UHFFFAOYSA-N 1 1 289.419 3.603 20 10 CHCDMO CC(C)CCN1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000895852179 1123522245 /nfs/dbraw/zinc/52/22/45/1123522245.db2.gz QNLWRAVEYIOWRF-HNNXBMFYSA-N 1 1 290.451 3.553 20 10 CHCDMO C/C=C/C[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000858538325 1123659346 /nfs/dbraw/zinc/65/93/46/1123659346.db2.gz UEBUAMSFGSUXCP-RTMURIBGSA-N 1 1 288.160 3.521 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473421 1123813171 /nfs/dbraw/zinc/81/31/71/1123813171.db2.gz PWKZRFMLBUEZBP-OLZOCXBDSA-N 1 1 283.824 3.516 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)Cc2cccs2)c1O ZINC000119995551 1123923766 /nfs/dbraw/zinc/92/37/66/1123923766.db2.gz KYHKNCZGEFAQMK-UHFFFAOYSA-N 1 1 291.416 3.875 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@@H+](CC1CC1)CC1CCC1 ZINC000794711121 1123942116 /nfs/dbraw/zinc/94/21/16/1123942116.db2.gz PMKJTRBAUHWFEY-UHFFFAOYSA-N 1 1 296.414 3.953 20 10 CHCDMO CCCN1CCC([NH2+][C@H](CC)c2ccc(C)cc2O)CC1 ZINC000794789887 1123948876 /nfs/dbraw/zinc/94/88/76/1123948876.db2.gz AVBDMQNRTNNGCQ-QGZVFWFLSA-N 1 1 290.451 3.616 20 10 CHCDMO FC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC000865822440 1124017406 /nfs/dbraw/zinc/01/74/06/1124017406.db2.gz HFENGDIRTSYFJU-INIZCTEOSA-N 1 1 289.325 3.561 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1ccc(F)cc1O ZINC000872108385 1124685252 /nfs/dbraw/zinc/68/52/52/1124685252.db2.gz SPRWTHYPTUZOPN-ONQXIZJVSA-N 1 1 293.382 3.530 20 10 CHCDMO CC(C)OC1(C[NH2+][C@H](C)c2ccc(F)cc2O)CCC1 ZINC000872116596 1124687346 /nfs/dbraw/zinc/68/73/46/1124687346.db2.gz TXDBZYYLDCECIF-GFCCVEGCSA-N 1 1 281.371 3.530 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000124974259 1124828857 /nfs/dbraw/zinc/82/88/57/1124828857.db2.gz JBWLLZJLGZPBRF-KRWDZBQOSA-N 1 1 297.398 3.608 20 10 CHCDMO Cc1ccc(C[N@H+](Cc2ccccn2)C(C)C)c(O)c1 ZINC000876624086 1124966844 /nfs/dbraw/zinc/96/68/44/1124966844.db2.gz FVJYNPUSENBHGC-UHFFFAOYSA-N 1 1 270.376 3.506 20 10 CHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(C)cc2O)C1 ZINC000876756915 1124975282 /nfs/dbraw/zinc/97/52/82/1124975282.db2.gz ACFQWHDDIGNISW-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)cc1O ZINC000877532744 1125040217 /nfs/dbraw/zinc/04/02/17/1125040217.db2.gz WUSYSOSFQQNAPS-MRXNPFEDSA-N 1 1 270.376 3.679 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000877595197 1125052741 /nfs/dbraw/zinc/05/27/41/1125052741.db2.gz UVZHDGNDARDRDN-LBPRGKRZSA-N 1 1 287.325 3.865 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1c(C)noc1C ZINC000883076933 1125370405 /nfs/dbraw/zinc/37/04/05/1125370405.db2.gz RQJKIQROPHLRSF-ZDUSSCGKSA-N 1 1 296.317 3.516 20 10 CHCDMO Cc1ccccc1C1([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000883152567 1125373565 /nfs/dbraw/zinc/37/35/65/1125373565.db2.gz ZVZGUSLCDXNAIU-UHFFFAOYSA-N 1 1 289.325 3.758 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001237934142 1129220686 /nfs/dbraw/zinc/22/06/86/1129220686.db2.gz HSRQAJZWSPUGHD-WDEREUQCSA-N 1 1 283.774 3.807 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001237934142 1129220690 /nfs/dbraw/zinc/22/06/90/1129220690.db2.gz HSRQAJZWSPUGHD-WDEREUQCSA-N 1 1 283.774 3.807 20 10 CHCDMO CC[N@@H+](Cc1c(O)ccc2ccc(OC)cc21)C1CCC1 ZINC000738051597 1129389527 /nfs/dbraw/zinc/38/95/27/1129389527.db2.gz ATRYRHREMPAWHJ-UHFFFAOYSA-N 1 1 285.387 3.928 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CCC=C(c3ccco3)C2)c1O ZINC000795651835 1129408760 /nfs/dbraw/zinc/40/87/60/1129408760.db2.gz SNOUZLGRHSCTQR-UHFFFAOYSA-N 1 1 299.370 3.592 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1cc(C)c(C)cc1O ZINC000092935845 1129412276 /nfs/dbraw/zinc/41/22/76/1129412276.db2.gz 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1129583640 /nfs/dbraw/zinc/58/36/40/1129583640.db2.gz XUMYPDJUDXNSCU-UHFFFAOYSA-N 1 1 266.388 3.813 20 10 CHCDMO CC[N@H+](Cc1c(O)ccc2ccccc21)C[C@H]1CCCO1 ZINC000098051746 1129642586 /nfs/dbraw/zinc/64/25/86/1129642586.db2.gz YANKRJIUYATYGF-OAHLLOKOSA-N 1 1 285.387 3.546 20 10 CHCDMO CC[NH+](CC)c1ccc(N(C)c2ccc(N)cc2)cc1 ZINC001212970988 1129643970 /nfs/dbraw/zinc/64/39/70/1129643970.db2.gz URCGRNHVMARYPF-UHFFFAOYSA-N 1 1 269.392 3.883 20 10 CHCDMO Cc1cc(O)c(CNc2[nH+]c3ccc(F)cc3n2C)cc1C ZINC000766522567 1129682228 /nfs/dbraw/zinc/68/22/28/1129682228.db2.gz ZXHQCUZUCLXJSQ-UHFFFAOYSA-N 1 1 299.349 3.647 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1O ZINC000380325623 1129739569 /nfs/dbraw/zinc/73/95/69/1129739569.db2.gz PMUZFXYLQIISTB-TXEJJXNPSA-N 1 1 295.810 3.676 20 10 CHCDMO CCc1nc(NCc2ccc(N3CCCC3)cc2)cc(C)[nH+]1 ZINC000804348094 1129778049 /nfs/dbraw/zinc/77/80/49/1129778049.db2.gz BKQRGWXQTPDQRL-UHFFFAOYSA-N 1 1 296.418 3.560 20 10 CHCDMO CC(C)c1ccc[nH+]c1NCc1ccc(N(C)C)cc1 ZINC000767292827 1129784748 /nfs/dbraw/zinc/78/47/48/1129784748.db2.gz XWFDVRXYEZOHES-UHFFFAOYSA-N 1 1 269.392 3.883 20 10 CHCDMO C[N@@H+](CCOC(C)(C)C)Cc1c(O)ccc2ccccc21 ZINC000767771939 1129812656 /nfs/dbraw/zinc/81/26/56/1129812656.db2.gz MLQBDJNWTQHKLA-UHFFFAOYSA-N 1 1 287.403 3.792 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccoc2)cc1 ZINC000768207292 1129840423 /nfs/dbraw/zinc/84/04/23/1129840423.db2.gz AUCONSOJDMURIT-UHFFFAOYSA-N 1 1 272.392 3.758 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3sccc3[C@H]2C)c1 ZINC000768206766 1129840841 /nfs/dbraw/zinc/84/08/41/1129840841.db2.gz GJHHDJJTGSDMBH-GFCCVEGCSA-N 1 1 273.401 3.881 20 10 CHCDMO CCOc1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC000768195635 1129841836 /nfs/dbraw/zinc/84/18/36/1129841836.db2.gz PESKWVSBQFCKGE-AWEZNQCLSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000768228404 1129845193 /nfs/dbraw/zinc/84/51/93/1129845193.db2.gz IMJSLKPZVONJPA-MRXNPFEDSA-N 1 1 283.371 3.738 20 10 CHCDMO Cc1ccc2c(C)cc(NCc3ccc(O)c(O)c3)[nH+]c2c1 ZINC001169990289 1129847090 /nfs/dbraw/zinc/84/70/90/1129847090.db2.gz DWODSNFXEAGVLJ-UHFFFAOYSA-N 1 1 294.354 3.875 20 10 CHCDMO CCOc1ccc(C[N@@H+](CCC(C)C)C2CC2)c(O)c1 ZINC000768258796 1129847187 /nfs/dbraw/zinc/84/71/87/1129847187.db2.gz XCSYWMMSLKSGSD-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccsc2)C2CC2)cc1 ZINC000768258215 1129849042 /nfs/dbraw/zinc/84/90/42/1129849042.db2.gz VCMLSXNWGXIRBT-UHFFFAOYSA-N 1 1 286.444 3.979 20 10 CHCDMO CC[N@@H+](Cc1cc(OC)c(C)cc1O)C1CCCCC1 ZINC000768438703 1129856678 /nfs/dbraw/zinc/85/66/78/1129856678.db2.gz XEGJTFOQUSAQKX-UHFFFAOYSA-N 1 1 277.408 3.864 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCc3cc(F)ccc3C2)cc1C ZINC000768482075 1129858224 /nfs/dbraw/zinc/85/82/24/1129858224.db2.gz PQAJODHLEOWLEE-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO CCC1(CC)C[N@@H+](Cc2cccc(C)c2O)CCS1 ZINC000768528362 1129860083 /nfs/dbraw/zinc/86/00/83/1129860083.db2.gz IZAAPOZOVCKXHS-UHFFFAOYSA-N 1 1 279.449 3.808 20 10 CHCDMO CC(C)C[N@@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000768539968 1129860778 /nfs/dbraw/zinc/86/07/78/1129860778.db2.gz XXAJZRGLACUTSG-UHFFFAOYSA-N 1 1 298.224 3.775 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1c(O)cccc1Cl ZINC000768927523 1129881290 /nfs/dbraw/zinc/88/12/90/1129881290.db2.gz WISGHDFWSIUXEB-UHFFFAOYSA-N 1 1 290.794 3.851 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2ccc(F)cc2)cc1 ZINC000768921226 1129881667 /nfs/dbraw/zinc/88/16/67/1129881667.db2.gz PGUYYINVLWOLNK-UHFFFAOYSA-N 1 1 286.394 3.566 20 10 CHCDMO CCC[N@H+](Cc1c(O)cccc1Cl)C[C@@H]1CCCCO1 ZINC000769337644 1129903458 /nfs/dbraw/zinc/90/34/58/1129903458.db2.gz GQRUTMXOBIZAST-ZDUSSCGKSA-N 1 1 297.826 3.827 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000769404166 1129906959 /nfs/dbraw/zinc/90/69/59/1129906959.db2.gz KCPOFQSWTJOMMY-CPUCHLNUSA-N 1 1 289.419 3.944 20 10 CHCDMO CCOc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c(O)c1 ZINC000769403301 1129906984 /nfs/dbraw/zinc/90/69/84/1129906984.db2.gz BUHGTQJVKLJULG-CPUCHLNUSA-N 1 1 289.419 3.944 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c1 ZINC000769426660 1129908118 /nfs/dbraw/zinc/90/81/18/1129908118.db2.gz VTLKCQHWOGSPOW-CYBMUJFWSA-N 1 1 285.362 3.959 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccc(C)cc2)c1O ZINC000769462004 1129911670 /nfs/dbraw/zinc/91/16/70/1129911670.db2.gz FBVRVNSCSBHMMW-HNNXBMFYSA-N 1 1 299.414 3.772 20 10 CHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC000769540458 1129913234 /nfs/dbraw/zinc/91/32/34/1129913234.db2.gz PZPBMULNHSFILF-KUHUBIRLSA-N 1 1 297.398 3.984 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000769497893 1129913633 /nfs/dbraw/zinc/91/36/33/1129913633.db2.gz HBWDNDVRDNFYOZ-UKRRQHHQSA-N 1 1 297.851 3.906 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCSC3(CCCCC3)C2)c1 ZINC000769501687 1129913729 /nfs/dbraw/zinc/91/37/29/1129913729.db2.gz NAZNPBLOVBWSDA-UHFFFAOYSA-N 1 1 291.460 3.952 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000769497432 1129914157 /nfs/dbraw/zinc/91/41/57/1129914157.db2.gz DOGRWRZGNSYTNB-ZFWWWQNUSA-N 1 1 297.851 3.906 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000769542064 1129916557 /nfs/dbraw/zinc/91/65/57/1129916557.db2.gz ZBHKIUAKEUHDQL-SCLBCKFNSA-N 1 1 283.371 3.594 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1 ZINC000770349841 1129946048 /nfs/dbraw/zinc/94/60/48/1129946048.db2.gz NLCKDUGRVIICAC-IFXJQAMLSA-N 1 1 297.398 3.525 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000770509642 1129949305 /nfs/dbraw/zinc/94/93/05/1129949305.db2.gz QAAUFCDWNKHPOW-INIZCTEOSA-N 1 1 271.335 3.868 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](OC)c1ccccc1 ZINC000801925280 1129960156 /nfs/dbraw/zinc/96/01/56/1129960156.db2.gz KSMJBOGVZHMORX-LJQANCHMSA-N 1 1 299.414 3.992 20 10 CHCDMO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886591716 1129974005 /nfs/dbraw/zinc/97/40/05/1129974005.db2.gz ABWWWRCCVCAPCX-SFYZADRCSA-N 1 1 265.250 3.523 20 10 CHCDMO C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)c1c(O)cccc1F ZINC000903156100 1130120724 /nfs/dbraw/zinc/12/07/24/1130120724.db2.gz BTIVIAFDEQYYRM-ODWCKFRGSA-N 1 1 295.423 3.856 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCSC1 ZINC000787091555 1130131115 /nfs/dbraw/zinc/13/11/15/1130131115.db2.gz UBDKFKSDYNRWBB-INIZCTEOSA-N 1 1 292.492 3.716 20 10 CHCDMO Oc1ccccc1C[N@@H+](CC[C@H]1CCCO1)C1CCCC1 ZINC000787244639 1130140106 /nfs/dbraw/zinc/14/01/06/1130140106.db2.gz AOIQOKQDDGFBIM-QGZVFWFLSA-N 1 1 289.419 3.706 20 10 CHCDMO Oc1cccc2c1[C@@H](Nc1cccc(C3CC3)[nH+]1)CC2 ZINC000903269265 1130141811 /nfs/dbraw/zinc/14/18/11/1130141811.db2.gz QZHRSFKZZJWHRV-AWEZNQCLSA-N 1 1 266.344 3.764 20 10 CHCDMO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cc(F)ccc1O ZINC000903313414 1130152861 /nfs/dbraw/zinc/15/28/61/1130152861.db2.gz PNENLUXLBSYWMY-SNVBAGLBSA-N 1 1 292.354 3.668 20 10 CHCDMO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(F)cc1O ZINC000903334809 1130160453 /nfs/dbraw/zinc/16/04/53/1130160453.db2.gz GOZXAJLNKYXCQU-PIGZYNQJSA-N 1 1 286.350 3.728 20 10 CHCDMO Cc1ncccc1CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000903417682 1130173272 /nfs/dbraw/zinc/17/32/72/1130173272.db2.gz FGNQIOAPPVJDSN-LBPRGKRZSA-N 1 1 290.794 3.642 20 10 CHCDMO CCCN1CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000788503790 1130191341 /nfs/dbraw/zinc/19/13/41/1130191341.db2.gz OLNZJDFKXYCMDD-HNNXBMFYSA-N 1 1 290.451 3.534 20 10 CHCDMO CSC1(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CCC1 ZINC000788604525 1130197193 /nfs/dbraw/zinc/19/71/93/1130197193.db2.gz CDJRIRFTOWHXDT-VIFPVBQESA-N 1 1 287.375 3.607 20 10 CHCDMO Cc1ccc(O)c(C[NH2+]CC(F)(F)c2ccccc2)c1 ZINC000788969582 1130220454 /nfs/dbraw/zinc/22/04/54/1130220454.db2.gz KEZWJYJAAUELGW-UHFFFAOYSA-N 1 1 277.314 3.582 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)C1CCC(F)(F)CC1 ZINC001254224899 1130230445 /nfs/dbraw/zinc/23/04/45/1130230445.db2.gz DJYDLJUJVYFAFW-UHFFFAOYSA-N 1 1 269.335 3.792 20 10 CHCDMO CCn1ccc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)c1 ZINC000790452077 1130313678 /nfs/dbraw/zinc/31/36/78/1130313678.db2.gz RULYCYWRBIIWMO-UHFFFAOYSA-N 1 1 294.398 3.999 20 10 CHCDMO COc1cc(C[N@H+]2CCc3cc(C)ccc3C2)c(O)cc1C ZINC000790452004 1130314665 /nfs/dbraw/zinc/31/46/65/1130314665.db2.gz OCNSUJIRPMQFMB-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO CC[N@@H+](Cc1cc2ccccc2[nH]1)Cc1ccccc1O ZINC001137320006 1130345302 /nfs/dbraw/zinc/34/53/02/1130345302.db2.gz UGJTURVFFDHTFK-UHFFFAOYSA-N 1 1 280.371 3.896 20 10 CHCDMO CC[C@H]([NH2+]Cc1csc(C)n1)c1ccc(F)cc1O ZINC000796695083 1130360323 /nfs/dbraw/zinc/36/03/23/1130360323.db2.gz NMARCHQMYBCOSD-ZDUSSCGKSA-N 1 1 280.368 3.537 20 10 CHCDMO C[C@@H]1CCSCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792197403 1130437197 /nfs/dbraw/zinc/43/71/97/1130437197.db2.gz VCUDVRRVCKIPII-SECBINFHSA-N 1 1 289.803 3.512 20 10 CHCDMO C[C@@H]1CCSCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792197403 1130437199 /nfs/dbraw/zinc/43/71/99/1130437199.db2.gz VCUDVRRVCKIPII-SECBINFHSA-N 1 1 289.803 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C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])[C@@H]1C ZINC001237812477 1131143179 /nfs/dbraw/zinc/14/31/79/1131143179.db2.gz HDXKEVIFHKNFRX-NXEZZACHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])[C@@H](C)C1 ZINC001237936596 1131154078 /nfs/dbraw/zinc/15/40/78/1131154078.db2.gz KPBCSRGMOGNYDQ-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2O)[C@@H](C)C1 ZINC001237936596 1131154081 /nfs/dbraw/zinc/15/40/81/1131154081.db2.gz KPBCSRGMOGNYDQ-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2O)[C@@H](C)C1 ZINC001237936596 1131154084 /nfs/dbraw/zinc/15/40/84/1131154084.db2.gz KPBCSRGMOGNYDQ-ZJUUUORDSA-N 1 1 271.763 3.805 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1cncc(Cl)c1Cl ZINC001238015897 1131162193 /nfs/dbraw/zinc/16/21/93/1131162193.db2.gz SRVGBQRDOQBIAS-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cncc(Cl)c1Cl ZINC001238015897 1131162197 /nfs/dbraw/zinc/16/21/97/1131162197.db2.gz 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CO[C@@H]1CCC[N@@H+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143112621 1132504162 /nfs/dbraw/zinc/50/41/62/1132504162.db2.gz XQILYEQJZIETFN-OAHLLOKOSA-N 1 1 291.435 3.691 20 10 CHCDMO CC(C)O[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143111396 1132504264 /nfs/dbraw/zinc/50/42/64/1132504264.db2.gz BMEBYMIMDIGOEE-OAHLLOKOSA-N 1 1 291.435 3.689 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)c1 ZINC001233284358 1132594501 /nfs/dbraw/zinc/59/45/01/1132594501.db2.gz RGOGZTSGITZDOF-WBVHZDCISA-N 1 1 297.389 3.962 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCCOC(C)(C)C2)c1 ZINC001233286192 1132595174 /nfs/dbraw/zinc/59/51/74/1132595174.db2.gz JIQFTSGKIPRQKV-UHFFFAOYSA-N 1 1 291.435 3.691 20 10 CHCDMO CCC[N@@H+](CCOC)Cc1cc(C(C)(C)C)ccc1O ZINC001233283707 1132595386 /nfs/dbraw/zinc/59/53/86/1132595386.db2.gz SAJOHYDKCAAEAZ-UHFFFAOYSA-N 1 1 279.424 3.548 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2c([O-])ccc(F)c2F)c1 ZINC001233331648 1132600774 /nfs/dbraw/zinc/60/07/74/1132600774.db2.gz 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CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203880453 1133378616 /nfs/dbraw/zinc/37/86/16/1133378616.db2.gz SFDQIJLSKGNLPI-INIZCTEOSA-N 1 1 283.371 3.607 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCc3ccccc3C2)cc1 ZINC001203933679 1133386377 /nfs/dbraw/zinc/38/63/77/1133386377.db2.gz DYJAFMAVCWMFLG-UHFFFAOYSA-N 1 1 280.415 3.701 20 10 CHCDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cn1 ZINC001203937873 1133386732 /nfs/dbraw/zinc/38/67/32/1133386732.db2.gz WRTMEIIUOIRNAO-LJQANCHMSA-N 1 1 295.430 3.793 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC001203936050 1133387199 /nfs/dbraw/zinc/38/71/99/1133387199.db2.gz HOVQTGODLDIVED-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO C[C@@H]1CC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233137 1133423205 /nfs/dbraw/zinc/42/32/05/1133423205.db2.gz ODUYHVPWNMDPMB-CYBMUJFWSA-N 1 1 254.377 3.500 20 10 CHCDMO CC[N@@H+](Cc1cc(F)cc(F)c1)Cc1ccccc1O ZINC001204230760 1133423244 /nfs/dbraw/zinc/42/32/44/1133423244.db2.gz MWHRROUEVREFOW-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ccc(O)cc1O ZINC001204278068 1133426603 /nfs/dbraw/zinc/42/66/03/1133426603.db2.gz RRCIADIOQLIWDU-UHFFFAOYSA-N 1 1 285.387 3.737 20 10 CHCDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1O ZINC001204273038 1133426693 /nfs/dbraw/zinc/42/66/93/1133426693.db2.gz JWYFCNSLAKCZAL-KRWDZBQOSA-N 1 1 283.371 3.743 20 10 CHCDMO C[N@@H+](Cc1ccc(O)cc1O)C(C)(C)Cc1ccccc1 ZINC001204279958 1133426854 /nfs/dbraw/zinc/42/68/54/1133426854.db2.gz GLGWPUXXWZUMMP-UHFFFAOYSA-N 1 1 285.387 3.551 20 10 CHCDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(C)cc1O ZINC001204348032 1133438186 /nfs/dbraw/zinc/43/81/86/1133438186.db2.gz NPRZNCRGFNSRKY-ZDUSSCGKSA-N 1 1 267.438 3.664 20 10 CHCDMO CCc1cccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC001205070816 1133524140 /nfs/dbraw/zinc/52/41/40/1133524140.db2.gz ZJLLSOLSAMGCTJ-UHFFFAOYSA-N 1 1 291.341 3.865 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001205148278 1133537548 /nfs/dbraw/zinc/53/75/48/1133537548.db2.gz GGTRXWJLJADWOR-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001205489425 1133582468 /nfs/dbraw/zinc/58/24/68/1133582468.db2.gz QGWQXIDOALEZCZ-XDWWLABZSA-N 1 1 272.436 3.886 20 10 CHCDMO CC(C)C[N@@H+](Cc1ccccc1)Cc1ccc(N)cc1 ZINC001205925576 1133631519 /nfs/dbraw/zinc/63/15/19/1133631519.db2.gz WTLLEDLOQIOVQT-UHFFFAOYSA-N 1 1 268.404 3.927 20 10 CHCDMO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C(C)(C)C ZINC001205998160 1133640159 /nfs/dbraw/zinc/64/01/59/1133640159.db2.gz JTTXSGLFDFIATK-HJWRWDBZSA-N 1 1 260.425 3.886 20 10 CHCDMO CC(C)c1ccc(O)c(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC001207439133 1133802631 /nfs/dbraw/zinc/80/26/31/1133802631.db2.gz AVFHDOPEPUQINH-UHFFFAOYSA-N 1 1 296.823 3.915 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]Cc1coc2ccccc12 ZINC001207622203 1133831609 /nfs/dbraw/zinc/83/16/09/1133831609.db2.gz LRULGVKIUKRYQB-UHFFFAOYSA-N 1 1 271.291 3.567 20 10 CHCDMO CC1=C[C@@H](C)[C@H](C[N@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184008 1133900888 /nfs/dbraw/zinc/90/08/88/1133900888.db2.gz ZMQNCEMLDDXNEK-ZBFHGGJFSA-N 1 1 271.404 3.743 20 10 CHCDMO C[N@@H+](CCCCOCc1ccccc1)Cc1ccccc1O ZINC001209265460 1133997648 /nfs/dbraw/zinc/99/76/48/1133997648.db2.gz RJNUKQOZBQTATM-UHFFFAOYSA-N 1 1 299.414 3.821 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1 ZINC001209516203 1134032313 /nfs/dbraw/zinc/03/23/13/1134032313.db2.gz CPJUGMZBYUBPQS-WDSOQIARSA-N 1 1 298.405 3.884 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@H+](C)[C@H]2CCCOC2)cc1 ZINC001209520283 1134034127 /nfs/dbraw/zinc/03/41/27/1134034127.db2.gz UIVREQOCACGFHY-IBGZPJMESA-N 1 1 298.430 3.705 20 10 CHCDMO CC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccccc1O ZINC000186100807 262079876 /nfs/dbraw/zinc/07/98/76/262079876.db2.gz OOUXEBMOQBYVMV-KRWDZBQOSA-N 1 1 290.451 3.553 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2cccc(F)c2O)s1 ZINC000272270659 263002882 /nfs/dbraw/zinc/00/28/82/263002882.db2.gz LGSGIVUSYBUYLG-UHFFFAOYSA-N 1 1 265.353 3.533 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cccc(F)c2O)s1 ZINC000272270659 263002883 /nfs/dbraw/zinc/00/28/83/263002883.db2.gz LGSGIVUSYBUYLG-UHFFFAOYSA-N 1 1 265.353 3.533 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289890297 263112685 /nfs/dbraw/zinc/11/26/85/263112685.db2.gz SVKJOOKYTFWFMT-HNNXBMFYSA-N 1 1 288.778 3.778 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000527926133 330296632 /nfs/dbraw/zinc/29/66/32/330296632.db2.gz OZQZIESUIRKGIC-NEPJUHHUSA-N 1 1 283.799 3.513 20 10 CHCDMO CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)cc2O)CCO1 ZINC000273354415 519279797 /nfs/dbraw/zinc/27/97/97/519279797.db2.gz CHUHSRZFOXEGLI-BPLDGKMQSA-N 1 1 295.398 3.776 20 10 CHCDMO CCC[N@@H+](CCc1ccccn1)Cc1cc(C)ccc1O ZINC000289835385 521673151 /nfs/dbraw/zinc/67/31/51/521673151.db2.gz OZNSUDWINSMDJH-UHFFFAOYSA-N 1 1 284.403 3.550 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000278392075 522180130 /nfs/dbraw/zinc/18/01/30/522180130.db2.gz MXLZRJLDPPCMEX-ZDUSSCGKSA-N 1 1 286.341 3.527 20 10 CHCDMO CCc1nc(C)c(C[NH2+][C@H](CC)c2ccc(F)cc2O)o1 ZINC000291888914 522212235 /nfs/dbraw/zinc/21/22/35/522212235.db2.gz KKUKIKNJBBXZJZ-CYBMUJFWSA-N 1 1 292.354 3.631 20 10 CHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000290488838 522968432 /nfs/dbraw/zinc/96/84/32/522968432.db2.gz OMTGQLULWYBLJN-QGZVFWFLSA-N 1 1 284.403 3.987 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc(C)c1O ZINC000290478309 523119612 /nfs/dbraw/zinc/11/96/12/523119612.db2.gz NYDRXSFBMZJPEA-INIZCTEOSA-N 1 1 270.376 3.679 20 10 CHCDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1O ZINC000280888823 523553157 /nfs/dbraw/zinc/55/31/57/523553157.db2.gz DEBLYLWUXRSTEG-INIZCTEOSA-N 1 1 299.418 3.644 20 10 CHCDMO Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062745061 524439319 /nfs/dbraw/zinc/43/93/19/524439319.db2.gz KQNXFGRHZVHRFW-GFCCVEGCSA-N 1 1 259.324 3.691 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccco2)cc1C ZINC000131068806 525311997 /nfs/dbraw/zinc/31/19/97/525311997.db2.gz CPCZWYUFRLRKAW-ZDUSSCGKSA-N 1 1 259.349 3.795 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1 ZINC000366545599 525340722 /nfs/dbraw/zinc/34/07/22/525340722.db2.gz QQMLQBRAFCULIQ-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@H](C)O)c1cc(Cl)c(Cl)cc1O ZINC000278973357 525441727 /nfs/dbraw/zinc/44/17/27/525441727.db2.gz CGPHPSMKYHZUPZ-DTWKUNHWSA-N 1 1 292.206 3.511 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(F)cc1O ZINC000281109018 525499517 /nfs/dbraw/zinc/49/95/17/525499517.db2.gz LRCVRDUGFOYXHH-ZJUUUORDSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000062744686 525531440 /nfs/dbraw/zinc/53/14/40/525531440.db2.gz WUQYACQROYVIBZ-RYUDHWBXSA-N 1 1 259.324 3.943 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278366490 526362794 /nfs/dbraw/zinc/36/27/94/526362794.db2.gz KCTUURRCRVTJJJ-VIFPVBQESA-N 1 1 293.716 3.820 20 10 CHCDMO C[N@@H+](Cc1ccsc1)Cc1cc(Cl)ccc1O ZINC000120469152 1117917582 /nfs/dbraw/zinc/91/75/82/1117917582.db2.gz QLCJEDWHNDKVLS-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@](C)(F)CC2)c1O ZINC001140178713 1131673452 /nfs/dbraw/zinc/67/34/52/1131673452.db2.gz VGCDVYAWRDNDPE-MRXNPFEDSA-N 1 1 265.372 3.723 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC3(CCC3)C2)cc1Cl ZINC001231870659 1132384677 /nfs/dbraw/zinc/38/46/77/1132384677.db2.gz MSBCUIWKICAMLZ-UHFFFAOYSA-N 1 1 265.784 3.730 20 10 CHCDMO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000282909598 1125532987 /nfs/dbraw/zinc/53/29/87/1125532987.db2.gz XGIQMFXRZAPAAC-SNVBAGLBSA-N 1 1 294.757 3.739 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000884482664 1125568364 /nfs/dbraw/zinc/56/83/64/1125568364.db2.gz GEDKAKKDTFRYBR-DNVCBOLYSA-N 1 1 297.398 3.546 20 10 CHCDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000215913093 1125581806 /nfs/dbraw/zinc/58/18/06/1125581806.db2.gz RTJSAYHLGJUQRV-UHFFFAOYSA-N 1 1 298.430 3.783 20 10 CHCDMO Cc1cccnc1CC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841757972 1125597602 /nfs/dbraw/zinc/59/76/02/1125597602.db2.gz QKZLIAUSORHJGI-GFCCVEGCSA-N 1 1 290.794 3.642 20 10 CHCDMO CC(C)C(C)(C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000219274455 1125675610 /nfs/dbraw/zinc/67/56/10/1125675610.db2.gz BCLKBAUGKIMSFP-NSHDSACASA-N 1 1 253.361 3.864 20 10 CHCDMO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886491743 1125680322 /nfs/dbraw/zinc/68/03/22/1125680322.db2.gz OPANHAUOGGXUJG-NWDGAFQWSA-N 1 1 289.350 3.952 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)s1 ZINC000886505217 1125681486 /nfs/dbraw/zinc/68/14/86/1125681486.db2.gz QJECUMQPOQRSBG-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886526543 1125684352 /nfs/dbraw/zinc/68/43/52/1125684352.db2.gz NQMPQDODLARULH-DTWKUNHWSA-N 1 1 278.327 3.548 20 10 CHCDMO COc1cc(C)ccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886539292 1125687040 /nfs/dbraw/zinc/68/70/40/1125687040.db2.gz XNTGSGBHKVHVFA-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886554859 1125689966 /nfs/dbraw/zinc/68/99/66/1125689966.db2.gz FBPIZHBJABQGCU-ZJUUUORDSA-N 1 1 292.354 3.590 20 10 CHCDMO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886554856 1125690095 /nfs/dbraw/zinc/69/00/95/1125690095.db2.gz FBPIZHBJABQGCU-NXEZZACHSA-N 1 1 292.354 3.590 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1c(O)cccc1F ZINC000886605768 1125696406 /nfs/dbraw/zinc/69/64/06/1125696406.db2.gz YDPADUFDGCQDGM-ZJUUUORDSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886619001 1125699427 /nfs/dbraw/zinc/69/94/27/1125699427.db2.gz QGUFZULEAZETFH-CHWSQXEVSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1c(O)cccc1F ZINC000886638683 1125700329 /nfs/dbraw/zinc/70/03/29/1125700329.db2.gz ZPUMHDVHMQSFBF-ZUZCIYMTSA-N 1 1 287.334 3.575 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1c(O)cccc1F ZINC000886732587 1125714207 /nfs/dbraw/zinc/71/42/07/1125714207.db2.gz KQMMFUDFFKNFGQ-STQMWFEESA-N 1 1 293.382 3.531 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)c1O ZINC000252854566 1129598632 /nfs/dbraw/zinc/59/86/32/1129598632.db2.gz KUUJYUUAPIHUAC-GHMZBOCLSA-N 1 1 283.799 3.532 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000768338011 1129851709 /nfs/dbraw/zinc/85/17/09/1129851709.db2.gz KTTRGPBLWQSLLM-HNNXBMFYSA-N 1 1 260.425 3.907 20 10 CHCDMO Cc1cccc(CNc2cccc3cc[nH+]cc32)c1O ZINC000159736827 1126752434 /nfs/dbraw/zinc/75/24/34/1126752434.db2.gz FWMCVJFGOXDJEH-UHFFFAOYSA-N 1 1 264.328 3.861 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)CCSC)c1ccc(F)cc1O ZINC000796770619 1130930814 /nfs/dbraw/zinc/93/08/14/1130930814.db2.gz DWMPDHNVEDXTAI-GXFFZTMASA-N 1 1 271.401 3.714 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1c(O)cc(OC)cc1Cl ZINC001236804788 1131011668 /nfs/dbraw/zinc/01/16/68/1131011668.db2.gz ZOEMREZFGWCKAV-LLVKDONJSA-N 1 1 283.799 3.819 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@H]2C)c(Cl)c1 ZINC001236798218 1131008105 /nfs/dbraw/zinc/00/81/05/1131008105.db2.gz DFJRQULRTXIYCS-GHMZBOCLSA-N 1 1 283.799 3.675 20 10 CHCDMO Cc1cc(Br)cc(C[N@@H+]2CCC=C(C)C2)c1O ZINC000798090576 1131024590 /nfs/dbraw/zinc/02/45/90/1131024590.db2.gz QPUVUZUIVTYQDI-UHFFFAOYSA-N 1 1 296.208 3.615 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccc(F)cc1)c1ccc(F)cc1O ZINC000285726254 1127241777 /nfs/dbraw/zinc/24/17/77/1127241777.db2.gz QJXXALWMJLBLDL-HNNXBMFYSA-N 1 1 277.314 3.911 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000286166526 1127261956 /nfs/dbraw/zinc/26/19/56/1127261956.db2.gz PQEXDFHJZTXYSB-JSGCOSHPSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(F)ccc1O ZINC000226565435 1127411419 /nfs/dbraw/zinc/41/14/19/1127411419.db2.gz JHVBRHNUDHHQGY-CQSZACIVSA-N 1 1 251.345 3.686 20 10 CHCDMO C[C@H](c1ccncc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293711171 1127514256 /nfs/dbraw/zinc/51/42/56/1127514256.db2.gz UTHMNVBWSPYSBN-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293711171 1127514258 /nfs/dbraw/zinc/51/42/58/1127514258.db2.gz UTHMNVBWSPYSBN-SNVBAGLBSA-N 1 1 294.757 3.773 20 10 CHCDMO Cc1cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)ccc1N(C)C ZINC000293700782 1127513520 /nfs/dbraw/zinc/51/35/20/1127513520.db2.gz XDISFGPGSDMVPG-CVEARBPZSA-N 1 1 294.389 3.538 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](CC(C)C)C2CC2)c1O ZINC000761191853 1127517195 /nfs/dbraw/zinc/51/71/95/1127517195.db2.gz CZMQVKVSEBVJFL-UHFFFAOYSA-N 1 1 283.799 3.675 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121206 1127650525 /nfs/dbraw/zinc/65/05/25/1127650525.db2.gz WEZAQJGVAMVYNT-GXFFZTMASA-N 1 1 283.799 3.817 20 10 CHCDMO CCC(CC)[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)N(C)C ZINC000062745411 1127773111 /nfs/dbraw/zinc/77/31/11/1127773111.db2.gz LKEZYHLUGSIEKX-LRDDRELGSA-N 1 1 296.430 3.548 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1O ZINC000230929805 1127784485 /nfs/dbraw/zinc/78/44/85/1127784485.db2.gz SKMCTMWNNIIWDB-FZMZJTMJSA-N 1 1 295.810 3.819 20 10 CHCDMO CCC[N@@H+](CC[C@H]1CCCCO1)Cc1ccccc1O ZINC000754051451 1128179520 /nfs/dbraw/zinc/17/95/20/1128179520.db2.gz ULNHFTJGCKLLDG-MRXNPFEDSA-N 1 1 277.408 3.563 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCS[C@@H](C)C1)c1ccc(F)cc1O ZINC000927029484 1128209385 /nfs/dbraw/zinc/20/93/85/1128209385.db2.gz PJVLWADXOLOQOL-SUHUHFCYSA-N 1 1 283.412 3.856 20 10 CHCDMO CC(C)CC[N@@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000914566594 1128210991 /nfs/dbraw/zinc/21/09/91/1128210991.db2.gz CKDWLLPJWDLSFX-UHFFFAOYSA-N 1 1 273.420 3.891 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c1 ZINC000762140244 1128273335 /nfs/dbraw/zinc/27/33/35/1128273335.db2.gz TZBPPGAWULOVNV-AWEZNQCLSA-N 1 1 259.393 3.774 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)c2ccccc2n1C ZINC001138252517 1128281839 /nfs/dbraw/zinc/28/18/39/1128281839.db2.gz JOOODJRMUHIUGG-SJORKVTESA-N 1 1 292.373 3.759 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000754730506 1128299958 /nfs/dbraw/zinc/29/99/58/1128299958.db2.gz QUMXWCJUWLGSNU-GFCCVEGCSA-N 1 1 277.408 3.540 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](C(C)C)C2)cc1C(C)C ZINC000777969209 1128352128 /nfs/dbraw/zinc/35/21/28/1128352128.db2.gz OREVNBALUSUXHE-SFHVURJKSA-N 1 1 291.435 3.681 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H]1F ZINC000777967751 1128352164 /nfs/dbraw/zinc/35/21/64/1128352164.db2.gz ZAMAMLSNMCDXTO-SMDDNHRTSA-N 1 1 295.398 3.575 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](C4CC4)C3)c2c1 ZINC000763330281 1128392502 /nfs/dbraw/zinc/39/25/02/1128392502.db2.gz CGFXEVZJZVTYEO-HNNXBMFYSA-N 1 1 297.398 3.786 20 10 CHCDMO Cc1ccc(C)c(C[N@H+](C)Cc2cc(C)ccc2O)c1 ZINC000763382580 1128429855 /nfs/dbraw/zinc/42/98/55/1128429855.db2.gz XVSXZFZCUSSXGH-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO CC(C)[N@@H+](C/C=C/Cl)Cc1ccc(N(C)C)cc1 ZINC000917075032 1128474635 /nfs/dbraw/zinc/47/46/35/1128474635.db2.gz OWUKENIXAKNXNJ-BJMVGYQFSA-N 1 1 266.816 3.716 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1O ZINC000042774010 1128584941 /nfs/dbraw/zinc/58/49/41/1128584941.db2.gz MXCNCHCRAOWKEP-NSHDSACASA-N 1 1 281.371 3.600 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)C(C)(C)C)c1O ZINC000042774010 1128584945 /nfs/dbraw/zinc/58/49/45/1128584945.db2.gz MXCNCHCRAOWKEP-NSHDSACASA-N 1 1 281.371 3.600 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@H]1CCCO1 ZINC000919945651 1128652538 /nfs/dbraw/zinc/65/25/38/1128652538.db2.gz OMHKYUQEUMVQNH-MRXNPFEDSA-N 1 1 291.435 3.825 20 10 CHCDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000779019099 1128683190 /nfs/dbraw/zinc/68/31/90/1128683190.db2.gz DSLXUECPAYBSNP-RYUDHWBXSA-N 1 1 251.345 3.542 20 10 CHCDMO CC[C@@]1(C)CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000779019863 1128683293 /nfs/dbraw/zinc/68/32/93/1128683293.db2.gz IYQUAMUGJPOUQG-HNNXBMFYSA-N 1 1 251.345 3.543 20 10 CHCDMO COc1cccc(Cl)c1C[N@H+](C)Cc1ccccc1O ZINC000091956606 1117861732 /nfs/dbraw/zinc/86/17/32/1117861732.db2.gz NEFWVJYUICNQAR-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO COc1cccc(Cl)c1C[N@@H+](C)Cc1ccccc1O ZINC000091956606 1117861734 /nfs/dbraw/zinc/86/17/34/1117861734.db2.gz NEFWVJYUICNQAR-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[C@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccc(F)cc1O ZINC000185828860 1117913943 /nfs/dbraw/zinc/91/39/43/1117913943.db2.gz OVALGMWJBABYKU-BLLLJJGKSA-N 1 1 295.398 3.513 20 10 CHCDMO CC(C)[N@@H+](Cc1cccc(Br)c1[O-])C1CC1 ZINC000179485215 1128744240 /nfs/dbraw/zinc/74/42/40/1128744240.db2.gz KWASFGGNGDYLGA-UHFFFAOYSA-N 1 1 284.197 3.528 20 10 CHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)Oc1ccccc1 ZINC000186040801 1117974579 /nfs/dbraw/zinc/97/45/79/1117974579.db2.gz FTCDHGUPITYGAP-STQMWFEESA-N 1 1 289.350 3.649 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)c1 ZINC000179682274 1128753917 /nfs/dbraw/zinc/75/39/17/1128753917.db2.gz OOUFZBOSMGUTBW-AWEZNQCLSA-N 1 1 285.387 3.902 20 10 CHCDMO Cc1cccc(C[N@H+](Cc2ccc(C#N)cc2)C(C)C)c1O ZINC000179696053 1128754266 /nfs/dbraw/zinc/75/42/66/1128754266.db2.gz DNWHWBMGKLSRQO-UHFFFAOYSA-N 1 1 294.398 3.983 20 10 CHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098294 1118135022 /nfs/dbraw/zinc/13/50/22/1118135022.db2.gz GITHWOWKYGYYHN-KGLIPLIRSA-N 1 1 291.435 3.607 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140178852 1118245449 /nfs/dbraw/zinc/24/54/49/1118245449.db2.gz AARWSWUCWFACPV-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)N[C@H](C)C[NH+](CC)CC)cc1 ZINC000765765572 1118267988 /nfs/dbraw/zinc/26/79/88/1118267988.db2.gz GWVDUNGJCPIVRN-HZPDHXFCSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H]([NH2+]CCOc1ccccc1)c1ccc(F)cc1O ZINC000796673482 1118321826 /nfs/dbraw/zinc/32/18/26/1118321826.db2.gz QVGMQVSWUNKFAG-INIZCTEOSA-N 1 1 289.350 3.651 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])CC1(C)C ZINC001659369529 1118480054 /nfs/dbraw/zinc/48/00/54/1118480054.db2.gz JQKCLKOYIUTHIH-LLVKDONJSA-N 1 1 267.800 3.914 20 10 CHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000180250129 1128783221 /nfs/dbraw/zinc/78/32/21/1128783221.db2.gz XKEFECGUDUDGFX-ZIAGYGMSSA-N 1 1 283.412 3.637 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccccc2F)c1O ZINC000160728014 1118533584 /nfs/dbraw/zinc/53/35/84/1118533584.db2.gz GGDYBVUKVZDOIV-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO Cc1cccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1O ZINC000180456004 1128792286 /nfs/dbraw/zinc/79/22/86/1128792286.db2.gz XKCNQXUDHWUOIO-QGZVFWFLSA-N 1 1 289.419 3.624 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1O ZINC000782275829 1118735792 /nfs/dbraw/zinc/73/57/92/1118735792.db2.gz IUEHUMKOSNNATG-IMJJTQAJSA-N 1 1 289.419 3.720 20 10 CHCDMO Cc1cc(C[N@H+]2CCS[C@H](C(C)C)C2)ccc1N(C)C ZINC001167495437 1118853495 /nfs/dbraw/zinc/85/34/95/1118853495.db2.gz FHFAFEPJOZKRES-KRWDZBQOSA-N 1 1 292.492 3.634 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)C1CCC1)c1ccc(F)cc1O ZINC000796845604 1119211645 /nfs/dbraw/zinc/21/16/45/1119211645.db2.gz BRYKVRFEHADYPX-HZMBPMFUSA-N 1 1 251.345 3.761 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C(C)C)C2CC2)c1O ZINC000177016850 1119693989 /nfs/dbraw/zinc/69/39/89/1119693989.db2.gz GTIHMNPCURFFCC-UHFFFAOYSA-N 1 1 281.783 3.621 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C(C)C)C2CC2)c1O ZINC000177016850 1119693990 /nfs/dbraw/zinc/69/39/90/1119693990.db2.gz GTIHMNPCURFFCC-UHFFFAOYSA-N 1 1 281.783 3.621 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000179557359 1119751886 /nfs/dbraw/zinc/75/18/86/1119751886.db2.gz CQJYBRKSIAWKCI-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO COc1cc(C[N@@H+]2CC=C(C)CC2)c(O)c(C(C)(C)C)c1 ZINC000755769332 1119765096 /nfs/dbraw/zinc/76/50/96/1119765096.db2.gz CQRSOOBGLKINJQ-UHFFFAOYSA-N 1 1 289.419 3.850 20 10 CHCDMO CCCC[N@@H+](Cc1cc(C)ccn1)Cc1ccccc1O ZINC000801594764 1128892132 /nfs/dbraw/zinc/89/21/32/1128892132.db2.gz NUZXLRGAAOVTGC-UHFFFAOYSA-N 1 1 284.403 3.898 20 10 CHCDMO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1O ZINC001140950765 1120136151 /nfs/dbraw/zinc/13/61/51/1120136151.db2.gz HEDSEPRASBPAFY-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000180443367 1120275689 /nfs/dbraw/zinc/27/56/89/1120275689.db2.gz OKPFWYRNUGWYSC-CRAIPNDOSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)c1 ZINC000181014298 1120286786 /nfs/dbraw/zinc/28/67/86/1120286786.db2.gz GAEJPFYVVCOSPC-UHFFFAOYSA-N 1 1 295.304 3.750 20 10 CHCDMO CCOC1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CCCC1 ZINC000312443219 1120424806 /nfs/dbraw/zinc/42/48/06/1120424806.db2.gz USDAFBCKRFTIRK-LBPRGKRZSA-N 1 1 281.371 3.531 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(F)cc2F)c1O ZINC000775649061 1120449583 /nfs/dbraw/zinc/44/95/83/1120449583.db2.gz ZOSTYYTXIKVHII-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H](C)C1CC1)c1ccc(F)cc1O ZINC000796722054 1120674827 /nfs/dbraw/zinc/67/48/27/1120674827.db2.gz YQOVJYFESUCGMM-YGRLFVJLSA-N 1 1 251.345 3.618 20 10 CHCDMO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N(C)C)c(C)c2)C1 ZINC001117704620 1120677092 /nfs/dbraw/zinc/67/70/92/1120677092.db2.gz ICNAVIMRTDDWOK-JKSUJKDBSA-N 1 1 292.492 3.777 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C#N)c(F)c1)Cc1ccccc1O ZINC000192049455 1128968154 /nfs/dbraw/zinc/96/81/54/1128968154.db2.gz PPBBCHUHZXTUBX-UHFFFAOYSA-N 1 1 298.361 3.815 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](CC(C)C)N(C)C)c1ccc(F)cc1O ZINC000796686543 1121216437 /nfs/dbraw/zinc/21/64/37/1121216437.db2.gz YXEBGYAKFJXPFV-HOCLYGCPSA-N 1 1 296.430 3.548 20 10 CHCDMO CCn1c2cc(F)ccc2[nH+]c1NCc1cc(C)ccc1O ZINC000766106790 1121261056 /nfs/dbraw/zinc/26/10/56/1121261056.db2.gz HQZDYZPXYRGAOY-UHFFFAOYSA-N 1 1 299.349 3.821 20 10 CHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(Br)ccc1O ZINC000706497663 1121431994 /nfs/dbraw/zinc/43/19/94/1121431994.db2.gz DPZQPZLIWWJVKR-AOOOYVTPSA-N 1 1 284.197 3.528 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCCCCCCC1 ZINC001137839874 1121441893 /nfs/dbraw/zinc/44/18/93/1121441893.db2.gz NHHHHLIJGCFTKA-UHFFFAOYSA-N 1 1 251.345 3.688 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](c3ccco3)C2)cc1 ZINC000773757264 1121799706 /nfs/dbraw/zinc/79/97/06/1121799706.db2.gz NVTMZDUTBSWYFA-MRXNPFEDSA-N 1 1 284.403 3.725 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](CC)CCc2ccccn2)cc1 ZINC000773775321 1121820008 /nfs/dbraw/zinc/82/00/08/1121820008.db2.gz HERLWPYTOHYFKY-UHFFFAOYSA-N 1 1 297.446 3.602 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)CCSC)cc1 ZINC000773772911 1121823105 /nfs/dbraw/zinc/82/31/05/1121823105.db2.gz MCCFPWGVTQZWNJ-CQSZACIVSA-N 1 1 280.481 3.716 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)c3ccccc23)CCCO1 ZINC001204232645 1121828997 /nfs/dbraw/zinc/82/89/97/1121828997.db2.gz HKCFTSQUYGPYHZ-HNNXBMFYSA-N 1 1 298.430 3.517 20 10 CHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000730819219 1121830050 /nfs/dbraw/zinc/83/00/50/1121830050.db2.gz QQOOLRRRSALLIA-UHFFFAOYSA-N 1 1 287.407 3.591 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)c3ccccc23)[C@H](C)CO1 ZINC001204240068 1121861119 /nfs/dbraw/zinc/86/11/19/1121861119.db2.gz HEPXDGXAIDIVHG-HUUCEWRRSA-N 1 1 298.430 3.515 20 10 CHCDMO CC(C)[N@@H+](Cc1cc(F)c(N(C)C)cc1F)C1CCC1 ZINC001179898624 1121919238 /nfs/dbraw/zinc/91/92/38/1121919238.db2.gz QSBZOMPFQPKVBM-UHFFFAOYSA-N 1 1 282.378 3.794 20 10 CHCDMO C[C@H]1CCC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001180030807 1121938780 /nfs/dbraw/zinc/93/87/80/1121938780.db2.gz PXPDJNDDNWTKFV-WRLNGNIRSA-N 1 1 272.436 3.888 20 10 CHCDMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC001180136553 1121950688 /nfs/dbraw/zinc/95/06/88/1121950688.db2.gz GHUAVVXZXPFPBK-HNNXBMFYSA-N 1 1 265.372 3.932 20 10 CHCDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(C)s2)c(O)c1 ZINC001180212511 1121961727 /nfs/dbraw/zinc/96/17/27/1121961727.db2.gz BXAPAMPXNJBVMW-UHFFFAOYSA-N 1 1 291.416 3.711 20 10 CHCDMO CC(C)[C@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816552844 1122028566 /nfs/dbraw/zinc/02/85/66/1122028566.db2.gz ZBDZOKLQZOYQIB-SECBINFHSA-N 1 1 259.752 3.566 20 10 CHCDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc(Cl)cc1O ZINC001181102184 1122033575 /nfs/dbraw/zinc/03/35/75/1122033575.db2.gz JNAVLPFLUDFZJQ-MFKMUULPSA-N 1 1 253.773 3.666 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)cc1O ZINC001181543951 1122061555 /nfs/dbraw/zinc/06/15/55/1122061555.db2.gz IYRNOBWGQURMGT-GXFFZTMASA-N 1 1 253.773 3.809 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCc1ccc(F)c(F)c1)C2 ZINC001183454960 1122223512 /nfs/dbraw/zinc/22/35/12/1122223512.db2.gz PTYSHUHXNIHINZ-UHFFFAOYSA-N 1 1 289.325 3.619 20 10 CHCDMO COc1cc(C)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(O)c1 ZINC001183673124 1122233852 /nfs/dbraw/zinc/23/38/52/1122233852.db2.gz PCFCUARBBAASPJ-CQSZACIVSA-N 1 1 297.398 3.829 20 10 CHCDMO Cc1cccc(C)c1C[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001184035536 1122252833 /nfs/dbraw/zinc/25/28/33/1122252833.db2.gz PBFMIQMTNQOOSP-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1cccc(C)c1C[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001184035536 1122252836 /nfs/dbraw/zinc/25/28/36/1122252836.db2.gz PBFMIQMTNQOOSP-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO CCn1c2ccc(C)cc2[nH+]c1NCc1ccc(C)cc1O ZINC001184461963 1122278395 /nfs/dbraw/zinc/27/83/95/1122278395.db2.gz HGVUSMNORUQDPI-UHFFFAOYSA-N 1 1 295.386 3.991 20 10 CHCDMO C[C@H]([NH2+]CCCF)c1cc(Cl)c(Cl)cc1O ZINC000193027955 1129051597 /nfs/dbraw/zinc/05/15/97/1129051597.db2.gz HOBGZINUEXQETO-ZETCQYMHSA-N 1 1 266.143 3.709 20 10 CHCDMO Cc1ccc(F)c(C[N@@H+](C)Cc2cc(F)ccc2O)c1 ZINC000775166864 1122464565 /nfs/dbraw/zinc/46/45/65/1122464565.db2.gz BUPYQKIAPWAENA-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CCC2CCC2)C2CC2)cc1 ZINC001190445370 1122535929 /nfs/dbraw/zinc/53/59/29/1122535929.db2.gz GTFVEDINJMRUGA-UHFFFAOYSA-N 1 1 272.436 3.907 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@H](SC)C2)c1 ZINC000092064249 1122839372 /nfs/dbraw/zinc/83/93/72/1122839372.db2.gz XZPMMFMWNAFUPM-HNNXBMFYSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2C)c1O ZINC000775639254 1122844077 /nfs/dbraw/zinc/84/40/77/1122844077.db2.gz RIQKRZJLUZXCID-LLVKDONJSA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1cccc(C[N@@H+](C)Cc2ccccc2C)c1O ZINC000775641521 1122851255 /nfs/dbraw/zinc/85/12/55/1122851255.db2.gz BYFIJVZAKAAZOW-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3sccc3[C@@H]2C)c1O ZINC000775646015 1122856750 /nfs/dbraw/zinc/85/67/50/1122856750.db2.gz FEAHBRNYLAOVHG-LBPRGKRZSA-N 1 1 273.401 3.881 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1O ZINC000775661064 1122876178 /nfs/dbraw/zinc/87/61/78/1122876178.db2.gz ICPOPECHKCBYEK-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](CCCO)CC(C)(C)C)c1O ZINC000775681786 1122902053 /nfs/dbraw/zinc/90/20/53/1122902053.db2.gz SPKZOUBQONMAAI-UHFFFAOYSA-N 1 1 299.842 3.585 20 10 CHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000775723507 1122924951 /nfs/dbraw/zinc/92/49/51/1122924951.db2.gz HICQJELAMBRUPG-KGLIPLIRSA-N 1 1 297.851 3.906 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C3CC3)C2)c1O ZINC000775726351 1122926677 /nfs/dbraw/zinc/92/66/77/1122926677.db2.gz QVXBVPBCXDHBJT-GFCCVEGCSA-N 1 1 265.784 3.586 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3c(F)cc(F)cc3C2)c1O ZINC000775734077 1122926944 /nfs/dbraw/zinc/92/69/44/1122926944.db2.gz KJTPNZHKUQQDGL-UHFFFAOYSA-N 1 1 289.325 3.537 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2C2CCCCC2)cc1O ZINC001203880460 1122959988 /nfs/dbraw/zinc/95/99/88/1122959988.db2.gz SKTBQIZBGDXMPE-OAHLLOKOSA-N 1 1 275.392 3.643 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+]2CCCC2(C)C)c1O ZINC000160966368 1123018455 /nfs/dbraw/zinc/01/84/55/1123018455.db2.gz FYIPZMOYCAWREC-UHFFFAOYSA-N 1 1 298.224 3.838 20 10 CHCDMO Cc1cccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1O ZINC000776013975 1123035139 /nfs/dbraw/zinc/03/51/39/1123035139.db2.gz POYOGSSUFISPKC-UHFFFAOYSA-N 1 1 279.383 3.748 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000776013962 1123035547 /nfs/dbraw/zinc/03/55/47/1123035547.db2.gz PECQGGPJIHTYBT-UHFFFAOYSA-N 1 1 283.346 3.579 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC12CCC(CC1)C2 ZINC001201787651 1123152228 /nfs/dbraw/zinc/15/22/28/1123152228.db2.gz SEWLAFFCAJZVAW-UHFFFAOYSA-N 1 1 283.774 3.855 20 10 CHCDMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(F)cc1O ZINC000107929253 1123229774 /nfs/dbraw/zinc/22/97/74/1123229774.db2.gz OMKCPAGQPJCNHW-SECBINFHSA-N 1 1 281.277 3.660 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(C)cc(Br)c1O)C1CC1 ZINC000850381392 1123261333 /nfs/dbraw/zinc/26/13/33/1123261333.db2.gz DEOUBMQZTNKNOH-ZDUSSCGKSA-N 1 1 298.224 3.741 20 10 CHCDMO CC[C@H](COCC1CC1)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000850494984 1123275193 /nfs/dbraw/zinc/27/51/93/1123275193.db2.gz UTTOFTYDXRJESL-GDBMZVCRSA-N 1 1 295.398 3.777 20 10 CHCDMO C[C@H]([NH2+]CCC(C)(C)F)c1ccc(Cl)cc1O ZINC000850532802 1123286076 /nfs/dbraw/zinc/28/60/76/1123286076.db2.gz XAXMMSZDKVNKGK-VIFPVBQESA-N 1 1 259.752 3.834 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000850541010 1123288272 /nfs/dbraw/zinc/28/82/72/1123288272.db2.gz UEOJXHCBLRHXDU-ZANVPECISA-N 1 1 253.773 3.885 20 10 CHCDMO CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(F)cc1O ZINC000850537596 1123288325 /nfs/dbraw/zinc/28/83/25/1123288325.db2.gz WEGUNKDZUSUGLR-YPMHNXCESA-N 1 1 273.298 3.617 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000850541008 1123288380 /nfs/dbraw/zinc/28/83/80/1123288380.db2.gz UEOJXHCBLRHXDU-RNCFNFMXSA-N 1 1 253.773 3.885 20 10 CHCDMO C[C@@H]([NH2+]CC(F)(F)c1ccc(F)cc1)c1ccccc1O ZINC000850562440 1123292878 /nfs/dbraw/zinc/29/28/78/1123292878.db2.gz UPMWBFSGZXEUNI-LLVKDONJSA-N 1 1 295.304 3.974 20 10 CHCDMO CC[C@H]([NH2+]CCCc1ccco1)c1ccc(F)cc1O ZINC000850569486 1123293960 /nfs/dbraw/zinc/29/39/60/1123293960.db2.gz GBLALNIDOJXMGH-HNNXBMFYSA-N 1 1 277.339 3.798 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000109772566 1123326568 /nfs/dbraw/zinc/32/65/68/1123326568.db2.gz OTGWQWZVMDZWOR-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccccc1O ZINC000109773258 1123326787 /nfs/dbraw/zinc/32/67/87/1123326787.db2.gz JTVMGFRFKUMQRI-UHFFFAOYSA-N 1 1 261.752 3.678 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H]1CC[C@@H](OC)C1 ZINC000852019038 1123392793 /nfs/dbraw/zinc/39/27/93/1123392793.db2.gz TUFNGHSRZSHVSR-HZPDHXFCSA-N 1 1 277.408 3.562 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H]1CC[C@@H](OC)C1 ZINC000852019039 1123393369 /nfs/dbraw/zinc/39/33/69/1123393369.db2.gz TUFNGHSRZSHVSR-JKSUJKDBSA-N 1 1 277.408 3.562 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](CCF)C2)cc1C ZINC000853564654 1123444109 /nfs/dbraw/zinc/44/41/09/1123444109.db2.gz RJHNEKKNZSULDG-CQSZACIVSA-N 1 1 265.372 3.581 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccc(F)cc1O ZINC000858536154 1123660933 /nfs/dbraw/zinc/66/09/33/1123660933.db2.gz FBZFINFYMLSAOF-OVZMXSCWSA-N 1 1 263.356 3.618 20 10 CHCDMO C[C@@H]([NH2+]Cc1cocn1)c1ccc(N2CCCCC2)cc1 ZINC000777038262 1123662164 /nfs/dbraw/zinc/66/21/64/1123662164.db2.gz YGHMRETXHXPUHY-CQSZACIVSA-N 1 1 285.391 3.516 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1 ZINC000862444033 1123810659 /nfs/dbraw/zinc/81/06/59/1123810659.db2.gz SLSZHPNOLXRHOO-TXEJJXNPSA-N 1 1 299.361 3.514 20 10 CHCDMO CCOc1ccc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c(O)c1 ZINC000862444677 1123811721 /nfs/dbraw/zinc/81/17/21/1123811721.db2.gz XPSBAEBLKKFOCV-TXEJJXNPSA-N 1 1 299.361 3.514 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2)c1O ZINC000119376225 1123857565 /nfs/dbraw/zinc/85/75/65/1123857565.db2.gz GRXBMXHLNWVJHJ-CQSZACIVSA-N 1 1 285.387 3.984 20 10 CHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000763646198 1129151582 /nfs/dbraw/zinc/15/15/82/1129151582.db2.gz KGHOYXFVFZLVQI-NSHDSACASA-N 1 1 265.784 3.810 20 10 CHCDMO CN(C)c1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000301378664 1123896100 /nfs/dbraw/zinc/89/61/00/1123896100.db2.gz XMPQYERRGNTBCN-UHFFFAOYSA-N 1 1 283.400 3.974 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC000120800551 1124024823 /nfs/dbraw/zinc/02/48/23/1124024823.db2.gz YTYYHYPJKWLPNP-UHFFFAOYSA-N 1 1 298.411 3.942 20 10 CHCDMO C[C@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866622556 1124091632 /nfs/dbraw/zinc/09/16/32/1124091632.db2.gz GVRUKCPRKPCPCP-BLLLJJGKSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866622558 1124091647 /nfs/dbraw/zinc/09/16/47/1124091647.db2.gz GVRUKCPRKPCPCP-MLGOLLRUSA-N 1 1 293.382 3.674 20 10 CHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2c(C)cccc2O)C1 ZINC000876758215 1124974912 /nfs/dbraw/zinc/97/49/12/1124974912.db2.gz JWAUWHSYTCMKIO-HNNXBMFYSA-N 1 1 297.398 3.699 20 10 CHCDMO CSc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)s1 ZINC000877703273 1125065724 /nfs/dbraw/zinc/06/57/24/1125065724.db2.gz ZHEJRKBKFVRGAW-UHFFFAOYSA-N 1 1 277.414 3.691 20 10 CHCDMO CSc1ccc(C[N@H+]2Cc3cccc(O)c3C2)s1 ZINC000877703273 1125065729 /nfs/dbraw/zinc/06/57/29/1125065729.db2.gz ZHEJRKBKFVRGAW-UHFFFAOYSA-N 1 1 277.414 3.691 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1O ZINC000127579761 1125202757 /nfs/dbraw/zinc/20/27/57/1125202757.db2.gz LVSXDCKMRQSJHT-WMLDXEAASA-N 1 1 297.398 3.779 20 10 CHCDMO CC(C)(C)c1cc[nH+]c(N2Cc3cccc(O)c3C2)c1 ZINC000882690578 1125351794 /nfs/dbraw/zinc/35/17/94/1125351794.db2.gz SPNPHEZISFRIEX-UHFFFAOYSA-N 1 1 268.360 3.605 20 10 CHCDMO CC[N@@H+](Cc1ccoc1)Cc1ccc(N(C)C)c(F)c1 ZINC000129909867 1125353452 /nfs/dbraw/zinc/35/34/52/1125353452.db2.gz BBFPSQXVKRPSPN-UHFFFAOYSA-N 1 1 276.355 3.507 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000130257608 1125358638 /nfs/dbraw/zinc/35/86/38/1125358638.db2.gz BEJJPCJDLPWKTG-UHFFFAOYSA-N 1 1 273.401 3.927 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000882935235 1125362682 /nfs/dbraw/zinc/36/26/82/1125362682.db2.gz JYWRCRADULQJHZ-HNNXBMFYSA-N 1 1 293.288 3.587 20 10 CHCDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)cc1 ZINC000130814644 1125369156 /nfs/dbraw/zinc/36/91/56/1125369156.db2.gz KPJXYGCSZZYZQX-ZDUSSCGKSA-N 1 1 299.370 3.622 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000131355801 1125388128 /nfs/dbraw/zinc/38/81/28/1125388128.db2.gz CHADITSYWFMZRV-CYBMUJFWSA-N 1 1 293.382 3.602 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(Cl)n1 ZINC000883301870 1125393082 /nfs/dbraw/zinc/39/30/82/1125393082.db2.gz KMBZRIYMPHHMHK-SNVBAGLBSA-N 1 1 294.757 3.739 20 10 CHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N)cc2)c1 ZINC001204849099 1125428994 /nfs/dbraw/zinc/42/89/94/1125428994.db2.gz XVBHUSWSXDHJBZ-SFHVURJKSA-N 1 1 266.388 3.914 20 10 CHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000133294647 1125444658 /nfs/dbraw/zinc/44/46/58/1125444658.db2.gz RPFAZORCRSJISB-UHFFFAOYSA-N 1 1 258.409 3.661 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)OC[C@H]2c2ccccc2)c1 ZINC000245773341 1129224714 /nfs/dbraw/zinc/22/47/14/1129224714.db2.gz SFCNRSSYPWFHJT-YJBOKZPZSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1cc(C[N@@H+](C)CCc2ccccc2)ccc1N(C)C ZINC001139670198 1131359744 /nfs/dbraw/zinc/35/97/44/1131359744.db2.gz ZMDKZSQZLFHLJR-UHFFFAOYSA-N 1 1 282.431 3.736 20 10 CHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)CC1 ZINC000093317056 1129421312 /nfs/dbraw/zinc/42/13/12/1129421312.db2.gz NYMKFXDBXHUROR-KRWDZBQOSA-N 1 1 291.435 3.790 20 10 CHCDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000795672831 1129424001 /nfs/dbraw/zinc/42/40/01/1129424001.db2.gz AWTYKFPVSPGPFE-GASCZTMLSA-N 1 1 291.435 3.607 20 10 CHCDMO CC[N@@H+](Cc1c(O)ccc2ccncc21)[C@H](C)C(C)C ZINC000742549993 1129487387 /nfs/dbraw/zinc/48/73/87/1129487387.db2.gz JWAVMOJGXPFTQW-CYBMUJFWSA-N 1 1 272.392 3.807 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC3(CCCC3)C1)CCC2 ZINC000743391085 1129522276 /nfs/dbraw/zinc/52/22/76/1129522276.db2.gz WLULGTGLLBELMO-UHFFFAOYSA-N 1 1 271.404 3.647 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1[O-])C1(C)CCCC1 ZINC000720385795 1129525345 /nfs/dbraw/zinc/52/53/45/1129525345.db2.gz LFWLAUSWMXFUNT-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C1(C)CCCC1 ZINC000720385795 1129525349 /nfs/dbraw/zinc/52/53/49/1129525349.db2.gz LFWLAUSWMXFUNT-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)C1(C)CCCC1 ZINC000720385795 1129525352 /nfs/dbraw/zinc/52/53/52/1129525352.db2.gz LFWLAUSWMXFUNT-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)C2(C)CCCC2)c1O ZINC000720386357 1129526678 /nfs/dbraw/zinc/52/66/78/1129526678.db2.gz AXXYPLXWMQUGLJ-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO CCC[N@@H+](CCOCCC(C)C)Cc1ccccc1O ZINC000743870540 1129542254 /nfs/dbraw/zinc/54/22/54/1129542254.db2.gz WTFKGKCVFWTIDU-UHFFFAOYSA-N 1 1 279.424 3.667 20 10 CHCDMO CC[C@H]([NH2+]Cc1ncc(C)s1)c1ccc(F)cc1O ZINC000796785536 1129584826 /nfs/dbraw/zinc/58/48/26/1129584826.db2.gz KHMRGNCQQRVLAM-LBPRGKRZSA-N 1 1 280.368 3.537 20 10 CHCDMO CC(C)O[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)C1(C)C ZINC000766331514 1129605190 /nfs/dbraw/zinc/60/51/90/1129605190.db2.gz SFRGKVSDGBQWGJ-HFBAOOFYSA-N 1 1 295.398 3.774 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@@H]1CCOC1 ZINC000738082185 1129665178 /nfs/dbraw/zinc/66/51/78/1129665178.db2.gz PFFFNAVOGXWGMP-HNNXBMFYSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[N@@H+](Cc1sccc1C)Cc1ccccc1O ZINC001204024430 1129723687 /nfs/dbraw/zinc/72/36/87/1129723687.db2.gz XAPOLWBVMUZLTH-UHFFFAOYSA-N 1 1 261.390 3.784 20 10 CHCDMO C[N@H+](Cc1ccccc1O)Cc1nc(Cl)ccc1Cl ZINC000766813134 1129755053 /nfs/dbraw/zinc/75/50/53/1129755053.db2.gz FEHHIDDDIRKJIY-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1nc(Cl)ccc1Cl ZINC000766813134 1129755056 /nfs/dbraw/zinc/75/50/56/1129755056.db2.gz FEHHIDDDIRKJIY-UHFFFAOYSA-N 1 1 297.185 3.726 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1c(O)cccc1Cl ZINC000768159967 1129836487 /nfs/dbraw/zinc/83/64/87/1129836487.db2.gz JRWMZBASAWJDAS-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000768194815 1129842135 /nfs/dbraw/zinc/84/21/35/1129842135.db2.gz FFHNPVKEOBHAGR-CYBMUJFWSA-N 1 1 289.400 3.799 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000768233233 1129845427 /nfs/dbraw/zinc/84/54/27/1129845427.db2.gz LZWQFWSBRCLFLM-SFHVURJKSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000768233698 1129845915 /nfs/dbraw/zinc/84/59/15/1129845915.db2.gz PJUCLLHWZBIIKE-INIZCTEOSA-N 1 1 283.371 3.520 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000768354144 1129853986 /nfs/dbraw/zinc/85/39/86/1129853986.db2.gz FPFHJKHWDUVJJZ-MRXNPFEDSA-N 1 1 298.386 3.523 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)c(F)c1)CC1CC1 ZINC000768673086 1129868306 /nfs/dbraw/zinc/86/83/06/1129868306.db2.gz IDFMVSNGSPKSSX-UHFFFAOYSA-N 1 1 264.388 3.512 20 10 CHCDMO C[N@@H+](Cc1cccc2c1OC(C)(C)C2)Cc1ccccc1O ZINC000768872091 1129877682 /nfs/dbraw/zinc/87/76/82/1129877682.db2.gz CCXYUDZZPSNMSG-UHFFFAOYSA-N 1 1 297.398 3.738 20 10 CHCDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1ccccc1O ZINC000768873616 1129878356 /nfs/dbraw/zinc/87/83/56/1129878356.db2.gz RTDMJXPEMJFOQA-QINSGFPZSA-N 1 1 267.372 3.928 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c(O)c1 ZINC000769102526 1129889578 /nfs/dbraw/zinc/88/95/78/1129889578.db2.gz OLAOKXHOLFKVDL-XJKSGUPXSA-N 1 1 275.392 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000769107654 1129891776 /nfs/dbraw/zinc/89/17/76/1129891776.db2.gz ZAEFMDSECPKOPH-LJQANCHMSA-N 1 1 296.414 3.795 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000769404170 1129907082 /nfs/dbraw/zinc/90/70/82/1129907082.db2.gz KCPOFQSWTJOMMY-KEYYUXOJSA-N 1 1 289.419 3.944 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000769426124 1129907548 /nfs/dbraw/zinc/90/75/48/1129907548.db2.gz MRBWFHXZWCEBTH-INIZCTEOSA-N 1 1 299.389 3.904 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000769395125 1129908935 /nfs/dbraw/zinc/90/89/35/1129908935.db2.gz MTQNWEFKJPHFSQ-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1c(O)cccc1OC ZINC000769488608 1129909379 /nfs/dbraw/zinc/90/93/79/1129909379.db2.gz GKAOMZDUAPQNFK-INIZCTEOSA-N 1 1 299.414 3.854 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000769485224 1129909421 /nfs/dbraw/zinc/90/94/21/1129909421.db2.gz 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CO[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H]1C ZINC000840127111 1132247820 /nfs/dbraw/zinc/24/78/20/1132247820.db2.gz RLPJDUTWEWZWHZ-KBXCAEBGSA-N 1 1 291.435 3.681 20 10 CHCDMO COC[C@H]1CC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000840083746 1132248261 /nfs/dbraw/zinc/24/82/61/1132248261.db2.gz RBQLJXZONJWDLC-CYBMUJFWSA-N 1 1 297.354 3.512 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000840175078 1132248813 /nfs/dbraw/zinc/24/88/13/1132248813.db2.gz GBJJMDQUIRDLBT-IBGZPJMESA-N 1 1 297.398 3.546 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCSC3(CCC3)CC2)cc1C ZINC000840174559 1132249848 /nfs/dbraw/zinc/24/98/48/1132249848.db2.gz QFVIRXZTFUZEJG-UHFFFAOYSA-N 1 1 291.460 3.871 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(F)cc1O ZINC000840820097 1132290310 /nfs/dbraw/zinc/29/03/10/1132290310.db2.gz JVFUHXDKFBVTTN-SDJAHQOYSA-N 1 1 263.356 3.761 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000840947971 1132311084 /nfs/dbraw/zinc/31/10/84/1132311084.db2.gz 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CCC[N@@H+](Cc1ccc(N(C)C)cc1OC)[C@@H](C)CC ZINC001231849773 1132379843 /nfs/dbraw/zinc/37/98/43/1132379843.db2.gz ZAOPAWLFGYUHIC-AWEZNQCLSA-N 1 1 278.440 3.772 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@](C)(F)C2)cc1Cl ZINC001231867379 1132380744 /nfs/dbraw/zinc/38/07/44/1132380744.db2.gz JVZQMAKZWOXEEY-AWEZNQCLSA-N 1 1 271.763 3.678 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)CC[C@@]1(C)O ZINC001231879354 1132388871 /nfs/dbraw/zinc/38/88/71/1132388871.db2.gz CJPHJIUJKVJYNF-IFXJQAMLSA-N 1 1 299.414 3.528 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CC=CCC1)c1ccc(Cl)cc1O ZINC000841748966 1132389833 /nfs/dbraw/zinc/38/98/33/1132389833.db2.gz MSWPQFFIDPHLDD-PWSUYJOCSA-N 1 1 251.757 3.805 20 10 CHCDMO C[C@@H]([NH2+]CCCc1nccs1)c1ccc(Cl)cc1O ZINC000841747240 1132390003 /nfs/dbraw/zinc/39/00/03/1132390003.db2.gz DQLJGXPMZWBBNO-SNVBAGLBSA-N 1 1 296.823 3.786 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(Cl)cc1O ZINC000841747507 1132390280 /nfs/dbraw/zinc/39/02/80/1132390280.db2.gz CDITVPQKBVULTK-DGCLKSJQSA-N 1 1 295.810 3.798 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C2(CC2)C1 ZINC001231883710 1132390628 /nfs/dbraw/zinc/39/06/28/1132390628.db2.gz SYIVXYZOUKZYAI-CYBMUJFWSA-N 1 1 267.372 3.920 20 10 CHCDMO C[C@H]([NH2+]CCc1ccccc1O)c1ccc(Cl)cc1O ZINC000841747007 1132390870 /nfs/dbraw/zinc/39/08/70/1132390870.db2.gz MQMXHECMDRMSRY-NSHDSACASA-N 1 1 291.778 3.645 20 10 CHCDMO C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841760718 1132394296 /nfs/dbraw/zinc/39/42/96/1132394296.db2.gz UJVPJNKERJKOPP-WOPDTQHZSA-N 1 1 283.799 3.511 20 10 CHCDMO CCC1(O)CCC([NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841757200 1132394820 /nfs/dbraw/zinc/39/48/20/1132394820.db2.gz FSMKIEOIXMCFFE-FFKNIBCLSA-N 1 1 297.826 3.780 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C ZINC001142508941 1132403543 /nfs/dbraw/zinc/40/35/43/1132403543.db2.gz QMRLKQCXAANDQX-GHMZBOCLSA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C ZINC001142508941 1132403546 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Cc1cc2c(cn1)C[N@@H+](Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143112457 1132504872 /nfs/dbraw/zinc/50/48/72/1132504872.db2.gz RKNSNXLOCCDLCU-UHFFFAOYSA-N 1 1 296.414 3.909 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232838181 1132528153 /nfs/dbraw/zinc/52/81/53/1132528153.db2.gz BDEPODQEZZOFOF-HNNXBMFYSA-N 1 1 276.424 3.613 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2O)cc1C ZINC001232840648 1132529235 /nfs/dbraw/zinc/52/92/35/1132529235.db2.gz FETBBSXGVMJCDY-UHFFFAOYSA-N 1 1 298.430 3.707 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2O)Cc2ccccc21 ZINC001232833625 1132529502 /nfs/dbraw/zinc/52/95/02/1132529502.db2.gz BIZFAJXHPNXHLT-AWEZNQCLSA-N 1 1 296.414 3.578 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)cc(O)c1 ZINC001232881751 1132536083 /nfs/dbraw/zinc/53/60/83/1132536083.db2.gz IRLNXXDTTNBFOK-UHFFFAOYSA-N 1 1 298.430 3.789 20 10 CHCDMO CC[N@@H+](Cc1ccc2ncoc2c1)Cc1ccccc1O ZINC001232945595 1132548235 /nfs/dbraw/zinc/54/82/35/1132548235.db2.gz YMQGVFXUNJATSP-UHFFFAOYSA-N 1 1 282.343 3.556 20 10 CHCDMO CCO[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286431 1132595210 /nfs/dbraw/zinc/59/52/10/1132595210.db2.gz UECBAKULPPPSEV-INIZCTEOSA-N 1 1 291.435 3.691 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2c(O)ccc(F)c2F)C[C@@H]1C ZINC001233332631 1132600849 /nfs/dbraw/zinc/60/08/49/1132600849.db2.gz RSAOWUKDJHBAQJ-MNOVXSKESA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)ccc(F)c2F)C[C@@H]1C ZINC001233332631 1132600851 /nfs/dbraw/zinc/60/08/51/1132600851.db2.gz RSAOWUKDJHBAQJ-MNOVXSKESA-N 1 1 269.335 3.538 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@@H+]1CCCc2ccccc2C1 ZINC001233334960 1132603686 /nfs/dbraw/zinc/60/36/86/1132603686.db2.gz BFBJBPIYZUCBDL-UHFFFAOYSA-N 1 1 289.325 3.619 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@H+]1CCCc2ccccc2C1 ZINC001233334960 1132603693 /nfs/dbraw/zinc/60/36/93/1132603693.db2.gz BFBJBPIYZUCBDL-UHFFFAOYSA-N 1 1 289.325 3.619 20 10 CHCDMO Oc1ccc(F)c(F)c1C[NH+]1CCC2(CCCC2)CC1 ZINC001233332856 1132605300 /nfs/dbraw/zinc/60/53/00/1132605300.db2.gz 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CC(C)C[N@@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204232862 1133423196 /nfs/dbraw/zinc/42/31/96/1133423196.db2.gz KSLACLICLUUWFB-UHFFFAOYSA-N 1 1 270.420 3.994 20 10 CHCDMO COC[C@H]1CCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232868 1133423289 /nfs/dbraw/zinc/42/32/89/1133423289.db2.gz KWLSMQLZFXBYCT-MRXNPFEDSA-N 1 1 298.430 3.517 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCOCC2(C)C)c2ccccc21 ZINC001204243297 1133424749 /nfs/dbraw/zinc/42/47/49/1133424749.db2.gz VNIPTBPYBBRJQI-UHFFFAOYSA-N 1 1 298.430 3.517 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)c2ccccc21 ZINC001204240572 1133424804 /nfs/dbraw/zinc/42/48/04/1133424804.db2.gz YYLYFGNHHDDLEX-IFXJQAMLSA-N 1 1 280.415 3.890 20 10 CHCDMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204281611 1133428966 /nfs/dbraw/zinc/42/89/66/1133428966.db2.gz XGFULBUOECYOGY-INIZCTEOSA-N 1 1 271.360 3.681 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001204299158 1133432473 /nfs/dbraw/zinc/43/24/73/1133432473.db2.gz 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CC[N@@H+](Cc1ccc2[nH]ccc2c1)Cc1ccccc1O ZINC001205606589 1133593605 /nfs/dbraw/zinc/59/36/05/1133593605.db2.gz ZKHNKQKMFRSJJV-UHFFFAOYSA-N 1 1 280.371 3.896 20 10 CHCDMO Cc1cnccc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001205858117 1133623561 /nfs/dbraw/zinc/62/35/61/1133623561.db2.gz YNBCZTHOXQTOLZ-UHFFFAOYSA-N 1 1 295.430 3.622 20 10 CHCDMO CC(C)C[C@]1(C)CCC[N@@H+]1Cc1cccc(F)c1O ZINC001205907542 1133628529 /nfs/dbraw/zinc/62/85/29/1133628529.db2.gz JIRVPALTTRJGTP-INIZCTEOSA-N 1 1 265.372 3.932 20 10 CHCDMO CC(C)C[C@]1(C)CCC[N@H+]1Cc1cccc(F)c1O ZINC001205907542 1133628531 /nfs/dbraw/zinc/62/85/31/1133628531.db2.gz JIRVPALTTRJGTP-INIZCTEOSA-N 1 1 265.372 3.932 20 10 CHCDMO Cc1ccoc1C[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC001205999496 1133640410 /nfs/dbraw/zinc/64/04/10/1133640410.db2.gz YRSMRCOHCOBVHX-UHFFFAOYSA-N 1 1 279.767 3.887 20 10 CHCDMO CC(C)(C)C1CC([NH2+]Cc2ccc(Cl)cc2O)C1 ZINC001206017903 1133642266 /nfs/dbraw/zinc/64/22/66/1133642266.db2.gz XPZZQQHJMLYLKZ-UHFFFAOYSA-N 1 1 267.800 3.960 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C3CCC3)C2)cc1Cl ZINC001206284812 1133682563 /nfs/dbraw/zinc/68/25/63/1133682563.db2.gz DCLGWSZVJYXJJS-CYBMUJFWSA-N 1 1 279.811 3.976 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCC1CCCCC1)CC2 ZINC001207260661 1133782794 /nfs/dbraw/zinc/78/27/94/1133782794.db2.gz FKVGOJGFOCMEBJ-UHFFFAOYSA-N 1 1 259.393 3.721 20 10 CHCDMO COc1ccc2oc(C[N@H+]3Cc4cccc(O)c4C3)cc2c1 ZINC001207242761 1133782850 /nfs/dbraw/zinc/78/28/50/1133782850.db2.gz GIMUXRHLKMXCLX-UHFFFAOYSA-N 1 1 295.338 3.663 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CC1CCC(F)(F)CC1)CC2 ZINC001207348982 1133794184 /nfs/dbraw/zinc/79/41/84/1133794184.db2.gz GLWOAYQOFBHHKV-UHFFFAOYSA-N 1 1 281.346 3.576 20 10 CHCDMO Oc1cccc(F)c1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001207623968 1133832865 /nfs/dbraw/zinc/83/28/65/1133832865.db2.gz ZDSKZOBGWLHRFO-HNNXBMFYSA-N 1 1 285.362 3.569 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cccc(Br)c1O ZINC000136819003 1134413544 /nfs/dbraw/zinc/41/35/44/1134413544.db2.gz UTPMLUXQIYZMQH-ZYHUDNBSSA-N 1 1 298.224 3.918 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc(Br)c1O ZINC000136819003 1134413549 /nfs/dbraw/zinc/41/35/49/1134413549.db2.gz UTPMLUXQIYZMQH-ZYHUDNBSSA-N 1 1 298.224 3.918 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N)cc1 ZINC001217967694 1135033054 /nfs/dbraw/zinc/03/30/54/1135033054.db2.gz UAGDOVWEJLHWBR-BEFAXECRSA-N 1 1 296.414 3.558 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1ccc(N)cc1 ZINC001217967696 1135033157 /nfs/dbraw/zinc/03/31/57/1135033157.db2.gz UAGDOVWEJLHWBR-DNVCBOLYSA-N 1 1 296.414 3.558 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1c(F)cccc1F ZINC000037771882 260116274 /nfs/dbraw/zinc/11/62/74/260116274.db2.gz HRNPFIKKDYEKPB-NSHDSACASA-N 1 1 289.325 3.751 20 10 CHCDMO C[C@H]([NH2+]CCCOC1CCCC1)c1ccc(F)cc1O ZINC000185240547 262047722 /nfs/dbraw/zinc/04/77/22/262047722.db2.gz GNSPYVOXYUHSBW-LBPRGKRZSA-N 1 1 281.371 3.531 20 10 CHCDMO CC[C@@H]([NH2+]CCC1(OC)CCC1)c1ccc(F)cc1O ZINC000293860839 263151435 /nfs/dbraw/zinc/15/14/35/263151435.db2.gz YZVJKPSGJSLTNS-CQSZACIVSA-N 1 1 281.371 3.531 20 10 CHCDMO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)cs1 ZINC000185425351 327839844 /nfs/dbraw/zinc/83/98/44/327839844.db2.gz RSRSFUPJOHGERH-ZJUUUORDSA-N 1 1 294.395 3.962 20 10 CHCDMO CCOc1cccc(CNc2cc(C3CC3)cc[nH+]2)c1O ZINC000289701638 521377908 /nfs/dbraw/zinc/37/79/08/521377908.db2.gz DUSLYIDWIXCOSG-UHFFFAOYSA-N 1 1 284.359 3.675 20 10 CHCDMO CCOc1cccc(CNc2cccc(C3CC3)[nH+]2)c1O ZINC000293067382 521377951 /nfs/dbraw/zinc/37/79/51/521377951.db2.gz VEJSCFGRKJOMAL-UHFFFAOYSA-N 1 1 284.359 3.675 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccco2)cc1C ZINC000131069014 525315085 /nfs/dbraw/zinc/31/50/85/525315085.db2.gz CPCZWYUFRLRKAW-CYBMUJFWSA-N 1 1 259.349 3.795 20 10 CHCDMO C[C@H]([NH2+]CCCCCO)c1cc(Cl)c(Cl)cc1O ZINC000280124948 525332443 /nfs/dbraw/zinc/33/24/43/525332443.db2.gz PUINUHFVXMQSCT-VIFPVBQESA-N 1 1 292.206 3.512 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccc(F)cc1O ZINC000062745432 525614649 /nfs/dbraw/zinc/61/46/49/525614649.db2.gz WRONREOHNYVWBM-HZMBPMFUSA-N 1 1 275.323 3.853 20 10 CHCDMO COc1cccc(C[N@@H+](Cc2cccs2)C2CC2)c1O ZINC000130253410 525924436 /nfs/dbraw/zinc/92/44/36/525924436.db2.gz YVNGWHOVHKNHPA-UHFFFAOYSA-N 1 1 289.400 3.627 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2cccc(Br)c2O)[C@H]1C ZINC000251608594 1125469409 /nfs/dbraw/zinc/46/94/09/1125469409.db2.gz BZRFDNOIEJTVHA-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cccc(Br)c2O)[C@H]1C ZINC000251608594 1125469411 /nfs/dbraw/zinc/46/94/11/1125469411.db2.gz BZRFDNOIEJTVHA-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+](C1CC1)C1CCCC1 ZINC001205208075 1118154006 /nfs/dbraw/zinc/15/40/06/1118154006.db2.gz IVSXFSHSBVNDKZ-UHFFFAOYSA-N 1 1 267.319 3.577 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+](C1CC1)C1CCCC1 ZINC001205208075 1118154010 /nfs/dbraw/zinc/15/40/10/1118154010.db2.gz IVSXFSHSBVNDKZ-UHFFFAOYSA-N 1 1 267.319 3.577 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)CCSCC)c1 ZINC000093871048 1120892912 /nfs/dbraw/zinc/89/29/12/1120892912.db2.gz LSAOYPWQOBUHIX-ZDUSSCGKSA-N 1 1 297.464 3.754 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CCCCC1(F)F ZINC000708501056 1121468341 /nfs/dbraw/zinc/46/83/41/1121468341.db2.gz AOUNJGXTYQZXEJ-SNVBAGLBSA-N 1 1 291.288 3.586 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCCS1)c1cc(F)cc(F)c1O ZINC000866479948 1124071332 /nfs/dbraw/zinc/07/13/32/1124071332.db2.gz BCVZVCTXHDEXPG-KOLCDFICSA-N 1 1 287.375 3.607 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCCC[C@@H]2C)c1O ZINC000211390462 1125304750 /nfs/dbraw/zinc/30/47/50/1125304750.db2.gz PMNXCMBEDMHUSO-ZDUSSCGKSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCC[C@](C)(F)C2)c1O ZINC001140178611 1131673136 /nfs/dbraw/zinc/67/31/36/1131673136.db2.gz QMFYZUZKSAZRFS-INIZCTEOSA-N 1 1 265.372 3.723 20 10 CHCDMO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccc(F)cc1O ZINC000834885505 1131718710 /nfs/dbraw/zinc/71/87/10/1131718710.db2.gz XACAHBHJAYMUQN-PRHODGIISA-N 1 1 292.181 3.766 20 10 CHCDMO CC[C@H]([NH2+]CCOC(C)(C)CC)c1ccc(F)cc1O ZINC000834916422 1131733626 /nfs/dbraw/zinc/73/36/26/1131733626.db2.gz YGKXTKUHIUJFKF-AWEZNQCLSA-N 1 1 283.387 3.777 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CO[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000842930197 1132477736 /nfs/dbraw/zinc/47/77/36/1132477736.db2.gz XPXKJFNZKMCNHL-HLTSFMKQSA-N 1 1 290.190 3.527 20 10 CHCDMO CCCC1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233334305 1132603941 /nfs/dbraw/zinc/60/39/41/1132603941.db2.gz BGCPAHQIXSTBKW-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO C[N@@H+](CCC1CCOCC1)Cc1c(O)ccc2ccccc21 ZINC000121174647 1125557367 /nfs/dbraw/zinc/55/73/67/1125557367.db2.gz KQILDMWETRNLPT-UHFFFAOYSA-N 1 1 299.414 3.794 20 10 CHCDMO C[N@H+]1Cc2ccc(NCc3c(O)cccc3Cl)cc2C1 ZINC000121283429 1125559527 /nfs/dbraw/zinc/55/95/27/1125559527.db2.gz YUFORRUDGFORGZ-UHFFFAOYSA-N 1 1 288.778 3.603 20 10 CHCDMO C[C@H](Cc1ccncc1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758079 1125598138 /nfs/dbraw/zinc/59/81/38/1125598138.db2.gz KKOXPUUMSHHISB-NEPJUHHUSA-N 1 1 290.794 3.722 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886489431 1125680394 /nfs/dbraw/zinc/68/03/94/1125680394.db2.gz IPICTNKGCNBYFF-NEPJUHHUSA-N 1 1 259.324 3.943 20 10 CHCDMO COCc1ccccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886497136 1125681041 /nfs/dbraw/zinc/68/10/41/1125681041.db2.gz UGIDUIRADAGKOA-LBPRGKRZSA-N 1 1 289.350 3.529 20 10 CHCDMO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886522252 1125683324 /nfs/dbraw/zinc/68/33/24/1125683324.db2.gz FVYNJCFRNZTCJE-VXGBXAGGSA-N 1 1 289.350 3.519 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccncc1 ZINC000886532787 1125685246 /nfs/dbraw/zinc/68/52/46/1125685246.db2.gz OUJLUUIKPDOWKL-SMDDNHRTSA-N 1 1 274.339 3.728 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1c(O)cccc1F ZINC000886552235 1125689807 /nfs/dbraw/zinc/68/98/07/1125689807.db2.gz XARXQEQWAHLCII-ZJUUUORDSA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1c(O)cccc1F ZINC000886551464 1125690078 /nfs/dbraw/zinc/69/00/78/1125690078.db2.gz IKGHQKDAMHRTTG-CHWSQXEVSA-N 1 1 293.382 3.674 20 10 CHCDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886555494 1125690230 /nfs/dbraw/zinc/69/02/30/1125690230.db2.gz UPEWNMPVVUPVHY-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886561800 1125691916 /nfs/dbraw/zinc/69/19/16/1125691916.db2.gz JKODCZZBYJHLKW-VXGBXAGGSA-N 1 1 288.366 3.901 20 10 CHCDMO COCC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccco1 ZINC000886587536 1125693842 /nfs/dbraw/zinc/69/38/42/1125693842.db2.gz ASIZMIWDSZJWSE-WCQYABFASA-N 1 1 293.338 3.553 20 10 CHCDMO Cc1cscc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886601540 1125696882 /nfs/dbraw/zinc/69/68/82/1125696882.db2.gz VWWXZVQJHHVIDP-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCC1(F)F)c1c(O)cccc1F ZINC000886619237 1125699319 /nfs/dbraw/zinc/69/93/19/1125699319.db2.gz XGTYLASYNMFMJG-VHSXEESVSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1c(O)cccc1F ZINC000886619236 1125699578 /nfs/dbraw/zinc/69/95/78/1125699578.db2.gz XGTYLASYNMFMJG-UWVGGRQHSA-N 1 1 273.298 3.617 20 10 CHCDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769551015 1129917324 /nfs/dbraw/zinc/91/73/24/1129917324.db2.gz UNXGZNSSSQVDHV-AWEZNQCLSA-N 1 1 280.481 3.716 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC2(CC2)C1 ZINC000792174042 1130435541 /nfs/dbraw/zinc/43/55/41/1130435541.db2.gz DWXHWQYVHYTMPU-UHFFFAOYSA-N 1 1 269.747 3.561 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC2(CC2)C1 ZINC000792174042 1130435544 /nfs/dbraw/zinc/43/55/44/1130435544.db2.gz DWXHWQYVHYTMPU-UHFFFAOYSA-N 1 1 269.747 3.561 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000179679756 1126831492 /nfs/dbraw/zinc/83/14/92/1126831492.db2.gz DCOOWYSBYYLVHE-UHFFFAOYSA-N 1 1 289.400 3.627 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(F)ccc2O)s1 ZINC000180126841 1126839591 /nfs/dbraw/zinc/83/95/91/1126839591.db2.gz ATJZRTMMMWINHD-SNVBAGLBSA-N 1 1 294.395 3.798 20 10 CHCDMO C[C@@H]([NH2+]C1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000192702015 1126963217 /nfs/dbraw/zinc/96/32/17/1126963217.db2.gz APGIYNPINRJDGS-MRVPVSSYSA-N 1 1 290.190 3.529 20 10 CHCDMO CC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C(C)C ZINC000269492400 1127040898 /nfs/dbraw/zinc/04/08/98/1127040898.db2.gz MOSYUONIRLQEOO-UHFFFAOYSA-N 1 1 290.451 3.532 20 10 CHCDMO CCOc1cccc(C[N@@H+](Cc2ccco2)C(C)C)c1O ZINC000271037231 1127066018 /nfs/dbraw/zinc/06/60/18/1127066018.db2.gz GLDJFFCLMDWXMD-UHFFFAOYSA-N 1 1 289.375 3.795 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)cc1 ZINC000271436406 1127081498 /nfs/dbraw/zinc/08/14/98/1127081498.db2.gz BQFCUQXAGVXDIE-CXAGYDPISA-N 1 1 298.434 3.594 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)CC2CCCC2)c(Cl)c1 ZINC001236803354 1131012847 /nfs/dbraw/zinc/01/28/47/1131012847.db2.gz MLOQNFVKARBMRR-UHFFFAOYSA-N 1 1 283.799 3.676 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)CCO1 ZINC000912854403 1127114611 /nfs/dbraw/zinc/11/46/11/1127114611.db2.gz ZNGAEUCFVNBMAC-HNNXBMFYSA-N 1 1 291.435 3.609 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121164 1131054046 /nfs/dbraw/zinc/05/40/46/1131054046.db2.gz KLIURFUTRFTBBC-CQSZACIVSA-N 1 1 289.753 3.899 20 10 CHCDMO CC[C@@H]([NH2+]CCCc1ccccn1)c1ccc(F)cc1O ZINC000285930526 1127246850 /nfs/dbraw/zinc/24/68/50/1127246850.db2.gz CXCAFLFGVRCUSO-MRXNPFEDSA-N 1 1 288.366 3.600 20 10 CHCDMO CC[C@@H]([NH2+]CCCc1nccs1)c1ccc(F)cc1O ZINC000286102893 1127258549 /nfs/dbraw/zinc/25/85/49/1127258549.db2.gz MQFTUGFVCUJJRZ-CYBMUJFWSA-N 1 1 294.395 3.661 20 10 CHCDMO CC[C@H]([NH2+]CCCc1nccs1)c1ccc(F)cc1O ZINC000286102897 1127258700 /nfs/dbraw/zinc/25/87/00/1127258700.db2.gz MQFTUGFVCUJJRZ-ZDUSSCGKSA-N 1 1 294.395 3.661 20 10 CHCDMO CC[C@@H]([NH2+]CCCCOC(C)C)c1ccc(F)cc1O ZINC000286211181 1127262400 /nfs/dbraw/zinc/26/24/00/1127262400.db2.gz RUNGWMKOPPVXEW-OAHLLOKOSA-N 1 1 283.387 3.777 20 10 CHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000760908503 1127325979 /nfs/dbraw/zinc/32/59/79/1127325979.db2.gz VZRBDKQVUINIRJ-PSASIEDQSA-N 1 1 279.277 3.913 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2O)CC1 ZINC000226565499 1127411531 /nfs/dbraw/zinc/41/15/31/1127411531.db2.gz MICXBYINGAQXOB-LBPRGKRZSA-N 1 1 251.345 3.543 20 10 CHCDMO CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168807310 1127471216 /nfs/dbraw/zinc/47/12/16/1127471216.db2.gz ISRPPBGPGPUQNW-MNOVXSKESA-N 1 1 271.401 3.714 20 10 CHCDMO Cc1cc[nH+]c(N[C@H](C)c2cc(Cl)ccc2O)c1 ZINC000005982078 1127502084 /nfs/dbraw/zinc/50/20/84/1127502084.db2.gz BEMRBHWKEUCAQU-SNVBAGLBSA-N 1 1 262.740 3.922 20 10 CHCDMO CCc1noc(C)c1C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000293669471 1127512117 /nfs/dbraw/zinc/51/21/17/1127512117.db2.gz JIVDTYSWGIFDJF-CQSZACIVSA-N 1 1 292.354 3.631 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](CC2CC2)C(C)C)c1O ZINC000761192530 1127517051 /nfs/dbraw/zinc/51/70/51/1127517051.db2.gz QRIPYYXEUMFXCA-UHFFFAOYSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C2CCC2)c1O ZINC000761195816 1127517608 /nfs/dbraw/zinc/51/76/08/1127517608.db2.gz OYZKPGXFHQCBIG-CQSZACIVSA-N 1 1 295.810 3.819 20 10 CHCDMO COc1ccc(O)c(CNc2ccc(C3CCC3)c[nH+]2)c1 ZINC000293985946 1127539418 /nfs/dbraw/zinc/53/94/18/1127539418.db2.gz LIENNDPPFRULHS-UHFFFAOYSA-N 1 1 284.359 3.675 20 10 CHCDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228629755 1127576165 /nfs/dbraw/zinc/57/61/65/1127576165.db2.gz PLRNPRFMKKGAEL-SNVBAGLBSA-N 1 1 271.788 3.532 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]C[C@@]12C[C@@H]1CCCC2 ZINC001308940864 1127595641 /nfs/dbraw/zinc/59/56/41/1127595641.db2.gz VOQGNJUVDLUIOO-SWLSCSKDSA-N 1 1 265.784 3.716 20 10 CHCDMO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccc(F)cc1O ZINC000170788874 1127650071 /nfs/dbraw/zinc/65/00/71/1127650071.db2.gz KDMUSDDDPFKUBL-LBPRGKRZSA-N 1 1 298.361 3.906 20 10 CHCDMO CC[C@@H]([NH2+]CCc1ncccc1C)c1ccc(F)cc1O ZINC000296462490 1127672639 /nfs/dbraw/zinc/67/26/39/1127672639.db2.gz NJNQYRDKEKYFNB-OAHLLOKOSA-N 1 1 288.366 3.518 20 10 CHCDMO CC[N@H+](Cc1csc(C)n1)Cc1ccc(N(C)C)cc1 ZINC000171119488 1127686940 /nfs/dbraw/zinc/68/69/40/1127686940.db2.gz TZUNXMRLGWPOBZ-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO CC[N@@H+](Cc1csc(C)n1)Cc1ccc(N(C)C)cc1 ZINC000171119488 1127686942 /nfs/dbraw/zinc/68/69/42/1127686942.db2.gz TZUNXMRLGWPOBZ-UHFFFAOYSA-N 1 1 289.448 3.540 20 10 CHCDMO Cc1cc(C[N@H+]2CCCO[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000172495075 1127766866 /nfs/dbraw/zinc/76/68/66/1127766866.db2.gz KZJXITJJMPPRTD-AWEZNQCLSA-N 1 1 291.435 3.609 20 10 CHCDMO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745134 1127772563 /nfs/dbraw/zinc/77/25/63/1127772563.db2.gz IUSQLUHBZOBLBR-RYUDHWBXSA-N 1 1 277.339 3.796 20 10 CHCDMO CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000230662536 1127771602 /nfs/dbraw/zinc/77/16/02/1127771602.db2.gz CRYSXHDDTFNQEC-WCFLWFBJSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc(F)cc1O ZINC000062747635 1127773875 /nfs/dbraw/zinc/77/38/75/1127773875.db2.gz BRBFIYNDTGJHTP-YPMHNXCESA-N 1 1 271.335 3.522 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccc(F)cc1O ZINC000062748439 1127773973 /nfs/dbraw/zinc/77/39/73/1127773973.db2.gz DVPLQYDGDYCSFP-LRDDRELGSA-N 1 1 285.362 3.739 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000062748280 1127774072 /nfs/dbraw/zinc/77/40/72/1127774072.db2.gz NUOXBIRKJZTHKY-VIFPVBQESA-N 1 1 281.277 3.660 20 10 CHCDMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)CO2 ZINC000373265916 1127830930 /nfs/dbraw/zinc/83/09/30/1127830930.db2.gz LBGYHTASWYQPKZ-XHDPSFHLSA-N 1 1 287.334 3.624 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1C ZINC000029891475 1128068069 /nfs/dbraw/zinc/06/80/69/1128068069.db2.gz IXLFSJSPFUSKLC-LJQANCHMSA-N 1 1 297.398 3.583 20 10 CHCDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785177 1128244262 /nfs/dbraw/zinc/24/42/62/1128244262.db2.gz RIUPUGBZQJNYNI-SUMWQHHRSA-N 1 1 273.420 3.891 20 10 CHCDMO Cn1cccc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000153231068 1128213760 /nfs/dbraw/zinc/21/37/60/1128213760.db2.gz CGYLSVJBFQSCAG-UHFFFAOYSA-N 1 1 296.370 3.526 20 10 CHCDMO Cn1cccc1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000153231068 1128213762 /nfs/dbraw/zinc/21/37/62/1128213762.db2.gz CGYLSVJBFQSCAG-UHFFFAOYSA-N 1 1 296.370 3.526 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1c(O)cccc1F ZINC000927124004 1128220123 /nfs/dbraw/zinc/22/01/23/1128220123.db2.gz GOBNLSQAUMPQKU-QWHCGFSZSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000762140527 1128273346 /nfs/dbraw/zinc/27/33/46/1128273346.db2.gz FFTRNNUIWUZICA-ZDUSSCGKSA-N 1 1 271.404 3.645 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccc(F)nc1 ZINC000929753439 1128285507 /nfs/dbraw/zinc/28/55/07/1128285507.db2.gz QAAHBQVOGLGJCX-ZDUSSCGKSA-N 1 1 288.366 3.900 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000915208576 1128292076 /nfs/dbraw/zinc/29/20/76/1128292076.db2.gz GOLSUYJPLQIYRC-CYBMUJFWSA-N 1 1 270.376 3.562 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000754730544 1128299996 /nfs/dbraw/zinc/29/99/96/1128299996.db2.gz QUMXWCJUWLGSNU-LBPRGKRZSA-N 1 1 277.408 3.540 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2cccc(F)c2)cc1C ZINC000915808077 1128340963 /nfs/dbraw/zinc/34/09/63/1128340963.db2.gz SCFWQHUVEJNIIK-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cc(C)ccc2C)c1O ZINC000763378852 1128426677 /nfs/dbraw/zinc/42/66/77/1128426677.db2.gz FSYBROOMGWEFPD-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC(C)C ZINC000917454586 1128501237 /nfs/dbraw/zinc/50/12/37/1128501237.db2.gz UNWPMBRWKGQIKZ-UHFFFAOYSA-N 1 1 279.424 3.873 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@@H]2CCCCO2)cc1C(C)C ZINC000918735201 1128569663 /nfs/dbraw/zinc/56/96/63/1128569663.db2.gz HTMDGJXCRCADFD-INIZCTEOSA-N 1 1 291.435 3.825 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](CC2CC2)C(C)C)c1O ZINC000042588140 1128578964 /nfs/dbraw/zinc/57/89/64/1128578964.db2.gz WPIDLZXDPVBYFS-UHFFFAOYSA-N 1 1 295.810 3.869 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](CC2CC2)C(C)C)c1O ZINC000042588140 1128578966 /nfs/dbraw/zinc/57/89/66/1128578966.db2.gz WPIDLZXDPVBYFS-UHFFFAOYSA-N 1 1 295.810 3.869 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000778984666 1128673734 /nfs/dbraw/zinc/67/37/34/1128673734.db2.gz HLOOAGKWXXAZSX-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccccc1O ZINC000778995538 1128674891 /nfs/dbraw/zinc/67/48/91/1128674891.db2.gz BISPTMOTSFHFCL-UHFFFAOYSA-N 1 1 255.361 3.723 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000748084893 1117940505 /nfs/dbraw/zinc/94/05/05/1117940505.db2.gz XXLMGULHIUEDQS-ZDUSSCGKSA-N 1 1 270.376 3.562 20 10 CHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000179578506 1128748590 /nfs/dbraw/zinc/74/85/90/1128748590.db2.gz XGLFVBJYTAXYJL-BEFAXECRSA-N 1 1 297.398 3.663 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1cc(Br)ccc1O ZINC000211452925 1118050005 /nfs/dbraw/zinc/05/00/05/1118050005.db2.gz DEEOUNRRIQQUCA-NSHDSACASA-N 1 1 298.224 3.919 20 10 CHCDMO Cc1ccc(C)c(C[N@@H+](C2CCC2)C2CCOCC2)c1O ZINC001140184672 1118254917 /nfs/dbraw/zinc/25/49/17/1118254917.db2.gz DPTANVKQSYBNDL-UHFFFAOYSA-N 1 1 289.419 3.543 20 10 CHCDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1cccc(Cl)c1[O-] ZINC001652674273 1118272601 /nfs/dbraw/zinc/27/26/01/1118272601.db2.gz BGYILUKQMKVIAA-JTQLQIEISA-N 1 1 253.773 3.666 20 10 CHCDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1O ZINC000179933883 1128767218 /nfs/dbraw/zinc/76/72/18/1128767218.db2.gz XOTSQKBIKOYMED-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO Cc1ccc(O[C@H]2CCC[N@@H+](Cc3ccccc3O)C2)cc1 ZINC001203556915 1118389347 /nfs/dbraw/zinc/38/93/47/1118389347.db2.gz WYIAOMLWQIIESB-SFHVURJKSA-N 1 1 297.398 3.744 20 10 CHCDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1O ZINC000180245007 1128782626 /nfs/dbraw/zinc/78/26/26/1128782626.db2.gz ZHWXOMFJNGMJJX-MRXNPFEDSA-N 1 1 288.366 3.597 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1c(O)cccc1Br ZINC000707138803 1118642896 /nfs/dbraw/zinc/64/28/96/1118642896.db2.gz HODGWVMYVMZYHB-WDEREUQCSA-N 1 1 298.224 3.918 20 10 CHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1c(O)cccc1Br ZINC000707138798 1118642902 /nfs/dbraw/zinc/64/29/02/1118642902.db2.gz HODGWVMYVMZYHB-MNOVXSKESA-N 1 1 298.224 3.918 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000754725996 1118645997 /nfs/dbraw/zinc/64/59/97/1118645997.db2.gz JKNJJWNXEHJQLQ-CQSZACIVSA-N 1 1 271.360 3.592 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000180449778 1128792001 /nfs/dbraw/zinc/79/20/01/1128792001.db2.gz VDRLZRSLLDEARG-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc3ccccc3o2)c1 ZINC000180482847 1128794229 /nfs/dbraw/zinc/79/42/29/1128794229.db2.gz IQSHGZFWIVBCLY-UHFFFAOYSA-N 1 1 297.354 3.779 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1O ZINC000180488856 1128794405 /nfs/dbraw/zinc/79/44/05/1128794405.db2.gz ARAMZQRRWCLZAR-GOSISDBHSA-N 1 1 296.414 3.777 20 10 CHCDMO Cc1cccc(C[N@H+](CCc2nccs2)C(C)C)c1O ZINC000180538525 1128796053 /nfs/dbraw/zinc/79/60/53/1128796053.db2.gz MNABZSCGIVSVNI-UHFFFAOYSA-N 1 1 290.432 3.610 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC000131587469 1118761111 /nfs/dbraw/zinc/76/11/11/1118761111.db2.gz GRJWIQORBRGMBR-MRXNPFEDSA-N 1 1 283.371 3.738 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000131997114 1118786998 /nfs/dbraw/zinc/78/69/98/1118786998.db2.gz DLCXNBXZOKFSJD-INIZCTEOSA-N 1 1 283.371 3.520 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000226561833 1119157473 /nfs/dbraw/zinc/15/74/73/1119157473.db2.gz AWPDXFIRAFBXBC-DOMZBBRYSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000179556350 1119751757 /nfs/dbraw/zinc/75/17/57/1119751757.db2.gz DDFJRVWORBRUAO-MRXNPFEDSA-N 1 1 285.412 3.682 20 10 CHCDMO Oc1cccc(Cl)c1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000310780067 1119950617 /nfs/dbraw/zinc/95/06/17/1119950617.db2.gz FIHOWEZFWVXIMA-TXEJJXNPSA-N 1 1 265.784 3.668 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C[C@@H]1C ZINC000162897427 1120003799 /nfs/dbraw/zinc/00/37/99/1120003799.db2.gz AADSSOBQWGMYGS-MNOVXSKESA-N 1 1 253.773 3.524 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)[C@@H](C)C(C)C)c1O ZINC000092590298 1120221629 /nfs/dbraw/zinc/22/16/29/1120221629.db2.gz WDQKQEFKBCHAEK-ZDUSSCGKSA-N 1 1 265.397 3.657 20 10 CHCDMO CC[N@@H+](Cc1cccs1)Cc1cc(F)ccc1O ZINC000179888521 1120257071 /nfs/dbraw/zinc/25/70/71/1120257071.db2.gz HBGICFGFGFFHRO-UHFFFAOYSA-N 1 1 265.353 3.615 20 10 CHCDMO Cc1cccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1O ZINC000180483226 1120276516 /nfs/dbraw/zinc/27/65/16/1120276516.db2.gz CXDJOSOZUFFGEP-LSDHHAIUSA-N 1 1 277.433 3.561 20 10 CHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668249 1120279348 /nfs/dbraw/zinc/27/93/48/1120279348.db2.gz ODWQRYCQDXHAOW-ZFWWWQNUSA-N 1 1 295.448 3.507 20 10 CHCDMO COc1cc(C)c(C)cc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001238766221 1131243626 /nfs/dbraw/zinc/24/36/26/1131243626.db2.gz IUCPELAAKASFQP-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO C[C@H]([NH2+]CCO[C@@H]1CCCC[C@H]1C)c1ccc(F)cc1O ZINC000756443669 1120350283 /nfs/dbraw/zinc/35/02/83/1120350283.db2.gz TZXQCIPKWJCUDK-IIYDPXPESA-N 1 1 295.398 3.777 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1ccc(F)cc1O ZINC000857082340 1120628128 /nfs/dbraw/zinc/62/81/28/1120628128.db2.gz MUBCFYKZHMIDPT-RKDXNWHRSA-N 1 1 292.181 3.766 20 10 CHCDMO CSCCCCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000186783179 1120664469 /nfs/dbraw/zinc/66/44/69/1120664469.db2.gz IFIPRVWNJPWKAT-LLVKDONJSA-N 1 1 271.401 3.715 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3cccc(C)c3C2)c1 ZINC000763505681 1128942019 /nfs/dbraw/zinc/94/20/19/1128942019.db2.gz NLYFWNFYYNSSEC-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(F)cc1O ZINC000756784638 1120848730 /nfs/dbraw/zinc/84/87/30/1120848730.db2.gz POLVDRQZFHHAEN-GTNSWQLSSA-N 1 1 286.350 3.728 20 10 CHCDMO CC(C)(C)C1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137831582 1121173962 /nfs/dbraw/zinc/17/39/62/1121173962.db2.gz GGEWVRYUGMLJAQ-UHFFFAOYSA-N 1 1 265.372 3.789 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc(F)cc1O ZINC000702548621 1121204689 /nfs/dbraw/zinc/20/46/89/1121204689.db2.gz WBBUMAHDSKEPCQ-GXSJLCMTSA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000756446469 1121237962 /nfs/dbraw/zinc/23/79/62/1121237962.db2.gz QPSQDWBRRJCHGM-NEPJUHHUSA-N 1 1 291.341 3.952 20 10 CHCDMO Cc1ncoc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000893863597 1121432806 /nfs/dbraw/zinc/43/28/06/1121432806.db2.gz JRSYGLVCHBZFFK-UHFFFAOYSA-N 1 1 299.418 3.605 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c([O-])cccc2F)cn1 ZINC001137840057 1121441729 /nfs/dbraw/zinc/44/17/29/1121441729.db2.gz QGSNTCYFXCNWIS-INIZCTEOSA-N 1 1 286.350 3.572 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2F)cn1 ZINC001137840057 1121441732 /nfs/dbraw/zinc/44/17/32/1121441732.db2.gz QGSNTCYFXCNWIS-INIZCTEOSA-N 1 1 286.350 3.572 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c(O)cccc2F)cn1 ZINC001137840057 1121441733 /nfs/dbraw/zinc/44/17/33/1121441733.db2.gz QGSNTCYFXCNWIS-INIZCTEOSA-N 1 1 286.350 3.572 20 10 CHCDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894017970 1121454251 /nfs/dbraw/zinc/45/42/51/1121454251.db2.gz UWSKTKIJVMWRHB-SNVBAGLBSA-N 1 1 293.313 3.569 20 10 CHCDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC000894017970 1121454256 /nfs/dbraw/zinc/45/42/56/1121454256.db2.gz UWSKTKIJVMWRHB-SNVBAGLBSA-N 1 1 293.313 3.569 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](CC)Cc2ccoc2)cc1 ZINC000773746583 1121790392 /nfs/dbraw/zinc/79/03/92/1121790392.db2.gz AELJJYOFYJQZED-UHFFFAOYSA-N 1 1 272.392 3.758 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000773757504 1121799852 /nfs/dbraw/zinc/79/98/52/1121799852.db2.gz ZQVWXZJHJCCZHR-IBGZPJMESA-N 1 1 295.430 3.875 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](Cc2cccnc2)C2CC2)cc1 ZINC000773808704 1121863401 /nfs/dbraw/zinc/86/34/01/1121863401.db2.gz LZKVDIHKXJOWFZ-UHFFFAOYSA-N 1 1 295.430 3.702 20 10 CHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCCO1)C1CCCC1 ZINC000732204359 1121911651 /nfs/dbraw/zinc/91/16/51/1121911651.db2.gz JONYHHJRJJKHDX-KRWDZBQOSA-N 1 1 289.419 3.706 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC001179850589 1121917076 /nfs/dbraw/zinc/91/70/76/1121917076.db2.gz YQTWEIQTMFWVNM-HNNXBMFYSA-N 1 1 299.418 3.618 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)C[C@@H]2C)c(Cl)c1 ZINC001179898775 1121918501 /nfs/dbraw/zinc/91/85/01/1121918501.db2.gz UIQUZOGPDXCUSL-MNOVXSKESA-N 1 1 253.773 3.584 20 10 CHCDMO CC[C@H]1CCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001179863580 1121921786 /nfs/dbraw/zinc/92/17/86/1121921786.db2.gz PMPSOVFHVQGDGL-YERXGYGTSA-N 1 1 258.409 3.640 20 10 CHCDMO CC1(C)CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000732980359 1121948259 /nfs/dbraw/zinc/94/82/59/1121948259.db2.gz IOTQHLGXDGBGPR-UHFFFAOYSA-N 1 1 270.376 3.562 20 10 CHCDMO CC[C@H](C)C[N@@H+](C)Cc1c([O-])ccc(Cl)c1F ZINC001180262003 1121969164 /nfs/dbraw/zinc/96/91/64/1121969164.db2.gz HCTJODSXRJZLOH-VIFPVBQESA-N 1 1 259.752 3.663 20 10 CHCDMO CC[C@H](C)C[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC001180262003 1121969169 /nfs/dbraw/zinc/96/91/69/1121969169.db2.gz HCTJODSXRJZLOH-VIFPVBQESA-N 1 1 259.752 3.663 20 10 CHCDMO CC[C@H](C)C[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC001180262003 1121969173 /nfs/dbraw/zinc/96/91/73/1121969173.db2.gz HCTJODSXRJZLOH-VIFPVBQESA-N 1 1 259.752 3.663 20 10 CHCDMO CC(C)OCCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613550 1122000401 /nfs/dbraw/zinc/00/04/01/1122000401.db2.gz BBQYFDXZLUMVKJ-UHFFFAOYSA-N 1 1 291.435 3.952 20 10 CHCDMO Cc1nnc([C@H](C)[NH2+]Cc2cc(C(C)C)ccc2O)s1 ZINC001180687275 1122007785 /nfs/dbraw/zinc/00/77/85/1122007785.db2.gz OQPWTTGTFMAETJ-JTQLQIEISA-N 1 1 291.420 3.526 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC001180907534 1122022098 /nfs/dbraw/zinc/02/20/98/1122022098.db2.gz QGORDNOYBPEOOC-CYBMUJFWSA-N 1 1 287.325 3.863 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]C1(Cc2ccccc2)CC1 ZINC001180971032 1122027272 /nfs/dbraw/zinc/02/72/72/1122027272.db2.gz ZPDJDEGNFMFOSG-UHFFFAOYSA-N 1 1 287.790 3.911 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC001181696866 1122073267 /nfs/dbraw/zinc/07/32/67/1122073267.db2.gz CGZGADSWAFHUOH-KRWDZBQOSA-N 1 1 299.418 3.966 20 10 CHCDMO CCOC[C@H](C)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774359682 1122157053 /nfs/dbraw/zinc/15/70/53/1122157053.db2.gz OGYVXIAHVCEBJO-IUCAKERBSA-N 1 1 292.206 3.775 20 10 CHCDMO COc1cc(C)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC001183673119 1122234046 /nfs/dbraw/zinc/23/40/46/1122234046.db2.gz PCFCUARBBAASPJ-AWEZNQCLSA-N 1 1 297.398 3.829 20 10 CHCDMO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1c(O)cccc1F ZINC001183920006 1122248360 /nfs/dbraw/zinc/24/83/60/1122248360.db2.gz SKOPYHSGBAIYLS-NEPJUHHUSA-N 1 1 253.361 3.836 20 10 CHCDMO Cc1cccc(CC[C@H](C)[NH2+]Cc2c(O)cccc2F)c1 ZINC001183919467 1122248552 /nfs/dbraw/zinc/24/85/52/1122248552.db2.gz LICRZQOFTVCDNL-AWEZNQCLSA-N 1 1 287.378 3.951 20 10 CHCDMO Oc1c(F)cccc1C[NH2+]CC1CC(c2ccccc2)C1 ZINC000802659987 1122438362 /nfs/dbraw/zinc/43/83/62/1122438362.db2.gz UPCGTDSVMYXNCU-UHFFFAOYSA-N 1 1 285.362 3.815 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC001191085824 1122576581 /nfs/dbraw/zinc/57/65/81/1122576581.db2.gz TWNJBDKKVAYKSF-SJLPKXTDSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001203752004 1122634541 /nfs/dbraw/zinc/63/45/41/1122634541.db2.gz OTGFZYYWGUMTPA-UHFFFAOYSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1cccc(C[N@@H+](C)CCCc2ccccc2)c1O ZINC000775651666 1122868760 /nfs/dbraw/zinc/86/87/60/1122868760.db2.gz QGSCYCPGYXAGEA-UHFFFAOYSA-N 1 1 269.388 3.765 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC001196253382 1122913602 /nfs/dbraw/zinc/91/36/02/1122913602.db2.gz CWDWRRBRRZMSMT-KRWDZBQOSA-N 1 1 272.436 3.765 20 10 CHCDMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775765544 1122949316 /nfs/dbraw/zinc/94/93/16/1122949316.db2.gz PPQKYSIYMVELSH-SFHVURJKSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1cccc(C[N@@H+](Cc2ccc(O)c(O)c2)C2CC2)c1C ZINC001203883060 1122967539 /nfs/dbraw/zinc/96/75/39/1122967539.db2.gz CYJOSVSPFNPVIG-UHFFFAOYSA-N 1 1 297.398 3.879 20 10 CHCDMO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(N(C)C)cc1 ZINC000775833773 1122987301 /nfs/dbraw/zinc/98/73/01/1122987301.db2.gz LUTPUZLUVZMFJA-CYBMUJFWSA-N 1 1 295.386 3.745 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccccc2F)c1 ZINC000216024527 1123020016 /nfs/dbraw/zinc/02/00/16/1123020016.db2.gz VTDRHYIWUWZKCM-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000776013187 1123034982 /nfs/dbraw/zinc/03/49/82/1123034982.db2.gz LFDDVBTVWZOCBI-YPMHNXCESA-N 1 1 287.325 3.863 20 10 CHCDMO C[C@H]([NH2+]CCCOC(C)(C)C)c1ccc(Cl)cc1O ZINC000850524587 1123281271 /nfs/dbraw/zinc/28/12/71/1123281271.db2.gz COKGCKODLVKMRF-NSHDSACASA-N 1 1 285.815 3.901 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccoc1)c1cccc(C(F)(F)F)c1O ZINC000850532851 1123285870 /nfs/dbraw/zinc/28/58/70/1123285870.db2.gz YGPZBDRVMSIZQZ-SNVBAGLBSA-N 1 1 299.292 3.897 20 10 CHCDMO CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(F)cc1O ZINC000850537595 1123288389 /nfs/dbraw/zinc/28/83/89/1123288389.db2.gz WEGUNKDZUSUGLR-WCQYABFASA-N 1 1 273.298 3.617 20 10 CHCDMO CC(C)(C)C(F)(F)C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000850572258 1123295567 /nfs/dbraw/zinc/29/55/67/1123295567.db2.gz IYLRHFOKPSLYRE-LLVKDONJSA-N 1 1 269.335 3.651 20 10 CHCDMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccccc1O ZINC000851841502 1123384520 /nfs/dbraw/zinc/38/45/20/1123384520.db2.gz UIQWTCULSQLNPZ-NSHDSACASA-N 1 1 257.324 3.505 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H]1CC[C@H](OC)C1 ZINC000852019036 1123393350 /nfs/dbraw/zinc/39/33/50/1123393350.db2.gz TUFNGHSRZSHVSR-CVEARBPZSA-N 1 1 277.408 3.562 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)O1 ZINC000111168329 1123428360 /nfs/dbraw/zinc/42/83/60/1123428360.db2.gz ACNKTYNDCMHGMV-ZFWWWQNUSA-N 1 1 285.387 3.545 20 10 CHCDMO Cc1csc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)n1 ZINC000113334665 1123521511 /nfs/dbraw/zinc/52/15/11/1123521511.db2.gz KRQJTFKSPAXPDX-NSHDSACASA-N 1 1 293.411 3.507 20 10 CHCDMO Cc1ccc(C[N@H+](Cc2ccccn2)CC(C)C)c(O)c1 ZINC000896661559 1123609901 /nfs/dbraw/zinc/60/99/01/1123609901.db2.gz RWNKJGXGYXHVJJ-UHFFFAOYSA-N 1 1 284.403 3.754 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cc(F)cc(F)c1O ZINC000858575532 1123663940 /nfs/dbraw/zinc/66/39/40/1123663940.db2.gz AETKFYDQVOSCMV-SFYZADRCSA-N 1 1 284.331 3.539 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccns1)c1ccc(F)cc1O ZINC000858577668 1123664795 /nfs/dbraw/zinc/66/47/95/1123664795.db2.gz UNZOSWGHYOXFLG-BXKDBHETSA-N 1 1 280.368 3.790 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)ccc1N(C)C ZINC000859836911 1123713136 /nfs/dbraw/zinc/71/31/36/1123713136.db2.gz BXAKTAHMNVWEQT-ZDUSSCGKSA-N 1 1 282.378 3.681 20 10 CHCDMO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3cncn3c2)c(O)c1 ZINC000840780998 1123796473 /nfs/dbraw/zinc/79/64/73/1123796473.db2.gz XQBDUQGCBUBWEQ-CQSZACIVSA-N 1 1 295.386 3.508 20 10 CHCDMO CC[C@@H](C)[N@@H+](CCO)Cc1cc(-c2ccccc2)ccc1O ZINC000862387254 1123806283 /nfs/dbraw/zinc/80/62/83/1123806283.db2.gz JEOLOMRNQHIMOB-OAHLLOKOSA-N 1 1 299.414 3.652 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc2ccncc21)[C@@H]1CCC(C)(C)C1 ZINC000794686839 1123927840 /nfs/dbraw/zinc/92/78/40/1123927840.db2.gz RYLLLQPBGPOWLJ-CQSZACIVSA-N 1 1 284.403 3.951 20 10 CHCDMO COC1(C[NH2+][C@H](C)c2ccc(F)cc2O)CCC(C)CC1 ZINC000794831413 1123962051 /nfs/dbraw/zinc/96/20/51/1123962051.db2.gz DFVLMWOAMFLCTC-UIORMTCPSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(F)cc1O ZINC000840884350 1123995782 /nfs/dbraw/zinc/99/57/82/1123995782.db2.gz KWDRIGCBTUJNKM-FZMZJTMJSA-N 1 1 281.371 3.530 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1c(O)cccc1F ZINC001119438114 1131254704 /nfs/dbraw/zinc/25/47/04/1131254704.db2.gz IDHXFZLHOWTOHD-ZRUFSTJUSA-N 1 1 285.309 3.616 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000872721386 1124727852 /nfs/dbraw/zinc/72/78/52/1124727852.db2.gz FOYCPQFUFMWBLJ-GJZGRUSLSA-N 1 1 299.439 3.730 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000876684692 1124971516 /nfs/dbraw/zinc/97/15/16/1124971516.db2.gz RDIODIMEKFUUQT-LJQANCHMSA-N 1 1 297.398 3.664 20 10 CHCDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c(O)c1 ZINC000877547097 1125041899 /nfs/dbraw/zinc/04/18/99/1125041899.db2.gz WQHLXGKGXHXZOH-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO CSc1ccc(C[N@H+]2Cc3cccc(O)c3C2)cc1 ZINC000877704027 1125066052 /nfs/dbraw/zinc/06/60/52/1125066052.db2.gz XBBYRLODUXFTGN-UHFFFAOYSA-N 1 1 271.385 3.630 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1cccc(OC(F)F)c1)C2 ZINC000877703779 1125066693 /nfs/dbraw/zinc/06/66/93/1125066693.db2.gz UOXDLOYKNVLURH-UHFFFAOYSA-N 1 1 291.297 3.509 20 10 CHCDMO CCC[N@H+](Cc1scnc1Cl)Cc1ccccc1O ZINC000878152214 1125123851 /nfs/dbraw/zinc/12/38/51/1125123851.db2.gz WHFVTTHEVWDMQR-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO CCC[N@@H+](Cc1scnc1Cl)Cc1ccccc1O ZINC000878152214 1125123855 /nfs/dbraw/zinc/12/38/55/1125123855.db2.gz WHFVTTHEVWDMQR-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1O ZINC000127579356 1125202263 /nfs/dbraw/zinc/20/22/63/1125202263.db2.gz LVSXDCKMRQSJHT-YOEHRIQHSA-N 1 1 297.398 3.779 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000211442640 1125306176 /nfs/dbraw/zinc/30/61/76/1125306176.db2.gz MTUKZRQVZJZBKJ-RISCZKNCSA-N 1 1 265.784 3.810 20 10 CHCDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882941867 1125363303 /nfs/dbraw/zinc/36/33/03/1125363303.db2.gz CTLRNIPESXKMKE-SNVBAGLBSA-N 1 1 293.313 3.530 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000883016411 1125368546 /nfs/dbraw/zinc/36/85/46/1125368546.db2.gz YLRVELYQJGKZQP-UHFFFAOYSA-N 1 1 293.288 3.588 20 10 CHCDMO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883099208 1125371436 /nfs/dbraw/zinc/37/14/36/1125371436.db2.gz MVHFLFXLRJMEAK-LLVKDONJSA-N 1 1 297.267 3.737 20 10 CHCDMO CC(C)(C)c1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)o1 ZINC000883199836 1125376711 /nfs/dbraw/zinc/37/67/11/1125376711.db2.gz QGMNEXUARUOVOG-UHFFFAOYSA-N 1 1 295.329 3.851 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]CC[C@H]1CCCC1(F)F ZINC000883264507 1125388050 /nfs/dbraw/zinc/38/80/50/1125388050.db2.gz CMNYVWRMXQSDGS-SNVBAGLBSA-N 1 1 291.288 3.586 20 10 CHCDMO CC(C)C[C@@H]1COCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000733790086 1129270410 /nfs/dbraw/zinc/27/04/10/1129270410.db2.gz FLRLAJUAPONNCW-MRXNPFEDSA-N 1 1 299.414 3.792 20 10 CHCDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000735668129 1129356166 /nfs/dbraw/zinc/35/61/66/1129356166.db2.gz POLZXCWPNSQWGK-OLZOCXBDSA-N 1 1 287.428 3.871 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000092670825 1129403188 /nfs/dbraw/zinc/40/31/88/1129403188.db2.gz WYJURJCDGMLYGC-UHFFFAOYSA-N 1 1 297.398 3.818 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1cncs1)C1CCCC1 ZINC000093319226 1129420876 /nfs/dbraw/zinc/42/08/76/1129420876.db2.gz XTQNLRDCFOQJED-UHFFFAOYSA-N 1 1 288.416 3.794 20 10 CHCDMO CC[N@H+](Cc1cc(C)ccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000093641122 1129426844 /nfs/dbraw/zinc/42/68/44/1129426844.db2.gz FUCNNJFOEYBJNQ-IBGZPJMESA-N 1 1 299.414 3.565 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](C)C(C)C)c1ccc(F)cc1O ZINC000796771269 1129432039 /nfs/dbraw/zinc/43/20/39/1129432039.db2.gz IHQQCCYOMSHZJM-FZMZJTMJSA-N 1 1 253.361 3.864 20 10 CHCDMO CCCC(O)(CCC)C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796772016 1129445840 /nfs/dbraw/zinc/44/58/40/1129445840.db2.gz OOTWWMSXTNJSER-HNNXBMFYSA-N 1 1 297.414 3.903 20 10 CHCDMO CCN(CC)c1ccc(CNc2ccc(C)c[nH+]2)cc1F ZINC000742405971 1129476653 /nfs/dbraw/zinc/47/66/53/1129476653.db2.gz SADXFQIXPUOYED-UHFFFAOYSA-N 1 1 287.382 3.987 20 10 CHCDMO CC(C)C[C@H]1CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000744437583 1129578317 /nfs/dbraw/zinc/57/83/17/1129578317.db2.gz WRGGANFVWCUDFI-CQSZACIVSA-N 1 1 273.420 3.749 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](C)C2)c1O ZINC000252854567 1129598908 /nfs/dbraw/zinc/59/89/08/1129598908.db2.gz KUUJYUUAPIHUAC-WDEREUQCSA-N 1 1 283.799 3.532 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cccc2ncccc12 ZINC001137630957 1131388071 /nfs/dbraw/zinc/38/80/71/1131388071.db2.gz XRXQSMRQYSHHPC-UHFFFAOYSA-N 1 1 292.382 3.963 20 10 CHCDMO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)nc1 ZINC000746448582 1129665257 /nfs/dbraw/zinc/66/52/57/1129665257.db2.gz AKULYPCVTKTQIC-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CC/C=C/CC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000767325849 1129786127 /nfs/dbraw/zinc/78/61/27/1129786127.db2.gz XYCLZMNLCPGVFO-IDOMTICXSA-N 1 1 289.419 3.730 20 10 CHCDMO CCOc1ccc(C[N@@H+]([C@H](C)C(C)C)C2CC2)c(O)c1 ZINC000768137177 1129834594 /nfs/dbraw/zinc/83/45/94/1129834594.db2.gz HHIQKHSAHHICKV-CYBMUJFWSA-N 1 1 277.408 3.800 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)ccc1O ZINC000768131939 1129835245 /nfs/dbraw/zinc/83/52/45/1129835245.db2.gz CBAQFVQVIYMPHO-UHFFFAOYSA-N 1 1 298.430 3.789 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+]([C@@H](C)C(C)C)C2CC2)c1 ZINC000768138189 1129835270 /nfs/dbraw/zinc/83/52/70/1129835270.db2.gz PPGHPKKYAXBKDX-ZDUSSCGKSA-N 1 1 277.408 3.800 20 10 CHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(Cl)ccc1O ZINC000768175468 1129838818 /nfs/dbraw/zinc/83/88/18/1129838818.db2.gz PTYKSALOEWBFRL-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CC(C)=CC[NH2+]Cc1cc(C)cc(Br)c1O ZINC000381532287 1129840144 /nfs/dbraw/zinc/84/01/44/1129840144.db2.gz ZQNCCEYNUOITOL-UHFFFAOYSA-N 1 1 284.197 3.519 20 10 CHCDMO CCOc1cccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000768194593 1129841823 /nfs/dbraw/zinc/84/18/23/1129841823.db2.gz BZVRSNRUVXPWFO-CQSZACIVSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H]2CCCc3ccccc32)c1O ZINC000768193329 1129842590 /nfs/dbraw/zinc/84/25/90/1129842590.db2.gz KOUYEPAHYVFSQL-KRWDZBQOSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000768197849 1129843371 /nfs/dbraw/zinc/84/33/71/1129843371.db2.gz XYNFUCKHVDLRPG-ZDUSSCGKSA-N 1 1 283.371 3.520 20 10 CHCDMO CCOc1cccc(C[N@@H+](C(CC)CC)C2CC2)c1O ZINC000768256917 1129846747 /nfs/dbraw/zinc/84/67/47/1129846747.db2.gz GEJGETHKGGCNAM-UHFFFAOYSA-N 1 1 277.408 3.944 20 10 CHCDMO CC(C)[N@@H+](Cc1cccn1C)Cc1ccc(N(C)C)cc1 ZINC000768357596 1129853549 /nfs/dbraw/zinc/85/35/49/1129853549.db2.gz OSZHYKHRTHGERN-UHFFFAOYSA-N 1 1 285.435 3.502 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)c(O)c1 ZINC000768353929 1129853727 /nfs/dbraw/zinc/85/37/27/1129853727.db2.gz CKGDMHJSKWMCHR-KRWDZBQOSA-N 1 1 298.386 3.523 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCc3cc(F)ccc3C2)c1 ZINC000768482409 1129857601 /nfs/dbraw/zinc/85/76/01/1129857601.db2.gz XKVNSSGEMMGZKR-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cc(F)cc(C)c3C2)c1O ZINC000800537001 1129882544 /nfs/dbraw/zinc/88/25/44/1129882544.db2.gz XGYZFRGYRKGUDD-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1C ZINC000769101747 1129890468 /nfs/dbraw/zinc/89/04/68/1129890468.db2.gz GCCQFHJCYLNDME-GDBMZVCRSA-N 1 1 259.393 3.774 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCCc3ccccc3C2)c1 ZINC000769331321 1129903165 /nfs/dbraw/zinc/90/31/65/1129903165.db2.gz FOZYTVYQRUCWPR-UHFFFAOYSA-N 1 1 297.398 3.739 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCc3c(C)cccc3C2)c1O ZINC000769339594 1129903814 /nfs/dbraw/zinc/90/38/14/1129903814.db2.gz SUAGDCYMCIEQJP-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000769380284 1129905160 /nfs/dbraw/zinc/90/51/60/1129905160.db2.gz RCIVFMHUXINGTP-MRXNPFEDSA-N 1 1 298.405 3.881 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@](C)(CC)C2)c1O ZINC000769445631 1129910207 /nfs/dbraw/zinc/91/02/07/1129910207.db2.gz GXRRZRHBRDQOSV-KRWDZBQOSA-N 1 1 277.408 3.803 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769448502 1129910990 /nfs/dbraw/zinc/91/09/90/1129910990.db2.gz SRPOZHBIVYTDHG-IYBDPMFKSA-N 1 1 272.436 3.765 20 10 CHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1c(O)cccc1OC ZINC000769456428 1129911610 /nfs/dbraw/zinc/91/16/10/1129911610.db2.gz JUYMAMRIFNPXCQ-CYBMUJFWSA-N 1 1 263.381 3.555 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000769498649 1129913658 /nfs/dbraw/zinc/91/36/58/1129913658.db2.gz NTUSHKQWBQQRHK-HOCLYGCPSA-N 1 1 297.398 3.779 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000769499957 1129913928 /nfs/dbraw/zinc/91/39/28/1129913928.db2.gz XZXPFPXMDTXVTB-UHFFFAOYSA-N 1 1 297.354 3.779 20 10 CHCDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1c(O)cccc1OC ZINC000769536647 1129916409 /nfs/dbraw/zinc/91/64/09/1129916409.db2.gz CEAKINSKSOFHON-UKRRQHHQSA-N 1 1 277.408 3.801 20 10 CHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770303442 1129944235 /nfs/dbraw/zinc/94/42/35/1129944235.db2.gz HBMDPVZPQXUKNV-INIZCTEOSA-N 1 1 272.436 3.909 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC000770511041 1129948654 /nfs/dbraw/zinc/94/86/54/1129948654.db2.gz XEMZYZBWMCMPDJ-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c(O)cc1C ZINC000770671699 1129954930 /nfs/dbraw/zinc/95/49/30/1129954930.db2.gz UNUALMIXFUJHSF-AWEZNQCLSA-N 1 1 289.419 3.721 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1c(O)cccc1F ZINC000886591715 1129974269 /nfs/dbraw/zinc/97/42/69/1129974269.db2.gz ABWWWRCCVCAPCX-JGVFFNPUSA-N 1 1 265.250 3.523 20 10 CHCDMO Cc1cccc(N(Cc2ccc(N(C)C)cc2)C2CC2)[nH+]1 ZINC000771756750 1129989217 /nfs/dbraw/zinc/98/92/17/1129989217.db2.gz JVOGORFIDHBOBC-UHFFFAOYSA-N 1 1 281.403 3.625 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Cl)o2)cc1 ZINC000771935475 1129996806 /nfs/dbraw/zinc/99/68/06/1129996806.db2.gz VHQMPOISNGHCQH-UHFFFAOYSA-N 1 1 278.783 3.631 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000771939252 1129997247 /nfs/dbraw/zinc/99/72/47/1129997247.db2.gz ORMGQRYMUUBTBY-MRXNPFEDSA-N 1 1 253.345 3.648 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@H+]2C[C@H]1CCO[C@@H](C)C1 ZINC000785762724 1130054801 /nfs/dbraw/zinc/05/48/01/1130054801.db2.gz 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C[N@H+](Cc1cc2c(cc1O)CCC2)C[C@H]1CC=CCC1 ZINC000784012434 1130869177 /nfs/dbraw/zinc/86/91/77/1130869177.db2.gz CVORUPRHAFCMGT-AWEZNQCLSA-N 1 1 271.404 3.669 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170760806 1130904013 /nfs/dbraw/zinc/90/40/13/1130904013.db2.gz JHILKWOBWCOGBY-QKDCVEJESA-N 1 1 259.393 3.649 20 10 CHCDMO CC[C@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccc(F)cc1O ZINC000796781241 1130931942 /nfs/dbraw/zinc/93/19/42/1130931942.db2.gz XMSNRZKEDFIRSQ-HOTGVXAUSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@H]([NH2+]CCC1CCC1)c1ccc(F)cc1O ZINC000796837989 1130938293 /nfs/dbraw/zinc/93/82/93/1130938293.db2.gz GXCKICZWZRUSGG-AWEZNQCLSA-N 1 1 251.345 3.762 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000796929474 1130946397 /nfs/dbraw/zinc/94/63/97/1130946397.db2.gz OONHTSRHPYQQLD-UKRRQHHQSA-N 1 1 295.398 3.918 20 10 CHCDMO CC[C@@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccc(F)cc1O ZINC000796927965 1130946616 /nfs/dbraw/zinc/94/66/16/1130946616.db2.gz 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/nfs/dbraw/zinc/79/74/72/261797472.db2.gz BJPDKNSRZVQLPY-UHFFFAOYSA-N 1 1 283.371 3.510 20 10 CHCDMO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185103485 262041311 /nfs/dbraw/zinc/04/13/11/262041311.db2.gz PBOAFEJTPWCAPI-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000527926140 330296609 /nfs/dbraw/zinc/29/66/09/330296609.db2.gz OZQZIESUIRKGIC-VXGBXAGGSA-N 1 1 283.799 3.513 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000529646112 333503462 /nfs/dbraw/zinc/50/34/62/333503462.db2.gz ZNBPNQYNTZYNOD-MRXNPFEDSA-N 1 1 286.350 3.557 20 10 CHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@H](C)c1cccnc1 ZINC000290519872 521341010 /nfs/dbraw/zinc/34/10/10/521341010.db2.gz PZWCNROIBMBHCC-CQSZACIVSA-N 1 1 270.376 3.679 20 10 CHCDMO CC[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1O ZINC000037786259 522809453 /nfs/dbraw/zinc/80/94/53/522809453.db2.gz YFCJBFVHCCLLKQ-MRXNPFEDSA-N 1 1 290.451 3.696 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000291020361 523387430 /nfs/dbraw/zinc/38/74/30/523387430.db2.gz AEULXXRTRFCQAW-OLZOCXBDSA-N 1 1 287.325 3.945 20 10 CHCDMO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc(C)ccc1O ZINC000281087841 523558566 /nfs/dbraw/zinc/55/85/66/523558566.db2.gz JXNXVMZPIZNUOE-MRXNPFEDSA-N 1 1 299.418 3.644 20 10 CHCDMO Cc1cncc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000275936953 526191998 /nfs/dbraw/zinc/19/19/98/526191998.db2.gz BEQXYZRVTQQCSI-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CCC1CCC([N@@H+](C)Cc2cccc(OC)c2O)CC1 ZINC000133534357 1125469441 /nfs/dbraw/zinc/46/94/41/1125469441.db2.gz KXBKRYZPFPIZLM-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO C[N@H+](Cc1ccc(Cl)cc1O)CC1CC(F)(F)C1 ZINC001140464759 1118737757 /nfs/dbraw/zinc/73/77/57/1118737757.db2.gz BXBPKGBNYBYMEI-UHFFFAOYSA-N 1 1 275.726 3.523 20 10 CHCDMO CCCC[C@H](C)[N@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000312605951 1120493055 /nfs/dbraw/zinc/49/30/55/1120493055.db2.gz FITBRCDPWNZKAY-NSHDSACASA-N 1 1 281.371 3.744 20 10 CHCDMO CCCC[C@H](C)[N@@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000312605951 1120493058 /nfs/dbraw/zinc/49/30/58/1120493058.db2.gz FITBRCDPWNZKAY-NSHDSACASA-N 1 1 281.371 3.744 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1cc(F)cc(F)c1O ZINC000834885103 1131718763 /nfs/dbraw/zinc/71/87/63/1131718763.db2.gz GOKYEAMWRHELQP-IUCAKERBSA-N 1 1 291.288 3.756 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)c1 ZINC000840946858 1132312053 /nfs/dbraw/zinc/31/20/53/1132312053.db2.gz PPSDWZPNIHYAJV-JTQLQIEISA-N 1 1 289.753 3.831 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)CC(C)(C)C)cc1Cl ZINC001231870447 1132383157 /nfs/dbraw/zinc/38/31/57/1132383157.db2.gz BMIVGELANBLZTI-UHFFFAOYSA-N 1 1 255.789 3.832 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCCS1)c1ccc(Cl)cc1O ZINC000841761576 1132395758 /nfs/dbraw/zinc/39/57/58/1132395758.db2.gz YNZZWDBLYBOWNS-GXSJLCMTSA-N 1 1 271.813 3.592 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1ccsc1Cl)CC2 ZINC001233059644 1132569426 /nfs/dbraw/zinc/56/94/26/1132569426.db2.gz WSRASIMNQZBQLL-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccsc1Cl)CC2 ZINC001233059644 1132569431 /nfs/dbraw/zinc/56/94/31/1132569431.db2.gz WSRASIMNQZBQLL-UHFFFAOYSA-N 1 1 279.792 3.665 20 10 CHCDMO Oc1ccc(F)c(F)c1C[NH+]1CCCCCCCC1 ZINC001233335959 1132602876 /nfs/dbraw/zinc/60/28/76/1132602876.db2.gz SOPLJHOMVGKJMH-UHFFFAOYSA-N 1 1 269.335 3.827 20 10 CHCDMO CCOC1CC(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)C1 ZINC000841752232 1125584517 /nfs/dbraw/zinc/58/45/17/1125584517.db2.gz NJOMQCHVMUDPNJ-LKSINWNRSA-N 1 1 297.826 3.901 20 10 CHCDMO C[C@H]([NH2+]CCCC(F)(F)F)c1c(O)cccc1F ZINC000886534303 1125685324 /nfs/dbraw/zinc/68/53/24/1125685324.db2.gz FNICDVSSRFRRAX-QMMMGPOBSA-N 1 1 265.250 3.524 20 10 CHCDMO COC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886547474 1125688346 /nfs/dbraw/zinc/68/83/46/1125688346.db2.gz LYQJWJPEUIVLCE-WFASDCNBSA-N 1 1 289.350 3.570 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1c(O)cccc1F ZINC000886551467 1125690066 /nfs/dbraw/zinc/69/00/66/1125690066.db2.gz IKGHQKDAMHRTTG-STQMWFEESA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1c(O)cccc1F ZINC000886552233 1125690338 /nfs/dbraw/zinc/69/03/38/1125690338.db2.gz XARXQEQWAHLCII-UWVGGRQHSA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1c(O)cccc1F ZINC000886557256 1125690518 /nfs/dbraw/zinc/69/05/18/1125690518.db2.gz XAJDPAQIHMDLAY-DIFFPNOSSA-N 1 1 286.350 3.728 20 10 CHCDMO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1c(O)cccc1F ZINC000886615396 1125698059 /nfs/dbraw/zinc/69/80/59/1125698059.db2.gz FNPTYCMMLFQBSK-GFCCVEGCSA-N 1 1 288.366 3.555 20 10 CHCDMO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)c2c(O)cccc2F)CCO1 ZINC000886580247 1125693071 /nfs/dbraw/zinc/69/30/71/1125693071.db2.gz BFHQOHLKHGFNQP-HZSPNIEDSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1cccc(CCC[NH2+][C@@H](C)c2c(O)cccc2F)n1 ZINC000886609123 1125697055 /nfs/dbraw/zinc/69/70/55/1125697055.db2.gz MLASGARGWFNZCN-ZDUSSCGKSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1c(O)cccc1F ZINC000886638124 1125701251 /nfs/dbraw/zinc/70/12/51/1125701251.db2.gz MMNAIRZLBIBAMI-TVQRCGJNSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000719428238 1129333486 /nfs/dbraw/zinc/33/34/86/1129333486.db2.gz BZDKXWKDWJVDSH-SNVBAGLBSA-N 1 1 295.839 3.713 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000180178748 1126840836 /nfs/dbraw/zinc/84/08/36/1126840836.db2.gz TYDCFSCNDDRJBX-ZDUSSCGKSA-N 1 1 271.360 3.599 20 10 CHCDMO CCC[N@@H+](Cc1ncc(C)s1)Cc1ccccc1O ZINC000180523718 1126845388 /nfs/dbraw/zinc/84/53/88/1126845388.db2.gz WIWJKHYOTUPHIB-UHFFFAOYSA-N 1 1 276.405 3.569 20 10 CHCDMO CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000185807913 1126902885 /nfs/dbraw/zinc/90/28/85/1126902885.db2.gz KXWWFZWSGUBQHI-JTQLQIEISA-N 1 1 294.395 3.962 20 10 CHCDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466674 1126944432 /nfs/dbraw/zinc/94/44/32/1126944432.db2.gz DTKPVHMDMRTOGD-INIZCTEOSA-N 1 1 290.451 3.534 20 10 CHCDMO CC[C@H](C)[N@H+](C)Cc1cc(Cl)c(Cl)cc1O ZINC001236789097 1131006252 /nfs/dbraw/zinc/00/62/52/1131006252.db2.gz CBCYCAJHELTVNP-QMMMGPOBSA-N 1 1 262.180 3.929 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1cc(Cl)c(Cl)cc1O ZINC001236789097 1131006256 /nfs/dbraw/zinc/00/62/56/1131006256.db2.gz CBCYCAJHELTVNP-QMMMGPOBSA-N 1 1 262.180 3.929 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792145 1131008496 /nfs/dbraw/zinc/00/84/96/1131008496.db2.gz CHDJGYXIHZQHGK-SECBINFHSA-N 1 1 274.191 3.931 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CC[C@@H](C)C[C@@H]2C)c(Cl)c1 ZINC001236800740 1131008896 /nfs/dbraw/zinc/00/88/96/1131008896.db2.gz AZPUYJHMRADJCG-MNOVXSKESA-N 1 1 283.799 3.675 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792145 1131008488 /nfs/dbraw/zinc/00/84/88/1131008488.db2.gz CHDJGYXIHZQHGK-SECBINFHSA-N 1 1 274.191 3.931 20 10 CHCDMO CCC1CC[NH+](Cc2ccc(OC)c(Cl)c2O)CC1 ZINC001236804386 1131012045 /nfs/dbraw/zinc/01/20/45/1131012045.db2.gz YSJKCFAWEIIZQA-UHFFFAOYSA-N 1 1 283.799 3.676 20 10 CHCDMO COc1ccc(C[NH+]2CCC(C)(C)CC2)c(O)c1Cl ZINC001236813900 1131012073 /nfs/dbraw/zinc/01/20/73/1131012073.db2.gz RGZSOCNRBLPEMN-UHFFFAOYSA-N 1 1 283.799 3.676 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001237082767 1131047870 /nfs/dbraw/zinc/04/78/70/1131047870.db2.gz UVQHZFMWFQANBH-DKCNOQQISA-N 1 1 290.165 3.631 20 10 CHCDMO Oc1ccc(Cl)c(Cl)c1C[N@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001237082767 1131047876 /nfs/dbraw/zinc/04/78/76/1131047876.db2.gz UVQHZFMWFQANBH-DKCNOQQISA-N 1 1 290.165 3.631 20 10 CHCDMO Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@@H](F)CC1 ZINC001237121379 1131055118 /nfs/dbraw/zinc/05/51/18/1131055118.db2.gz LUQZVDLYMNWUKM-SECBINFHSA-N 1 1 275.726 3.509 20 10 CHCDMO C[C@@H]1CCCC[N@H+]1Cc1cc(C(F)(F)F)ccc1O ZINC001237137095 1131056910 /nfs/dbraw/zinc/05/69/10/1131056910.db2.gz LPSYGZNMORMICB-SNVBAGLBSA-N 1 1 273.298 3.785 20 10 CHCDMO CCc1nc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000156419404 1127154946 /nfs/dbraw/zinc/15/49/46/1127154946.db2.gz ISEYBTWTQQYZGH-LBPRGKRZSA-N 1 1 289.448 3.622 20 10 CHCDMO Cc1cccc(O)c1C[N@@H+]1CC[C@H](C)C(F)(F)CC1 ZINC001237484663 1131104492 /nfs/dbraw/zinc/10/44/92/1131104492.db2.gz GQKDVJUPCOOGHF-LBPRGKRZSA-N 1 1 269.335 3.568 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CCCCS1 ZINC000816566973 1131112160 /nfs/dbraw/zinc/11/21/60/1131112160.db2.gz MWCDVJAUMIFCPI-JTQLQIEISA-N 1 1 289.803 3.560 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237814546 1131142403 /nfs/dbraw/zinc/14/24/03/1131142403.db2.gz SSGXEBXKZUGAFK-SNVBAGLBSA-N 1 1 271.763 3.949 20 10 CHCDMO CC[C@H]([NH2+]CC(C)(C)CCOC)c1ccc(F)cc1O ZINC000285944193 1127248183 /nfs/dbraw/zinc/24/81/83/1127248183.db2.gz DOQJJJNKUVULEL-AWEZNQCLSA-N 1 1 283.387 3.635 20 10 CHCDMO CC[C@H]([NH2+]CC1(CCOC)CCC1)c1ccc(F)cc1O ZINC000286000029 1127251824 /nfs/dbraw/zinc/25/18/24/1127251824.db2.gz IOEUHZIYEUTJFB-HNNXBMFYSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000286047312 1127256433 /nfs/dbraw/zinc/25/64/33/1127256433.db2.gz KBBKOTALXYYLCR-ZFWWWQNUSA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)C)C1)c1ccc(F)cc1O ZINC000286160207 1127261380 /nfs/dbraw/zinc/26/13/80/1127261380.db2.gz PWBHGADTXDQOIC-KMFMINBZSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1cccc(CCC[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000287654267 1127311705 /nfs/dbraw/zinc/31/17/05/1127311705.db2.gz VCMSJVHDEDOTTO-CYBMUJFWSA-N 1 1 288.366 3.518 20 10 CHCDMO CCSCC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168807496 1127471403 /nfs/dbraw/zinc/47/14/03/1127471403.db2.gz ISRPPBGPGPUQNW-GHMZBOCLSA-N 1 1 271.401 3.714 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1 ZINC000295210668 1127627836 /nfs/dbraw/zinc/62/78/36/1127627836.db2.gz LMLPEQCBPQHOIZ-YOEHRIQHSA-N 1 1 298.434 3.525 20 10 CHCDMO CCC(CC)[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)N(C)C ZINC000062745412 1127772894 /nfs/dbraw/zinc/77/28/94/1127772894.db2.gz LKEZYHLUGSIEKX-MLGOLLRUSA-N 1 1 296.430 3.548 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1ccc(F)cc1O ZINC000062745136 1127773104 /nfs/dbraw/zinc/77/31/04/1127773104.db2.gz IUSQLUHBZOBLBR-NWDGAFQWSA-N 1 1 277.339 3.796 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc(F)cc1O ZINC000062747636 1127773662 /nfs/dbraw/zinc/77/36/62/1127773662.db2.gz BRBFIYNDTGJHTP-WCQYABFASA-N 1 1 271.335 3.522 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(C)cc1O ZINC000373559706 1127848815 /nfs/dbraw/zinc/84/88/15/1127848815.db2.gz CPXRPEVAYCWMQT-HUUCEWRRSA-N 1 1 285.391 3.542 20 10 CHCDMO CCC1([NH3+])CC[NH+]([C@H](C)c2ccc3ccccc3c2[O-])CC1 ZINC000925760706 1128140959 /nfs/dbraw/zinc/14/09/59/1128140959.db2.gz RANADZVUJZVJAB-CQSZACIVSA-N 1 1 298.430 3.810 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001138220614 1128148051 /nfs/dbraw/zinc/14/80/51/1128148051.db2.gz IWDLKKYJJOYHDH-FUHWJXTLSA-N 1 1 270.420 3.661 20 10 CHCDMO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)C1CC1 ZINC000324207781 1128160442 /nfs/dbraw/zinc/16/04/42/1128160442.db2.gz CJUROFCSBPOJQB-ZUZCIYMTSA-N 1 1 251.345 3.617 20 10 CHCDMO Oc1cc2c(cc1C[N@@H+](C1CC1)C1CCCC1)CCC2 ZINC000915208915 1128291632 /nfs/dbraw/zinc/29/16/32/1128291632.db2.gz RPDVZNGYTVJSRA-UHFFFAOYSA-N 1 1 271.404 3.788 20 10 CHCDMO C[C@@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CCOC1(C)C ZINC000763204488 1128375706 /nfs/dbraw/zinc/37/57/06/1128375706.db2.gz KPOVTLAWKUMORN-ZDUSSCGKSA-N 1 1 285.387 3.545 20 10 CHCDMO Cc1ccc(C)c(C[N@H+](C)Cc2cc(F)ccc2O)c1 ZINC000763378321 1128427604 /nfs/dbraw/zinc/42/76/04/1128427604.db2.gz AECWWEVLMKHEFA-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc(C)ccc2C)c1 ZINC000763382509 1128430323 /nfs/dbraw/zinc/43/03/23/1128430323.db2.gz WKLYFSVHPNJTKR-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CC(C)CC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917073965 1128473707 /nfs/dbraw/zinc/47/37/07/1128473707.db2.gz KEBHAGPQHJQKEB-UHFFFAOYSA-N 1 1 260.425 3.763 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCc2ccc(F)cc2)cc1C ZINC000919948258 1128653316 /nfs/dbraw/zinc/65/33/16/1128653316.db2.gz HNIDDILCKPXAGP-UHFFFAOYSA-N 1 1 287.378 3.823 20 10 CHCDMO Cc1ccc(C[N@@H+](Cc2cc(F)ccc2O)C2CC2)o1 ZINC000778995781 1128674875 /nfs/dbraw/zinc/67/48/75/1128674875.db2.gz INVPYWZSFGZMMF-UHFFFAOYSA-N 1 1 275.323 3.597 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(C)c1O ZINC001238063549 1117766464 /nfs/dbraw/zinc/76/64/64/1117766464.db2.gz YKZYKOUJZOEFAS-OAHLLOKOSA-N 1 1 265.372 3.994 20 10 CHCDMO CC[C@H]1CCC[C@H]1[NH2+]Cc1cc(Cl)cc(C(C)=O)c1O ZINC001307682070 1117906477 /nfs/dbraw/zinc/90/64/77/1117906477.db2.gz FOAWGLHJKIPCTF-XHDPSFHLSA-N 1 1 295.810 3.917 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179563859 1128748005 /nfs/dbraw/zinc/74/80/05/1128748005.db2.gz HDGPDJUEEXMTQL-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccccc2)c1O ZINC000179596684 1128748767 /nfs/dbraw/zinc/74/87/67/1128748767.db2.gz FSDHSAJBDUMLGY-CQSZACIVSA-N 1 1 255.361 3.894 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c1O ZINC000779149043 1128752562 /nfs/dbraw/zinc/75/25/62/1128752562.db2.gz KCRWFMMGTAKMNI-ZANVPECISA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c1O ZINC000779149043 1128752566 /nfs/dbraw/zinc/75/25/66/1128752566.db2.gz KCRWFMMGTAKMNI-ZANVPECISA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cccc(C[N@@H+](Cc2ccc(C#N)cc2)C2CC2)c1O ZINC000179679017 1128753343 /nfs/dbraw/zinc/75/33/43/1128753343.db2.gz DQCZNXKCYLYCEP-UHFFFAOYSA-N 1 1 292.382 3.737 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000179701864 1128754796 /nfs/dbraw/zinc/75/47/96/1128754796.db2.gz NFENIQKITYFOOZ-ZDUSSCGKSA-N 1 1 271.360 3.594 20 10 CHCDMO COc1ccc([C@H](C)C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000179770473 1128758261 /nfs/dbraw/zinc/75/82/61/1128758261.db2.gz HWDBFWQDGIXADM-CQSZACIVSA-N 1 1 285.387 3.636 20 10 CHCDMO CC[C@H](C)[N@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653568 1118187803 /nfs/dbraw/zinc/18/78/03/1118187803.db2.gz BOCUDLJRWPBEGN-HOTGVXAUSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653568 1118187806 /nfs/dbraw/zinc/18/78/06/1118187806.db2.gz BOCUDLJRWPBEGN-HOTGVXAUSA-N 1 1 291.483 3.524 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C)CC2(c3ccccc3)CC2)c1 ZINC000188714552 1128763960 /nfs/dbraw/zinc/76/39/60/1128763960.db2.gz WKWKDOVSZOHGKW-UHFFFAOYSA-N 1 1 297.398 3.564 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)cc1C ZINC000179960122 1128768956 /nfs/dbraw/zinc/76/89/56/1128768956.db2.gz RMIMTTQDVFKVBV-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO CCC(CC)[C@H](CNCc1c(O)cccc1Cl)[NH+](C)C ZINC000083551807 1118356703 /nfs/dbraw/zinc/35/67/03/1118356703.db2.gz CXBKKVDQXSKUEC-HNNXBMFYSA-N 1 1 298.858 3.502 20 10 CHCDMO CCc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000084199925 1118372167 /nfs/dbraw/zinc/37/21/67/1118372167.db2.gz VKHFKJZDRZWFHB-GFCCVEGCSA-N 1 1 273.351 3.945 20 10 CHCDMO C[N@H+](Cc1ccc(Br)cc1O)C[C@H]1CC1(C)C ZINC001659739847 1118487633 /nfs/dbraw/zinc/48/76/33/1118487633.db2.gz UXNYDEXEIQOWCE-LLVKDONJSA-N 1 1 298.224 3.633 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001663672565 1118521786 /nfs/dbraw/zinc/52/17/86/1118521786.db2.gz SYKMXEXBGFPZBV-GFCCVEGCSA-N 1 1 265.397 3.577 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)CC2(O)CCCCCC2)cc1C ZINC000779203715 1128786957 /nfs/dbraw/zinc/78/69/57/1128786957.db2.gz HVVOZMMIUQLWRT-UHFFFAOYSA-N 1 1 291.435 3.526 20 10 CHCDMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1Cc1c(O)cccc1Br ZINC000707138840 1118643415 /nfs/dbraw/zinc/64/34/15/1118643415.db2.gz IDDACCIGBWYJTL-OUAUKWLOSA-N 1 1 298.224 3.631 20 10 CHCDMO CC(C)[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000780495424 1118712675 /nfs/dbraw/zinc/71/26/75/1118712675.db2.gz DTYNOFBEWKQLBQ-OAHLLOKOSA-N 1 1 284.403 3.808 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001140465627 1118742972 /nfs/dbraw/zinc/74/29/72/1118742972.db2.gz OLCXHQPOHCIGPZ-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001140466137 1118745200 /nfs/dbraw/zinc/74/52/00/1118745200.db2.gz YLNHTZCFJNOQMR-UHFFFAOYSA-N 1 1 277.751 3.803 20 10 CHCDMO C[C@@H]([NH2+]CCCC(F)(F)F)c1ccc(F)cc1O ZINC000148599957 1119336657 /nfs/dbraw/zinc/33/66/57/1119336657.db2.gz IMJHWOIUCYLKAV-MRVPVSSYSA-N 1 1 265.250 3.524 20 10 CHCDMO C[C@H](CCCO)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192949860 1119340539 /nfs/dbraw/zinc/34/05/39/1119340539.db2.gz CDZDJEMBHRJCLQ-RKDXNWHRSA-N 1 1 292.206 3.511 20 10 CHCDMO CC[C@H](C)C[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000708445613 1119466870 /nfs/dbraw/zinc/46/68/70/1119466870.db2.gz VGKSUFSGOKCUEZ-VHSXEESVSA-N 1 1 257.324 3.585 20 10 CHCDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000179661643 1119755957 /nfs/dbraw/zinc/75/59/57/1119755957.db2.gz MPKIKNMGENUVIZ-OAHLLOKOSA-N 1 1 290.476 3.614 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000708800443 1119865940 /nfs/dbraw/zinc/86/59/40/1119865940.db2.gz LCWNBRWLXXMXES-UHFFFAOYSA-N 1 1 277.383 3.934 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2ccccn2)cc1 ZINC000177999454 1119897882 /nfs/dbraw/zinc/89/78/82/1119897882.db2.gz XNAAEWKWWRBLRU-UHFFFAOYSA-N 1 1 297.446 3.602 20 10 CHCDMO COc1ccc(O)c([C@@H](C)Nc2cccc(C3CC3)[nH+]2)c1 ZINC000293512461 1120109197 /nfs/dbraw/zinc/10/91/97/1120109197.db2.gz AFVWCHXCBCAHJM-LLVKDONJSA-N 1 1 284.359 3.846 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccc(F)cc1O ZINC000311847009 1120113325 /nfs/dbraw/zinc/11/33/25/1120113325.db2.gz ILKOZAQZFKUGPM-TVRADYJESA-N 1 1 263.356 3.761 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116438856 1120118854 /nfs/dbraw/zinc/11/88/54/1120118854.db2.gz RPJMEZLRRZWCGW-HNNXBMFYSA-N 1 1 258.409 3.661 20 10 CHCDMO CC(C)OCCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000728688080 1120140392 /nfs/dbraw/zinc/14/03/92/1120140392.db2.gz DXWJQRNFQUOPQF-UHFFFAOYSA-N 1 1 292.467 3.778 20 10 CHCDMO CCC[N@@H+](Cc1sc(C)nc1C)Cc1ccccc1O ZINC000172772878 1120284633 /nfs/dbraw/zinc/28/46/33/1120284633.db2.gz YVJIDYPLMANGSG-UHFFFAOYSA-N 1 1 290.432 3.878 20 10 CHCDMO CCCC[N@@H+](Cc1cncc(F)c1)Cc1ccccc1O ZINC000282326502 1120353444 /nfs/dbraw/zinc/35/34/44/1120353444.db2.gz ANZZWTSSLJDSIM-UHFFFAOYSA-N 1 1 288.366 3.729 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3cccc(C)c3C2)c1 ZINC000763501914 1128913018 /nfs/dbraw/zinc/91/30/18/1128913018.db2.gz GJFGFBBJUKQDAN-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(F)cc1O ZINC000695731474 1120414364 /nfs/dbraw/zinc/41/43/64/1120414364.db2.gz SWBZYZRBEABSJI-LLVKDONJSA-N 1 1 263.356 3.905 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000220294358 1120552335 /nfs/dbraw/zinc/55/23/35/1120552335.db2.gz GUGHSWIFABWSIF-UONOGXRCSA-N 1 1 291.435 3.607 20 10 CHCDMO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000922666239 1120575561 /nfs/dbraw/zinc/57/55/61/1120575561.db2.gz YTIHMEBFWPHVFJ-JTQLQIEISA-N 1 1 295.304 3.969 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1cc(C)cc(OC)c1O ZINC000125511055 1120790523 /nfs/dbraw/zinc/79/05/23/1120790523.db2.gz UWNCCYSDZKRTNC-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c(O)c1 ZINC001237045316 1128952644 /nfs/dbraw/zinc/95/26/44/1128952644.db2.gz ITHQGSSJNZMEDU-IUODEOHRSA-N 1 1 265.372 3.696 20 10 CHCDMO C[C@@H]1CCCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000703198975 1121238254 /nfs/dbraw/zinc/23/82/54/1121238254.db2.gz ITMAVOOZSVZALS-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000703198975 1121238256 /nfs/dbraw/zinc/23/82/56/1121238256.db2.gz ITMAVOOZSVZALS-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO [O-]c1cccc(F)c1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001137838538 1121417313 /nfs/dbraw/zinc/41/73/13/1121417313.db2.gz CLHWRBXNUYQWMZ-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001137838538 1121417316 /nfs/dbraw/zinc/41/73/16/1121417316.db2.gz CLHWRBXNUYQWMZ-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001137838538 1121417320 /nfs/dbraw/zinc/41/73/20/1121417320.db2.gz CLHWRBXNUYQWMZ-CYBMUJFWSA-N 1 1 289.325 3.660 20 10 CHCDMO [O-]c1cccc(F)c1C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001137838877 1121423910 /nfs/dbraw/zinc/42/39/10/1121423910.db2.gz MBPOFSUOMGLFLI-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001137838877 1121423913 /nfs/dbraw/zinc/42/39/13/1121423913.db2.gz MBPOFSUOMGLFLI-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001137838877 1121423917 /nfs/dbraw/zinc/42/39/17/1121423917.db2.gz MBPOFSUOMGLFLI-AWEZNQCLSA-N 1 1 277.383 3.934 20 10 CHCDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2F)cn1 ZINC001137840058 1121443393 /nfs/dbraw/zinc/44/33/93/1121443393.db2.gz QGSNTCYFXCNWIS-MRXNPFEDSA-N 1 1 286.350 3.572 20 10 CHCDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2c(O)cccc2F)cn1 ZINC001137840058 1121443399 /nfs/dbraw/zinc/44/33/99/1121443399.db2.gz QGSNTCYFXCNWIS-MRXNPFEDSA-N 1 1 286.350 3.572 20 10 CHCDMO CCC[N@H+](Cc1nc(C(C)C)c[nH]1)Cc1ccccc1O ZINC000893983682 1121451366 /nfs/dbraw/zinc/45/13/66/1121451366.db2.gz FLWYXVLZRRDSLU-UHFFFAOYSA-N 1 1 287.407 3.651 20 10 CHCDMO CCC[N@@H+](Cc1nc(C(C)C)c[nH]1)Cc1ccccc1O ZINC000893983682 1121451367 /nfs/dbraw/zinc/45/13/67/1121451367.db2.gz FLWYXVLZRRDSLU-UHFFFAOYSA-N 1 1 287.407 3.651 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CCCCC1(F)F ZINC000708501054 1121468847 /nfs/dbraw/zinc/46/88/47/1121468847.db2.gz AOUNJGXTYQZXEJ-JTQLQIEISA-N 1 1 291.288 3.586 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCOc3ccccc3C2)cc1 ZINC000773746614 1121790335 /nfs/dbraw/zinc/79/03/35/1121790335.db2.gz MPVBIPCLHARETH-UHFFFAOYSA-N 1 1 296.414 3.537 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000773757509 1121799886 /nfs/dbraw/zinc/79/98/86/1121799886.db2.gz ZQVWXZJHJCCZHR-LJQANCHMSA-N 1 1 295.430 3.875 20 10 CHCDMO C=Cc1ccc(CC[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC001178778179 1121820033 /nfs/dbraw/zinc/82/00/33/1121820033.db2.gz IPMYYNIEBAYNFJ-UHFFFAOYSA-N 1 1 289.325 3.646 20 10 CHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000773816288 1121883659 /nfs/dbraw/zinc/88/36/59/1121883659.db2.gz FQBJAPUKGIKOSN-HNNXBMFYSA-N 1 1 280.481 3.716 20 10 CHCDMO Oc1ccccc1C[N@@H+](CC1CCCC1)C[C@@H]1CCCO1 ZINC000732203446 1121912140 /nfs/dbraw/zinc/91/21/40/1121912140.db2.gz VANJDGUKSZRQQM-KRWDZBQOSA-N 1 1 289.419 3.563 20 10 CHCDMO CCc1nc([C@@H](C)[NH2+]Cc2ccc(OC)c(C)c2)cs1 ZINC000732232266 1121914440 /nfs/dbraw/zinc/91/44/40/1121914440.db2.gz HQSTZQLMMYULNR-GFCCVEGCSA-N 1 1 290.432 3.873 20 10 CHCDMO CNc1ccc(C)cc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001179845867 1121917033 /nfs/dbraw/zinc/91/70/33/1121917033.db2.gz YQNJLSSFUJPWOI-UHFFFAOYSA-N 1 1 297.446 3.735 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1C)[C@@H](C)C(C)C ZINC001180042768 1121941871 /nfs/dbraw/zinc/94/18/71/1121941871.db2.gz JDACAKCUGZWQJN-HNNXBMFYSA-N 1 1 262.441 3.927 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2cccc(CC)c2O)cc1 ZINC001180488384 1121991683 /nfs/dbraw/zinc/99/16/83/1121991683.db2.gz LABWCEVCLNVBLI-UHFFFAOYSA-N 1 1 299.414 3.985 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCCC(C)(C)C1 ZINC001180896217 1122023611 /nfs/dbraw/zinc/02/36/11/1122023611.db2.gz CFFCCMLOLDXXMK-UHFFFAOYSA-N 1 1 260.425 3.683 20 10 CHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(Cl)cc1O ZINC001181102182 1122033476 /nfs/dbraw/zinc/03/34/76/1122033476.db2.gz JNAVLPFLUDFZJQ-GWCFXTLKSA-N 1 1 253.773 3.666 20 10 CHCDMO C[C@@H]1CCC[C@H](C[NH2+]Cc2cc(F)c(F)cc2O)[C@@H]1C ZINC001181233355 1122044691 /nfs/dbraw/zinc/04/46/91/1122044691.db2.gz AMZCUEKTLDGMSZ-IJLUTSLNSA-N 1 1 283.362 3.832 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c1 ZINC000779604442 1129031831 /nfs/dbraw/zinc/03/18/31/1129031831.db2.gz LQDZIBGXSRYYFZ-CQSZACIVSA-N 1 1 289.419 3.803 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+]C[C@@H]1CC2CCC1CC2 ZINC001182532921 1122173439 /nfs/dbraw/zinc/17/34/39/1122173439.db2.gz HUBAEQJQVSFJLP-MCIGGMRASA-N 1 1 281.346 3.586 20 10 CHCDMO CSCc1ccc(C[N@H+]2Cc3cccc(O)c3C2)cc1 ZINC001183455228 1122223960 /nfs/dbraw/zinc/22/39/60/1122223960.db2.gz RIGUITSCCVBMMC-UHFFFAOYSA-N 1 1 285.412 3.771 20 10 CHCDMO CCC(CC)(CC)C[NH2+]Cc1c(O)cccc1F ZINC001183918608 1122248417 /nfs/dbraw/zinc/24/84/17/1122248417.db2.gz ABJWDIMIWVTJKZ-UHFFFAOYSA-N 1 1 253.361 3.837 20 10 CHCDMO C[N@@H+](Cc1ccco1)Cc1ccc(N2CCCC2)cc1 ZINC001203278094 1122424475 /nfs/dbraw/zinc/42/44/75/1122424475.db2.gz ADRAKLCMTPEXDW-UHFFFAOYSA-N 1 1 270.376 3.512 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H](CC(C)C)C2)ccc1N(C)C ZINC001191344729 1122591615 /nfs/dbraw/zinc/59/16/15/1122591615.db2.gz ZYGPTYIMNLCNNF-QGZVFWFLSA-N 1 1 274.452 3.929 20 10 CHCDMO CC[C@@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1ccccc1O ZINC000775512389 1122635049 /nfs/dbraw/zinc/63/50/49/1122635049.db2.gz KGPGMBUSNYIIPN-CQSZACIVSA-N 1 1 295.386 3.818 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2)c1O ZINC000775634713 1122840420 /nfs/dbraw/zinc/84/04/20/1122840420.db2.gz VLBMQKSHXXNODN-UHFFFAOYSA-N 1 1 275.779 3.986 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)C2CCCC2)c1O ZINC000775644256 1122851813 /nfs/dbraw/zinc/85/18/13/1122851813.db2.gz CFDRWPRFJCFNEG-UHFFFAOYSA-N 1 1 253.773 3.728 20 10 CHCDMO Cc1cccc(C[N@@H+](Cc2ccccc2)C2CC2)c1O ZINC000775648067 1122857047 /nfs/dbraw/zinc/85/70/47/1122857047.db2.gz PAPMSXPSYRJNLD-UHFFFAOYSA-N 1 1 267.372 3.865 20 10 CHCDMO Cc1ccc(OCC[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775646868 1122857962 /nfs/dbraw/zinc/85/79/62/1122857962.db2.gz LASKGZKHIRNICL-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](c3ccco3)C2)c1O ZINC000775692925 1122911172 /nfs/dbraw/zinc/91/11/72/1122911172.db2.gz QPGGGFXDRIJAPZ-GFCCVEGCSA-N 1 1 291.778 3.937 20 10 CHCDMO Cc1cccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1O ZINC000775701321 1122912056 /nfs/dbraw/zinc/91/20/56/1122912056.db2.gz KICDQJHAJIBREY-IIAWOOMASA-N 1 1 259.393 3.854 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c1O ZINC000775700263 1122912404 /nfs/dbraw/zinc/91/24/04/1122912404.db2.gz LYDOXGQIHSVYJJ-CYBMUJFWSA-N 1 1 285.362 3.959 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H]2C)c1O ZINC000775737056 1122929070 /nfs/dbraw/zinc/92/90/70/1122929070.db2.gz NXWGJKWGEHFONA-ONGXEEELSA-N 1 1 253.773 3.584 20 10 CHCDMO CC(C)[C@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775765542 1122949529 /nfs/dbraw/zinc/94/95/29/1122949529.db2.gz PPQKYSIYMVELSH-GOSISDBHSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776013692 1123036698 /nfs/dbraw/zinc/03/66/98/1123036698.db2.gz NLMAAOJOKCYSSO-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO C[N@@H+](CCc1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001201602852 1123130815 /nfs/dbraw/zinc/13/08/15/1123130815.db2.gz CPRUMECORAUOPX-UHFFFAOYSA-N 1 1 294.442 3.961 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)CC1CCCC1 ZINC001202167389 1123180494 /nfs/dbraw/zinc/18/04/94/1123180494.db2.gz XIAOZWXTGZNSSE-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO CC[N@@H+](CCCC(F)(F)F)Cc1ccccc1O ZINC001202433332 1123211612 /nfs/dbraw/zinc/21/16/12/1123211612.db2.gz MWLDYOWLQUABIS-UHFFFAOYSA-N 1 1 261.287 3.557 20 10 CHCDMO COc1cccc([C@@H](C)[NH2+]CC(F)(F)C(C)(C)C)c1O ZINC000850572696 1123295609 /nfs/dbraw/zinc/29/56/09/1123295609.db2.gz NYNWRZQDUFZKPX-SNVBAGLBSA-N 1 1 287.350 3.733 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCC1CCC1)C[C@H]1CCCO1 ZINC000851840912 1123384297 /nfs/dbraw/zinc/38/42/97/1123384297.db2.gz LQZUKPWUXLUDBG-QGZVFWFLSA-N 1 1 289.419 3.563 20 10 CHCDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccccc1O ZINC000111236015 1123432434 /nfs/dbraw/zinc/43/24/34/1123432434.db2.gz VAVIKVXSYZLKAC-NSHDSACASA-N 1 1 277.314 3.863 20 10 CHCDMO C[C@@H]([NH2+]CCOC1CCCCC1)c1ccc(F)cc1O ZINC000111636458 1123457512 /nfs/dbraw/zinc/45/75/12/1123457512.db2.gz DLGGLEWWEDXMPE-GFCCVEGCSA-N 1 1 281.371 3.531 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(Cl)cc1O ZINC000857080856 1123585293 /nfs/dbraw/zinc/58/52/93/1123585293.db2.gz LGMTTZBQSXJGIQ-IUCAKERBSA-N 1 1 275.726 3.742 20 10 CHCDMO C/C=C/C[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000858538324 1123660657 /nfs/dbraw/zinc/66/06/57/1123660657.db2.gz UEBUAMSFGSUXCP-MPJRPATESA-N 1 1 288.160 3.521 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2O)C[C@H](C)C1(F)F ZINC000862443419 1123810866 /nfs/dbraw/zinc/81/08/66/1123810866.db2.gz OWZJEDGKOZVMJV-AOOOYVTPSA-N 1 1 289.753 3.769 20 10 CHCDMO CCN(CC)c1ccc(CNc2[nH+]cccc2C)cc1 ZINC000083515128 1129149760 /nfs/dbraw/zinc/14/97/60/1129149760.db2.gz AMJRYBIGPXLQHZ-UHFFFAOYSA-N 1 1 269.392 3.848 20 10 CHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670531 1123924704 /nfs/dbraw/zinc/92/47/04/1123924704.db2.gz XRVJLMONKNLURK-IINYFYTJSA-N 1 1 299.336 3.654 20 10 CHCDMO CCc1cc(NCc2c(O)ccc3c2CCCC3)nc(C)[nH+]1 ZINC000302102898 1123954875 /nfs/dbraw/zinc/95/48/75/1123954875.db2.gz QOGQRIKJNIVKTB-UHFFFAOYSA-N 1 1 297.402 3.544 20 10 CHCDMO C[C@H]([NH2+]CCCc1ccccc1F)c1ccc(F)cc1O ZINC000794838739 1123988357 /nfs/dbraw/zinc/98/83/57/1123988357.db2.gz ABVBYJOZBGLLFJ-LBPRGKRZSA-N 1 1 291.341 3.954 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1 ZINC000783592786 1124001729 /nfs/dbraw/zinc/00/17/29/1124001729.db2.gz KLDRFSWRTMLTFV-JQFCIGGWSA-N 1 1 289.419 3.801 20 10 CHCDMO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1cc(F)cc(F)c1O ZINC001120261128 1131273765 /nfs/dbraw/zinc/27/37/65/1131273765.db2.gz ZKIKNKAAQZALRZ-QGFIPJAISA-N 1 1 299.386 3.748 20 10 CHCDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc(N)cc1 ZINC001120370822 1131275235 /nfs/dbraw/zinc/27/52/35/1131275235.db2.gz GOGFBAGOKGDEHO-KBXCAEBGSA-N 1 1 266.388 3.647 20 10 CHCDMO CCCOc1ccc(C[NH2+]Cc2ncc(C)s2)cc1C ZINC000873063324 1124736721 /nfs/dbraw/zinc/73/67/21/1124736721.db2.gz PZPUGWMODYNXCH-UHFFFAOYSA-N 1 1 290.432 3.839 20 10 CHCDMO CCCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1C ZINC000873129264 1124739353 /nfs/dbraw/zinc/73/93/53/1124739353.db2.gz JHZVKCPWTHEXDW-GDBMZVCRSA-N 1 1 299.418 3.776 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000125830269 1124928945 /nfs/dbraw/zinc/92/89/45/1124928945.db2.gz WIZNVFVNOCZKMX-CQSZACIVSA-N 1 1 285.387 3.902 20 10 CHCDMO CCC[N@H+](Cc1nc(Cl)cs1)Cc1ccccc1O ZINC000876654408 1124968713 /nfs/dbraw/zinc/96/87/13/1124968713.db2.gz FFKMZKSOWLWEDP-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO CCC[N@@H+](Cc1nc(Cl)cs1)Cc1ccccc1O ZINC000876654408 1124968717 /nfs/dbraw/zinc/96/87/17/1124968717.db2.gz FFKMZKSOWLWEDP-UHFFFAOYSA-N 1 1 296.823 3.914 20 10 CHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2c(C)cccc2O)s1 ZINC000876714732 1124973158 /nfs/dbraw/zinc/97/31/58/1124973158.db2.gz CNYDETLLGVLKLQ-GFCCVEGCSA-N 1 1 290.432 3.967 20 10 CHCDMO Oc1cccc2c1C[N@@H+](CCCCOc1ccccc1)C2 ZINC000877702972 1125067098 /nfs/dbraw/zinc/06/70/98/1125067098.db2.gz MSDAYGMAZZENMQ-UHFFFAOYSA-N 1 1 283.371 3.567 20 10 CHCDMO C[C@H]([NH2+]Cc1scnc1Cl)c1ccc(N(C)C)cc1 ZINC000878454488 1125155427 /nfs/dbraw/zinc/15/54/27/1125155427.db2.gz DDRWKQMHZSUUES-JTQLQIEISA-N 1 1 295.839 3.713 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000211470142 1125306784 /nfs/dbraw/zinc/30/67/84/1125306784.db2.gz XOXFXVWVMDAPGB-FZMZJTMJSA-N 1 1 265.784 3.810 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCOC3(CCC3)C2)cc1C(C)C ZINC000129679395 1125346046 /nfs/dbraw/zinc/34/60/46/1125346046.db2.gz FQHQBOFTMAIGDA-UHFFFAOYSA-N 1 1 289.419 3.579 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1cc(OC)ccc1O ZINC000213553324 1125362283 /nfs/dbraw/zinc/36/22/83/1125362283.db2.gz GZPLJIVWRVBKOO-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cc(OC)ccc1O ZINC000213553268 1125362674 /nfs/dbraw/zinc/36/26/74/1125362674.db2.gz GZPLJIVWRVBKOO-CQSZACIVSA-N 1 1 263.381 3.555 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(F)cc1O ZINC000883357716 1125401487 /nfs/dbraw/zinc/40/14/87/1125401487.db2.gz RMTPIHADGOXFRL-DZGCQCFKSA-N 1 1 293.382 3.674 20 10 CHCDMO Cc1cccc2c1C[N@@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC001139669792 1131357184 /nfs/dbraw/zinc/35/71/84/1131357184.db2.gz OEFDMNNYWXKMGB-UHFFFAOYSA-N 1 1 280.415 3.885 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccccc2O)[C@@H](c2ccco2)C1 ZINC000245611762 1129213561 /nfs/dbraw/zinc/21/35/61/1129213561.db2.gz OCOGKZNCGYAXLV-DZGCQCFKSA-N 1 1 271.360 3.958 20 10 CHCDMO CCOc1cccc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c1O ZINC000092009595 1129377661 /nfs/dbraw/zinc/37/76/61/1129377661.db2.gz ZVIBAUIOOYTHHA-LBPRGKRZSA-N 1 1 275.392 3.554 20 10 CHCDMO Cc1cc(C[N@@H+](C)C[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000738066877 1129389933 /nfs/dbraw/zinc/38/99/33/1129389933.db2.gz POKUFBFXPNLXQI-HNNXBMFYSA-N 1 1 291.435 3.609 20 10 CHCDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132211 1129417778 /nfs/dbraw/zinc/41/77/78/1129417778.db2.gz DDCVSRMFIRZMLL-OLZOCXBDSA-N 1 1 277.408 3.800 20 10 CHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cccc(OC)c2O)C1 ZINC000093361816 1129422342 /nfs/dbraw/zinc/42/23/42/1129422342.db2.gz LUODKQAPHZCJHR-AWEZNQCLSA-N 1 1 295.448 3.508 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)n1 ZINC000093444903 1129423909 /nfs/dbraw/zinc/42/39/09/1129423909.db2.gz VUHCAJOUOMSILH-LJQANCHMSA-N 1 1 295.430 3.793 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H](CCO)CC(C)C)c1ccc(F)cc1O ZINC000796781285 1129490250 /nfs/dbraw/zinc/49/02/50/1129490250.db2.gz LRLWMMCBJNPVFT-CZUORRHYSA-N 1 1 297.414 3.617 20 10 CHCDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380217 1129522774 /nfs/dbraw/zinc/52/27/74/1129522774.db2.gz WJAVUZYXYLVFLB-TZMCWYRMSA-N 1 1 291.391 3.522 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)CC1CCC1 ZINC000743841784 1129537172 /nfs/dbraw/zinc/53/71/72/1129537172.db2.gz WZWXSYCMHXXUSL-UHFFFAOYSA-N 1 1 260.425 3.763 20 10 CHCDMO CC[N@H+](Cc1cc(Br)ccc1O)CC1CCC1 ZINC000743874183 1129543402 /nfs/dbraw/zinc/54/34/02/1129543402.db2.gz VOXYVXAVLUHBBO-UHFFFAOYSA-N 1 1 298.224 3.777 20 10 CHCDMO CCC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCO1 ZINC000746136682 1129626834 /nfs/dbraw/zinc/62/68/34/1129626834.db2.gz DZCSUBZICAPEFE-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnccc2C)cc1 ZINC000746297366 1129630404 /nfs/dbraw/zinc/63/04/04/1129630404.db2.gz VSVLCZZWTHNQRQ-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO CC[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1ccc(F)cc1O ZINC000796790594 1129777159 /nfs/dbraw/zinc/77/71/59/1129777159.db2.gz SIPURINQYPMDKC-UAGQMJEPSA-N 1 1 295.398 3.513 20 10 CHCDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763401 1129812280 /nfs/dbraw/zinc/81/22/80/1129812280.db2.gz AMMXBZHJKADFFM-CQSZACIVSA-N 1 1 291.391 3.522 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)C2CCCCC2)c1 ZINC000768139149 1129836862 /nfs/dbraw/zinc/83/68/62/1129836862.db2.gz WRUUNIYIOGWTBS-UHFFFAOYSA-N 1 1 277.408 3.946 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccco2)C(C)C)c1 ZINC000768250807 1129846821 /nfs/dbraw/zinc/84/68/21/1129846821.db2.gz WRZGTFSBXKXBEQ-UHFFFAOYSA-N 1 1 289.375 3.795 20 10 CHCDMO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000768271547 1129848416 /nfs/dbraw/zinc/84/84/16/1129848416.db2.gz MFBGDYLWUUPTFN-RQJHMYQMSA-N 1 1 283.240 3.662 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000768360232 1129853457 /nfs/dbraw/zinc/85/34/57/1129853457.db2.gz LOCQPZMVKTXDCZ-HNNXBMFYSA-N 1 1 288.778 3.778 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000768360215 1129853587 /nfs/dbraw/zinc/85/35/87/1129853587.db2.gz LEYMMPBUIZNXCM-QGZVFWFLSA-N 1 1 298.386 3.523 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000768360664 1129854119 /nfs/dbraw/zinc/85/41/19/1129854119.db2.gz NYOVTVUVJYHAQY-SFHVURJKSA-N 1 1 280.415 3.742 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)c(O)cc1C ZINC000768439232 1129855885 /nfs/dbraw/zinc/85/58/85/1129855885.db2.gz DQBZZNGQCSZGKE-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N)cc1)Cc1ccc(F)cc1 ZINC000035365364 1129856160 /nfs/dbraw/zinc/85/61/60/1129856160.db2.gz XKJOCCVFCYLOPI-UHFFFAOYSA-N 1 1 272.367 3.819 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@H]2CCc3ccccc32)c(O)cc1C ZINC000768442697 1129856901 /nfs/dbraw/zinc/85/69/01/1129856901.db2.gz ZCQUJKSHGZXAMN-KRWDZBQOSA-N 1 1 297.398 3.829 20 10 CHCDMO C[N@@H+](CCOC(C)(C)C)Cc1cc2c(cc1O)CCCC2 ZINC000768462180 1129858892 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Cc1c(C[N@H+]2C[C@@H](C)C[C@H]2CF)c2ccccc2n1C ZINC001138252537 1131482422 /nfs/dbraw/zinc/48/24/22/1131482422.db2.gz KKKHHVKCXSOMRY-JSGCOSHPSA-N 1 1 274.383 3.667 20 10 CHCDMO Cc1c(C[N@H+]2CCC[C@@H](CF)C2)c2ccccc2n1C ZINC001138257073 1131483535 /nfs/dbraw/zinc/48/35/35/1131483535.db2.gz USRSKNIZKFSAJO-AWEZNQCLSA-N 1 1 274.383 3.668 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1nc3ccccc3s1)CC2 ZINC001136956561 1131488925 /nfs/dbraw/zinc/48/89/25/1131488925.db2.gz VYTOOZAVHQIEAS-UHFFFAOYSA-N 1 1 296.395 3.560 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1nc3ccccc3s1)CC2 ZINC001136956561 1131488929 /nfs/dbraw/zinc/48/89/29/1131488929.db2.gz VYTOOZAVHQIEAS-UHFFFAOYSA-N 1 1 296.395 3.560 20 10 CHCDMO CN1CCCc2cc(C[N@@H+](C)CCc3ccccc3)ccc21 ZINC001138354808 1131494135 /nfs/dbraw/zinc/49/41/35/1131494135.db2.gz VUMJQAPECPWCFV-UHFFFAOYSA-N 1 1 294.442 3.744 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2cccnc2)cc1Cl ZINC000825502336 1131513251 /nfs/dbraw/zinc/51/32/51/1131513251.db2.gz WPPNXNWFSHXGFV-GFCCVEGCSA-N 1 1 290.794 3.942 20 10 CHCDMO CC1(C)CCC[C@@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001202839111 1131517591 /nfs/dbraw/zinc/51/75/91/1131517591.db2.gz ANAMZSIXUSTJOE-LLVKDONJSA-N 1 1 283.362 3.976 20 10 CHCDMO Cc1cc(C[N@H+]2CCc3cccc(O)c3C2)c(C)s1 ZINC001138570999 1131522215 /nfs/dbraw/zinc/52/22/15/1131522215.db2.gz SBEDLRFDMJAXPR-UHFFFAOYSA-N 1 1 273.401 3.629 20 10 CHCDMO Cc1cc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)ccc1N(C)C ZINC000844443687 1131566365 /nfs/dbraw/zinc/56/63/65/1131566365.db2.gz KYWQGYVTERAJIC-INIZCTEOSA-N 1 1 294.389 3.682 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@]3(CC3(F)F)C1)CCCC2 ZINC000844756271 1131596447 /nfs/dbraw/zinc/59/64/47/1131596447.db2.gz JPQLHOBKMXPEPK-INIZCTEOSA-N 1 1 293.357 3.502 20 10 CHCDMO CCc1cccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001144326899 1131619223 /nfs/dbraw/zinc/61/92/23/1131619223.db2.gz ZZLOXPCXMGTVRH-UHFFFAOYSA-N 1 1 297.398 3.609 20 10 CHCDMO CCOc1ccc(C)cc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001139607338 1131621970 /nfs/dbraw/zinc/62/19/70/1131621970.db2.gz OGEZDUWGLNJLRG-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)ccc1N(C)C ZINC001139672315 1131627039 /nfs/dbraw/zinc/62/70/39/1131627039.db2.gz VLUNCWMXBTYENT-HIFRSBDPSA-N 1 1 260.425 3.681 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1Br)C[C@@H]1CC1(C)C ZINC001140101085 1131664610 /nfs/dbraw/zinc/66/46/10/1131664610.db2.gz JPQZLKXMTBCJDU-JTQLQIEISA-N 1 1 298.224 3.633 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC001140178895 1131672920 /nfs/dbraw/zinc/67/29/20/1131672920.db2.gz BTONJEDMLMUIFU-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@H]2c2cccnc2)c1O ZINC001140178630 1131673294 /nfs/dbraw/zinc/67/32/94/1131673294.db2.gz RPGXTHYGMPTNRJ-KRWDZBQOSA-N 1 1 282.387 3.741 20 10 CHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC12CCCC2 ZINC000845999954 1131677067 /nfs/dbraw/zinc/67/70/67/1131677067.db2.gz MGFJSBZDXRICKC-UHFFFAOYSA-N 1 1 296.208 3.673 20 10 CHCDMO Oc1c(Br)cccc1C[N@H+]1CCC12CCCC2 ZINC000845999954 1131677068 /nfs/dbraw/zinc/67/70/68/1131677068.db2.gz MGFJSBZDXRICKC-UHFFFAOYSA-N 1 1 296.208 3.673 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC000846117848 1131688227 /nfs/dbraw/zinc/68/82/27/1131688227.db2.gz RWJPIGWUHHHBAE-CYBMUJFWSA-N 1 1 287.737 3.585 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+](Cc1ccco1)C1CC1 ZINC001140341959 1131703291 /nfs/dbraw/zinc/70/32/91/1131703291.db2.gz MYWANLBZTWHCIM-UHFFFAOYSA-N 1 1 277.751 3.803 20 10 CHCDMO Oc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C1CC1 ZINC001140341959 1131703295 /nfs/dbraw/zinc/70/32/95/1131703295.db2.gz MYWANLBZTWHCIM-UHFFFAOYSA-N 1 1 277.751 3.803 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)C(F)F ZINC000834826105 1131707745 /nfs/dbraw/zinc/70/77/45/1131707745.db2.gz BPMDLTGBZAKNHW-NWDGAFQWSA-N 1 1 257.324 3.785 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H](C)O ZINC000834886184 1131718687 /nfs/dbraw/zinc/71/86/87/1131718687.db2.gz ADDPLXUWQVKCFB-UBJUHAIHSA-N 1 1 292.206 3.509 20 10 CHCDMO CCc1nc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)co1 ZINC000834898124 1131724339 /nfs/dbraw/zinc/72/43/39/1131724339.db2.gz JFWAFEDTWPDWDQ-ZDUSSCGKSA-N 1 1 294.782 3.837 20 10 CHCDMO CC[N@@H+](Cc1ccc2c(c1)CCC2)Cc1ccccc1O ZINC001203035032 1131724552 /nfs/dbraw/zinc/72/45/52/1131724552.db2.gz NYDJJUKJRZTBBY-UHFFFAOYSA-N 1 1 281.399 3.903 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC001140464124 1131750534 /nfs/dbraw/zinc/75/05/34/1131750534.db2.gz CIFNWKQUCMGFOH-OAHLLOKOSA-N 1 1 288.778 3.778 20 10 CHCDMO C[C@@H](c1ccccn1)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835043619 1131762871 /nfs/dbraw/zinc/76/28/71/1131762871.db2.gz ADNRAIJETNOKQX-PTZVLDCSSA-N 1 1 295.430 3.854 20 10 CHCDMO C[C@H]1CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000835049788 1131764950 /nfs/dbraw/zinc/76/49/50/1131764950.db2.gz STKOCIBOBBUGLU-XVWMLYKFSA-N 1 1 290.476 3.593 20 10 CHCDMO C[C@@H]1CCSCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835049396 1131765046 /nfs/dbraw/zinc/76/50/46/1131765046.db2.gz RDRBANMEMZXUEO-FOSCPCJNSA-N 1 1 290.476 3.593 20 10 CHCDMO C[C@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052568 1131766986 /nfs/dbraw/zinc/76/69/86/1131766986.db2.gz HGIPBKOSEGXUTD-WSNITJDQSA-N 1 1 294.389 3.743 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](CC(=O)c2ccccc2)C(C)C)c1 ZINC001140622735 1131831572 /nfs/dbraw/zinc/83/15/72/1131831572.db2.gz FDOZNTCBSGPKIG-UHFFFAOYSA-N 1 1 297.398 3.794 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC001140742179 1131905725 /nfs/dbraw/zinc/90/57/25/1131905725.db2.gz JLWUIYNQCNUAFS-LBPRGKRZSA-N 1 1 283.371 3.526 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)cc2O)C1 ZINC001140856356 1131948434 /nfs/dbraw/zinc/94/84/34/1131948434.db2.gz YUPQYPMYKJNBLC-OAHLLOKOSA-N 1 1 290.451 3.860 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C)C[C@@H]2C)c(O)c1 ZINC001140856343 1131949221 /nfs/dbraw/zinc/94/92/21/1131949221.db2.gz YNPDZGGLYAEWFX-CABCVRRESA-N 1 1 290.451 3.859 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC3CCC2CC3)c(O)c1 ZINC001140856308 1131949336 /nfs/dbraw/zinc/94/93/36/1131949336.db2.gz WZJLZUSTWAKKAF-UHFFFAOYSA-N 1 1 288.435 3.613 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C(C)(C)C)c(Cl)c1 ZINC001140925088 1131965063 /nfs/dbraw/zinc/96/50/63/1131965063.db2.gz ZIFOCVPIARSOJW-UHFFFAOYSA-N 1 1 254.805 3.636 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)c(O)c1 ZINC001140948703 1131969547 /nfs/dbraw/zinc/96/95/47/1131969547.db2.gz WMMFEHPPJYBTDV-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(O)c1 ZINC001140950054 1131970038 /nfs/dbraw/zinc/97/00/38/1131970038.db2.gz SPVFWZCTYRCBPU-KRWDZBQOSA-N 1 1 282.387 3.823 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1ccc(C)cc1O ZINC001140948519 1131970622 /nfs/dbraw/zinc/97/06/22/1131970622.db2.gz LIXIYQLURJQKKB-UHFFFAOYSA-N 1 1 255.361 3.723 20 10 CHCDMO Cc1ccc(C[N@@H+]2Cc3cccc(Cl)c3C2)c(O)c1 ZINC001140957520 1131973506 /nfs/dbraw/zinc/97/35/06/1131973506.db2.gz CHVRICSUCSQQNU-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO Cc1ccc(C[N@H+]2Cc3cccc(Cl)c3C2)c(O)c1 ZINC001140957520 1131973512 /nfs/dbraw/zinc/97/35/12/1131973512.db2.gz CHVRICSUCSQQNU-UHFFFAOYSA-N 1 1 273.763 3.870 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c(O)c1 ZINC001140958357 1131973984 /nfs/dbraw/zinc/97/39/84/1131973984.db2.gz YZKOLBAYWWTMRE-KRWDZBQOSA-N 1 1 282.387 3.741 20 10 CHCDMO Cc1cc[nH+]c(N2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773254846 1132013051 /nfs/dbraw/zinc/01/30/51/1132013051.db2.gz OBCHCSQTNQCWNZ-UHFFFAOYSA-N 1 1 285.778 3.732 20 10 CHCDMO CCc1ccccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001141227706 1132050854 /nfs/dbraw/zinc/05/08/54/1132050854.db2.gz FPNMZBPYXYDYTK-UHFFFAOYSA-N 1 1 267.372 3.513 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CCOC(C)C ZINC001172455797 1132238277 /nfs/dbraw/zinc/23/82/77/1132238277.db2.gz XMADVYYXNKHMFO-INIZCTEOSA-N 1 1 292.467 3.778 20 10 CHCDMO CS[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840117663 1132247352 /nfs/dbraw/zinc/24/73/52/1132247352.db2.gz WCEMGJJYTRDPJN-CQSZACIVSA-N 1 1 279.449 3.761 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](F)C1)oc1ccccc12 ZINC000840103273 1132248184 /nfs/dbraw/zinc/24/81/84/1132248184.db2.gz AQGKLZRJBKSPMH-LBPRGKRZSA-N 1 1 285.318 3.835 20 10 CHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)c2csnn2)c1O ZINC000840886140 1132302832 /nfs/dbraw/zinc/30/28/32/1132302832.db2.gz PLTHLMVMKTZCTN-BDAKNGLRSA-N 1 1 297.811 3.617 20 10 CHCDMO Cc1ccc2c(c1)C[N@H+](Cc1cccc(C)c1O)CC2 ZINC001231591194 1132319381 /nfs/dbraw/zinc/31/93/81/1132319381.db2.gz VNWUHCNFLFIWCL-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1cc2c(cn1)C[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231590576 1132319700 /nfs/dbraw/zinc/31/97/00/1132319700.db2.gz ICBQKEYBHVPKKB-UHFFFAOYSA-N 1 1 290.366 3.765 20 10 CHCDMO COc1cccc([C@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594843 1132320688 /nfs/dbraw/zinc/32/06/88/1132320688.db2.gz PYSCDWSSRBRSDS-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1cccc2c1C[N@@H+](Cc1cccc(C)c1O)C2 ZINC001231591289 1132321740 /nfs/dbraw/zinc/32/17/40/1132321740.db2.gz ZLHKJPYVRKUTDQ-UHFFFAOYSA-N 1 1 253.345 3.525 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231843320 1132375472 /nfs/dbraw/zinc/37/54/72/1132375472.db2.gz VTJRXRMNMVUALZ-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)c(O)c1 ZINC001231844628 1132379881 /nfs/dbraw/zinc/37/98/81/1132379881.db2.gz OKYLYKCFJVBIDA-GJZGRUSLSA-N 1 1 259.393 3.631 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC001231870239 1132384777 /nfs/dbraw/zinc/38/47/77/1132384777.db2.gz PKTZHBOMZVUJQF-PHIMTYICSA-N 1 1 267.800 3.832 20 10 CHCDMO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841747819 1132389847 /nfs/dbraw/zinc/38/98/47/1132389847.db2.gz DVJGUFRBVBXVGN-FIXISWKDSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@]1(F)CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@H]1F ZINC001231879905 1132390022 /nfs/dbraw/zinc/39/00/22/1132390022.db2.gz VLDMJLURPAWOLT-WBVHZDCISA-N 1 1 291.341 3.817 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)ccc2ccccc21 ZINC001231878800 1132390567 /nfs/dbraw/zinc/39/05/67/1132390567.db2.gz UTRGFOLCMIPYHF-CRAIPNDOSA-N 1 1 297.398 3.546 20 10 CHCDMO COC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC001231883123 1132391065 /nfs/dbraw/zinc/39/10/65/1132391065.db2.gz YQLATMWROJIXPO-QGZVFWFLSA-N 1 1 299.414 3.935 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841753818 1132392468 /nfs/dbraw/zinc/39/24/68/1132392468.db2.gz NNWDWYUCFJQHJA-JHJVBQTASA-N 1 1 297.826 3.901 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1ccc(Cl)cc1O ZINC000841755610 1132392903 /nfs/dbraw/zinc/39/29/03/1132392903.db2.gz KHOGTDDHPJLKAL-NOOOWODRSA-N 1 1 283.799 3.510 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1ccc(Cl)cc1O ZINC000841758649 1132394174 /nfs/dbraw/zinc/39/41/74/1132394174.db2.gz URRIHZBOTGGKJZ-CHIMOYNISA-N 1 1 265.784 3.742 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000842616010 1132444360 /nfs/dbraw/zinc/44/43/60/1132444360.db2.gz FRSQWBBLWNGSCX-YOEHRIQHSA-N 1 1 282.387 3.705 20 10 CHCDMO COc1cc(O)c(C[N@H+](C)CC(C)(C)C)cc1Cl ZINC001232264865 1132447092 /nfs/dbraw/zinc/44/70/92/1132447092.db2.gz NGQLLIGDSXTOOX-UHFFFAOYSA-N 1 1 271.788 3.532 20 10 CHCDMO COc1cc(O)c(C[N@@H+](C)CC(C)(C)C)cc1Cl ZINC001232264865 1132447095 /nfs/dbraw/zinc/44/70/95/1132447095.db2.gz NGQLLIGDSXTOOX-UHFFFAOYSA-N 1 1 271.788 3.532 20 10 CHCDMO C[N@@H+](CCc1ccccn1)Cc1cccc(C(C)(C)C)c1O ZINC001143104704 1132502182 /nfs/dbraw/zinc/50/21/82/1132502182.db2.gz XVAUNFOQOIMEGD-UHFFFAOYSA-N 1 1 298.430 3.759 20 10 CHCDMO COCC[N@@H+](Cc1cccc(C(C)(C)C)c1O)C(C)C ZINC001143110831 1132504525 /nfs/dbraw/zinc/50/45/25/1132504525.db2.gz QMOLVGVVMLVPEB-UHFFFAOYSA-N 1 1 279.424 3.547 20 10 CHCDMO C[C@@H]([NH2+]CCCCCC[NH3+])c1ccc2ccccc2c1[O-] ZINC000843340674 1132520960 /nfs/dbraw/zinc/52/09/60/1132520960.db2.gz DMBGBAOFLSKEEC-CQSZACIVSA-N 1 1 286.419 3.715 20 10 CHCDMO CCCC[N@@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027154 1132564387 /nfs/dbraw/zinc/56/43/87/1132564387.db2.gz LHPJFTLRNGHJSN-UHFFFAOYSA-N 1 1 290.176 3.526 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027904 1132565206 /nfs/dbraw/zinc/56/52/06/1132565206.db2.gz GBWFQWWHSIJNPF-QMMMGPOBSA-N 1 1 290.176 3.524 20 10 CHCDMO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286949 1132595158 /nfs/dbraw/zinc/59/51/58/1132595158.db2.gz PUVOHDMOUSXGNA-INIZCTEOSA-N 1 1 289.419 3.633 20 10 CHCDMO CC(C)(C)c1ccc(O)c(C[N@H+]2CCCC23CC3)c1 ZINC001233284016 1132595529 /nfs/dbraw/zinc/59/55/29/1132595529.db2.gz DUCOUQIIZNMKIS-UHFFFAOYSA-N 1 1 259.393 3.818 20 10 CHCDMO C[N@H+](Cc1cc(C(C)(C)C)ccc1O)C[C@@H]1CCCCO1 ZINC001233286569 1132595629 /nfs/dbraw/zinc/59/56/29/1132595629.db2.gz ZJBIPZXVBPHKSW-INIZCTEOSA-N 1 1 291.435 3.691 20 10 CHCDMO Oc1c(C[NH+]2CC3(C2)CCCC3)cccc1C(F)(F)F ZINC001233416471 1132618569 /nfs/dbraw/zinc/61/85/69/1132618569.db2.gz JNUKVLOWDVPSIV-UHFFFAOYSA-N 1 1 285.309 3.787 20 10 CHCDMO Oc1c(C[NH+]2C3CCC2CC3)cccc1C(F)(F)F ZINC001233418364 1132618718 /nfs/dbraw/zinc/61/87/18/1132618718.db2.gz DCIUUOLKOXLKAA-UHFFFAOYSA-N 1 1 271.282 3.538 20 10 CHCDMO CC[C@H]1CCC[N@@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418822 1132620854 /nfs/dbraw/zinc/62/08/54/1132620854.db2.gz XKYNKOWGDWXIHX-NSHDSACASA-N 1 1 273.298 3.785 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418822 1132620857 /nfs/dbraw/zinc/62/08/57/1132620857.db2.gz XKYNKOWGDWXIHX-NSHDSACASA-N 1 1 273.298 3.785 20 10 CHCDMO CC[C@@H]1CCC[N@@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418821 1132621733 /nfs/dbraw/zinc/62/17/33/1132621733.db2.gz XKYNKOWGDWXIHX-LLVKDONJSA-N 1 1 273.298 3.785 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418821 1132621734 /nfs/dbraw/zinc/62/17/34/1132621734.db2.gz XKYNKOWGDWXIHX-LLVKDONJSA-N 1 1 273.298 3.785 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1O ZINC001233452538 1132625455 /nfs/dbraw/zinc/62/54/55/1132625455.db2.gz AICKHVOWAKINIQ-VIFPVBQESA-N 1 1 261.287 3.641 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233454266 1132626559 /nfs/dbraw/zinc/62/65/59/1132626559.db2.gz NYICVVNSNBRAOF-GFCCVEGCSA-N 1 1 273.298 3.785 20 10 CHCDMO Cc1cc(F)cc(Nc2cc[nH+]c3ccccc23)c1O ZINC001174039939 1132703572 /nfs/dbraw/zinc/70/35/72/1132703572.db2.gz JCHUYUISQPLTLX-UHFFFAOYSA-N 1 1 268.291 3.553 20 10 CHCDMO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2Nc1ccc(N)c[nH+]1 ZINC001163486276 1133152140 /nfs/dbraw/zinc/15/21/40/1133152140.db2.gz HQNBMYGLBUTZSG-QGZVFWFLSA-N 1 1 297.402 3.722 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)[C@H]1C ZINC000252125972 1133185617 /nfs/dbraw/zinc/18/56/17/1133185617.db2.gz KBABVAXFGHJEAR-MNOVXSKESA-N 1 1 253.773 3.666 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001203558516 1133339844 /nfs/dbraw/zinc/33/98/44/1133339844.db2.gz LNBIPSWHVNODRY-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO COc1cccc(C[N@@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001203599215 1133343863 /nfs/dbraw/zinc/34/38/63/1133343863.db2.gz DDKFBZPKQSLUNB-UHFFFAOYSA-N 1 1 299.414 3.854 20 10 CHCDMO C[N@H+](Cc1cc(Cl)ccc1O)Cc1cccc(F)c1F ZINC001203664587 1133351679 /nfs/dbraw/zinc/35/16/79/1133351679.db2.gz LVUUSMBMEMHCJE-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO Oc1ccc(C[N@@H+](Cc2ccccc2)C2CCC2)cc1O ZINC001203881910 1133378231 /nfs/dbraw/zinc/37/82/31/1133378231.db2.gz XUSBKOYEIOESKJ-UHFFFAOYSA-N 1 1 283.371 3.653 20 10 CHCDMO C[N@@H+](Cc1ccc(O)c(O)c1)Cc1cccc2ccccc21 ZINC001203879656 1133378568 /nfs/dbraw/zinc/37/85/68/1133378568.db2.gz WPTZKFSUIMQCPX-UHFFFAOYSA-N 1 1 293.366 3.883 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CC/C=C/c2cccnc2)cc1 ZINC001203937090 1133385763 /nfs/dbraw/zinc/38/57/63/1133385763.db2.gz KDUCGUXZIYRVBC-QPJJXVBHSA-N 1 1 295.430 3.683 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC001203936226 1133386178 /nfs/dbraw/zinc/38/61/78/1133386178.db2.gz KRDKDKCKLDQFOH-HNNXBMFYSA-N 1 1 260.425 3.907 20 10 CHCDMO C[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccccc1O ZINC001204049285 1133403488 /nfs/dbraw/zinc/40/34/88/1133403488.db2.gz WMJOQACXWOLDMX-UHFFFAOYSA-N 1 1 266.344 3.506 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC3(CC3)C2)c2ccccc21 ZINC001204235221 1133423017 /nfs/dbraw/zinc/42/30/17/1133423017.db2.gz KPENVTFXOXYWCK-UHFFFAOYSA-N 1 1 280.415 3.892 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H]2C3)c2ccccc21 ZINC001204240350 1133423587 /nfs/dbraw/zinc/42/35/87/1133423587.db2.gz PMYWELRGZOQEFP-GOEBONIOSA-N 1 1 280.415 3.890 20 10 CHCDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204239620 1133424285 /nfs/dbraw/zinc/42/42/85/1133424285.db2.gz AKHZXLYGIGBHSW-MRXNPFEDSA-N 1 1 298.430 3.517 20 10 CHCDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(O)cc1O ZINC001204277369 1133426623 /nfs/dbraw/zinc/42/66/23/1133426623.db2.gz BPBINDOTWJJDRN-NSHDSACASA-N 1 1 291.778 3.944 20 10 CHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CCC2(CCC2)C1 ZINC001204321892 1133436242 /nfs/dbraw/zinc/43/62/42/1133436242.db2.gz LWNYWTMMAZQGOE-UHFFFAOYSA-N 1 1 270.420 3.663 20 10 CHCDMO F[C@@H]1CCCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325649 1133438274 /nfs/dbraw/zinc/43/82/74/1133438274.db2.gz SNQYLMPSBVFDJE-MRXNPFEDSA-N 1 1 276.399 3.611 20 10 CHCDMO CCC(C)(C)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC001205634760 1133596988 /nfs/dbraw/zinc/59/69/88/1133596988.db2.gz ZELJLZSVWUCFMZ-CMDGGOBGSA-N 1 1 260.425 3.886 20 10 CHCDMO CCC[C@@H](C[N@@H+](C)Cc1ccc(N2CCCC2)cc1)OC ZINC001205708959 1133605240 /nfs/dbraw/zinc/60/52/40/1133605240.db2.gz MSSOHEULJSKWGF-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(C)cc(OC)c1O ZINC001206122810 1133660616 /nfs/dbraw/zinc/66/06/16/1133660616.db2.gz VWAGRDOAEUREOP-CYBMUJFWSA-N 1 1 265.397 3.720 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C3CCC3)C2)cc1Cl ZINC001206284813 1133683173 /nfs/dbraw/zinc/68/31/73/1133683173.db2.gz DCLGWSZVJYXJJS-ZDUSSCGKSA-N 1 1 279.811 3.976 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@H]1C1CCC1 ZINC001206552018 1133717135 /nfs/dbraw/zinc/71/71/35/1133717135.db2.gz FFJDFPMTLXTAHM-HNNXBMFYSA-N 1 1 281.346 3.825 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC001206552018 1133717139 /nfs/dbraw/zinc/71/71/39/1133717139.db2.gz FFJDFPMTLXTAHM-HNNXBMFYSA-N 1 1 281.346 3.825 20 10 CHCDMO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)cc1C)CC2 ZINC001206584087 1133721759 /nfs/dbraw/zinc/72/17/59/1133721759.db2.gz DPLNAOKGIIJSRZ-UHFFFAOYSA-N 1 1 294.442 3.928 20 10 CHCDMO C[N@@H+](CCCc1ccccc1F)Cc1ccccc1O ZINC001207495061 1133809374 /nfs/dbraw/zinc/80/93/74/1133809374.db2.gz RBIHHWAYGOBXQP-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC001207912327 1133861365 /nfs/dbraw/zinc/86/13/65/1133861365.db2.gz QTTPTJONLGZUNT-INIZCTEOSA-N 1 1 282.431 3.988 20 10 CHCDMO Oc1cc2c(cc1O)C[N@@H+](CCCC1CCCC1)CCC2 ZINC001208093838 1133877297 /nfs/dbraw/zinc/87/72/97/1133877297.db2.gz DBIKQTKURNALFC-UHFFFAOYSA-N 1 1 289.419 3.816 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)[C@H](C)CO1 ZINC000403825817 1134876822 /nfs/dbraw/zinc/87/68/22/1134876822.db2.gz MLRPVNSDAAPNMU-HIFRSBDPSA-N 1 1 285.387 3.545 20 10 CHCDMO Oc1ccc(Cl)cc1Nc1cc[nH+]cc1C(F)(F)F ZINC001216396423 1134881574 /nfs/dbraw/zinc/88/15/74/1134881574.db2.gz GVHKODQODGRPRM-UHFFFAOYSA-N 1 1 288.656 3.625 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc(N)cc1 ZINC001218337426 1135089548 /nfs/dbraw/zinc/08/95/48/1135089548.db2.gz YYZFFZJSYLGRKL-BEFAXECRSA-N 1 1 296.414 3.558 20 10 CHCDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000274273972 328210556 /nfs/dbraw/zinc/21/05/56/328210556.db2.gz XBSCIZOHKHYCDB-JGVFFNPUSA-N 1 1 297.811 3.617 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)c2ccco2)c1O ZINC000131075128 521334666 /nfs/dbraw/zinc/33/46/66/521334666.db2.gz IHBODAFKZSEZOV-LBPRGKRZSA-N 1 1 275.348 3.577 20 10 CHCDMO COCc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062747693 523105207 /nfs/dbraw/zinc/10/52/07/523105207.db2.gz KDGDBCZOTITEFF-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(C)ccc1O ZINC000290557635 523122206 /nfs/dbraw/zinc/12/22/06/523122206.db2.gz SECUUHOCXZHXDJ-INIZCTEOSA-N 1 1 270.376 3.679 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccncc2)cc1C ZINC000289868709 525316464 /nfs/dbraw/zinc/31/64/64/525316464.db2.gz RBWUMLQNNICMLV-KRWDZBQOSA-N 1 1 282.387 3.741 20 10 CHCDMO C[C@H]([NH2+]Cc1cccc(F)c1)c1ccc(F)cc1O ZINC000062745490 525456332 /nfs/dbraw/zinc/45/63/32/525456332.db2.gz VQBABVCXCWGDSZ-JTQLQIEISA-N 1 1 263.287 3.521 20 10 CHCDMO Oc1c(F)cccc1C[NH2+][C@H]1C[C@H](c2ccccc2F)C1 ZINC000280626119 526331014 /nfs/dbraw/zinc/33/10/14/526331014.db2.gz GJNCSKMWTSGXBA-JOCQHMNTSA-N 1 1 289.325 3.706 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(OC)cc1O ZINC000213659507 1118818471 /nfs/dbraw/zinc/81/84/71/1118818471.db2.gz ISHDOSVEVVBIOQ-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO CC[N@H+](Cc1ccc(Cl)cc1O)C1CCCC1 ZINC001181655437 1122067677 /nfs/dbraw/zinc/06/76/77/1122067677.db2.gz JXXYLODFFBXCHN-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO CC[N@@H+](Cc1ccc(Cl)cc1O)C1CCCC1 ZINC001181655437 1122067684 /nfs/dbraw/zinc/06/76/84/1122067684.db2.gz JXXYLODFFBXCHN-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCCC12CC2 ZINC001183196435 1122210298 /nfs/dbraw/zinc/21/02/98/1122210298.db2.gz BOWINQNFTVLNEX-LLVKDONJSA-N 1 1 283.774 3.855 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)[C@H]1C ZINC001193603176 1122704947 /nfs/dbraw/zinc/70/49/47/1122704947.db2.gz AOLPRNGGXBKFML-GOEBONIOSA-N 1 1 260.425 3.681 20 10 CHCDMO CC1(CC(F)(F)F)C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000839142411 1132183917 /nfs/dbraw/zinc/18/39/17/1132183917.db2.gz FUSAFGYCNHORAU-UHFFFAOYSA-N 1 1 293.716 3.820 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC3CCC2CC3)cc1Cl ZINC001231870567 1132384723 /nfs/dbraw/zinc/38/47/23/1132384723.db2.gz JSABPTGNIJTRPW-UHFFFAOYSA-N 1 1 265.784 3.728 20 10 CHCDMO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000282909595 1125532893 /nfs/dbraw/zinc/53/28/93/1125532893.db2.gz XGIQMFXRZAPAAC-JTQLQIEISA-N 1 1 294.757 3.739 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000884482666 1125567892 /nfs/dbraw/zinc/56/78/92/1125567892.db2.gz GEDKAKKDTFRYBR-KXBFYZLASA-N 1 1 297.398 3.546 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C1CCOCC1 ZINC000841748658 1125577691 /nfs/dbraw/zinc/57/76/91/1125577691.db2.gz BBINLPMTLKMOJV-IAQYHMDHSA-N 1 1 297.826 3.901 20 10 CHCDMO COCCC(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752501 1125583919 /nfs/dbraw/zinc/58/39/19/1125583919.db2.gz PBCCZSQRBWFRSE-NSHDSACASA-N 1 1 285.815 3.759 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(Cl)cc1O ZINC000841757142 1125597211 /nfs/dbraw/zinc/59/72/11/1125597211.db2.gz FBGDOQRBEMRFLQ-WDEREUQCSA-N 1 1 283.799 3.511 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(Cl)cc1O ZINC000841759270 1125599234 /nfs/dbraw/zinc/59/92/34/1125599234.db2.gz XVENUWGZWFOICG-VXGBXAGGSA-N 1 1 297.826 3.901 20 10 CHCDMO COc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccc1C ZINC000886515551 1125682852 /nfs/dbraw/zinc/68/28/52/1125682852.db2.gz NFQNOKYJZFFSGN-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886519380 1125683231 /nfs/dbraw/zinc/68/32/31/1125683231.db2.gz UHBKCAAUWDXFQB-VXGBXAGGSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1c(O)cccc1F ZINC000886525023 1125683945 /nfs/dbraw/zinc/68/39/45/1125683945.db2.gz VWGFOOSEMSDALR-YGRLFVJLSA-N 1 1 287.334 3.575 20 10 CHCDMO COc1cc(C)cc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886555493 1125689912 /nfs/dbraw/zinc/68/99/12/1125689912.db2.gz UPEWNMPVVUPVHY-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO C[C@@H]([NH2+]CCCC(C)(F)F)c1c(O)cccc1F ZINC000886616149 1125697815 /nfs/dbraw/zinc/69/78/15/1125697815.db2.gz WBSWMQCRGMXQIL-SECBINFHSA-N 1 1 261.287 3.617 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1c(O)cccc1F ZINC000886607372 1125696840 /nfs/dbraw/zinc/69/68/40/1125696840.db2.gz QLCDOXIKXVRLRJ-WFASDCNBSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)c1c(O)cccc1F ZINC000886630994 1125699726 /nfs/dbraw/zinc/69/97/26/1125699726.db2.gz ABOBZWFZCRZGIM-CUOATXAZSA-N 1 1 289.753 3.887 20 10 CHCDMO COc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1C ZINC000886639573 1125701515 /nfs/dbraw/zinc/70/15/15/1125701515.db2.gz GKPQKSUBZFJPSC-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)s1 ZINC000886645388 1125702362 /nfs/dbraw/zinc/70/23/62/1125702362.db2.gz XYGNABXSFYEDBZ-BDAKNGLRSA-N 1 1 280.368 3.708 20 10 CHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000826539434 1125756866 /nfs/dbraw/zinc/75/68/66/1125756866.db2.gz TXEZRIZZTYOIJX-GWCFXTLKSA-N 1 1 296.208 3.529 20 10 CHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000826539434 1125756869 /nfs/dbraw/zinc/75/68/69/1125756869.db2.gz TXEZRIZZTYOIJX-GWCFXTLKSA-N 1 1 296.208 3.529 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc1 ZINC000192460265 1125769110 /nfs/dbraw/zinc/76/91/10/1125769110.db2.gz RQBQTPOHWXVARA-UHFFFAOYSA-N 1 1 297.398 3.522 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC000122184041 1125785063 /nfs/dbraw/zinc/78/50/63/1125785063.db2.gz ZDGUROOHROZSKM-LBPRGKRZSA-N 1 1 289.350 3.733 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)C[C@@H](C)CC)c1 ZINC000769537633 1129916531 /nfs/dbraw/zinc/91/65/31/1129916531.db2.gz NGGNLQCJSBGSQP-ZDUSSCGKSA-N 1 1 265.397 3.659 20 10 CHCDMO CCCCC[N@@H+](CCCOC)Cc1cc(F)ccc1O ZINC000780792102 1130693224 /nfs/dbraw/zinc/69/32/24/1130693224.db2.gz FXKZTUWMKAFXHL-UHFFFAOYSA-N 1 1 283.387 3.560 20 10 CHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466675 1126944420 /nfs/dbraw/zinc/94/44/20/1126944420.db2.gz DTKPVHMDMRTOGD-MRXNPFEDSA-N 1 1 290.451 3.534 20 10 CHCDMO CSC[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000814178878 1130834461 /nfs/dbraw/zinc/83/44/61/1130834461.db2.gz HAOUNACJIWYFHY-LLVKDONJSA-N 1 1 285.840 3.621 20 10 CHCDMO CC(C)[N@H+](Cc1nccs1)Cc1ccc(N(C)C)cc1 ZINC000269706520 1127045274 /nfs/dbraw/zinc/04/52/74/1127045274.db2.gz ZTNZESCJTIEOCU-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO CC(C)[N@@H+](Cc1nccs1)Cc1ccc(N(C)C)cc1 ZINC000269706520 1127045278 /nfs/dbraw/zinc/04/52/78/1127045278.db2.gz ZTNZESCJTIEOCU-UHFFFAOYSA-N 1 1 289.448 3.620 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237119563 1131053750 /nfs/dbraw/zinc/05/37/50/1131053750.db2.gz IWDAELKOHIMWNG-UHFFFAOYSA-N 1 1 289.297 3.665 20 10 CHCDMO CCCC[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000913064167 1127120875 /nfs/dbraw/zinc/12/08/75/1127120875.db2.gz FHUFLWAPKZOICA-UHFFFAOYSA-N 1 1 265.397 3.627 20 10 CHCDMO CC(C)[N@H+](Cc1cc(F)c(Cl)cc1[O-])CC1CC1 ZINC001237935300 1131153586 /nfs/dbraw/zinc/15/35/86/1131153586.db2.gz CDFRXPLFJWIKIG-UHFFFAOYSA-N 1 1 271.763 3.805 20 10 CHCDMO CC(C)[N@@H+](Cc1cc(F)c(Cl)cc1O)CC1CC1 ZINC001237935300 1131153588 /nfs/dbraw/zinc/15/35/88/1131153588.db2.gz CDFRXPLFJWIKIG-UHFFFAOYSA-N 1 1 271.763 3.805 20 10 CHCDMO CC(C)[N@H+](Cc1cc(F)c(Cl)cc1O)CC1CC1 ZINC001237935300 1131153592 /nfs/dbraw/zinc/15/35/92/1131153592.db2.gz CDFRXPLFJWIKIG-UHFFFAOYSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1O ZINC000285630602 1127239574 /nfs/dbraw/zinc/23/95/74/1127239574.db2.gz LGIFGFNBZNEOPQ-HNNXBMFYSA-N 1 1 277.314 3.911 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccc(OC)cc1)c1ccc(F)cc1O ZINC000285714980 1127241274 /nfs/dbraw/zinc/24/12/74/1127241274.db2.gz PSYJCYGNEXQKIO-INIZCTEOSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cccs1)c1ccc(F)cc1O ZINC000285732733 1127241475 /nfs/dbraw/zinc/24/14/75/1127241475.db2.gz QRLHCUNCRZSTRP-CYBMUJFWSA-N 1 1 265.353 3.834 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000286047305 1127256115 /nfs/dbraw/zinc/25/61/15/1127256115.db2.gz KBBKOTALXYYLCR-HIFRSBDPSA-N 1 1 293.382 3.674 20 10 CHCDMO CCOCCC1(C[NH2+][C@@H](CC)c2ccc(F)cc2O)CC1 ZINC000286102939 1127258534 /nfs/dbraw/zinc/25/85/34/1127258534.db2.gz MQRUUQLXCAFCHB-HNNXBMFYSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H](C)c1nccs1)c1ccc(F)cc1O ZINC000286218302 1127263193 /nfs/dbraw/zinc/26/31/93/1127263193.db2.gz SFJMTPXMACTJIE-MFKMUULPSA-N 1 1 294.395 3.832 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000057535367 1127263320 /nfs/dbraw/zinc/26/33/20/1127263320.db2.gz HFEICHDYJJYCTM-CYBMUJFWSA-N 1 1 287.325 3.783 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCSC(C)(C)C2)c1 ZINC001308620202 1127396715 /nfs/dbraw/zinc/39/67/15/1127396715.db2.gz SCJYVLZVURPTFK-UHFFFAOYSA-N 1 1 279.449 3.843 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001237933610 1129219164 /nfs/dbraw/zinc/21/91/64/1129219164.db2.gz DUNUBWMEDYIWRN-QWRGUYRKSA-N 1 1 283.774 3.807 20 10 CHCDMO Cc1cccc(C[N@H+]2CCCc3ccccc3C2)c1O ZINC000158031656 1127415973 /nfs/dbraw/zinc/41/59/73/1127415973.db2.gz BOLPLLTZZXANPF-UHFFFAOYSA-N 1 1 267.372 3.649 20 10 CHCDMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1Cc1cc(Cl)cc(F)c1[O-] ZINC001308826185 1127498033 /nfs/dbraw/zinc/49/80/33/1127498033.db2.gz UTIAKTMPTBTGRI-KXUCPTDWSA-N 1 1 271.763 3.661 20 10 CHCDMO CC1(C)C[N@H+](Cc2cc(F)ccc2O)[C@@H]1c1ccncc1 ZINC000293909100 1127532195 /nfs/dbraw/zinc/53/21/95/1127532195.db2.gz LQIWWCGHXIFWCX-MRXNPFEDSA-N 1 1 286.350 3.509 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)[C@@H]1c1ccncc1 ZINC000293909100 1127532198 /nfs/dbraw/zinc/53/21/98/1127532198.db2.gz LQIWWCGHXIFWCX-MRXNPFEDSA-N 1 1 286.350 3.509 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000228561073 1127567683 /nfs/dbraw/zinc/56/76/83/1127567683.db2.gz NXINYKQWLNIJMG-CYBMUJFWSA-N 1 1 283.799 3.819 20 10 CHCDMO C[N@@H+](Cc1c(O)cccc1Br)CC(C)(C)C ZINC000707141342 1127652597 /nfs/dbraw/zinc/65/25/97/1127652597.db2.gz CPGNAPKBDAPEAR-UHFFFAOYSA-N 1 1 286.213 3.633 20 10 CHCDMO Cc1ncsc1C[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000172495979 1127766643 /nfs/dbraw/zinc/76/66/43/1127766643.db2.gz RYLUKNFVEPVBSN-UHFFFAOYSA-N 1 1 298.411 3.942 20 10 CHCDMO Cc1cccc(OCC[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000062748307 1127774141 /nfs/dbraw/zinc/77/41/41/1127774141.db2.gz FHDIAQJZTZVARO-ZDUSSCGKSA-N 1 1 289.350 3.569 20 10 CHCDMO C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748203 1127774240 /nfs/dbraw/zinc/77/42/40/1127774240.db2.gz KZHFJCYPMUHVDP-QWRGUYRKSA-N 1 1 279.380 3.875 20 10 CHCDMO CCC1([NH3+])CC[NH+]([C@@H](C)c2ccc3ccccc3c2[O-])CC1 ZINC000925760704 1128141218 /nfs/dbraw/zinc/14/12/18/1128141218.db2.gz RANADZVUJZVJAB-AWEZNQCLSA-N 1 1 298.430 3.810 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCS[C@H](C)C1)c1ccc(F)cc1O ZINC000927029482 1128209487 /nfs/dbraw/zinc/20/94/87/1128209487.db2.gz PJVLWADXOLOQOL-OSMZGAPFSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@H]([N@@H+](C)Cc1cc2c(cc1O)CCC2)C(C)(C)C ZINC000914568109 1128211605 /nfs/dbraw/zinc/21/16/05/1128211605.db2.gz AJUKVMATHOVMFD-LBPRGKRZSA-N 1 1 261.409 3.747 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1c(O)cccc1F ZINC000927062900 1128213184 /nfs/dbraw/zinc/21/31/84/1128213184.db2.gz PXBGRPXHTXZWPU-FZMZJTMJSA-N 1 1 286.350 3.655 20 10 CHCDMO C[C@@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1c(O)cccc1F ZINC000927124002 1128219763 /nfs/dbraw/zinc/21/97/63/1128219763.db2.gz GOBNLSQAUMPQKU-CHWSQXEVSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccc(N(C)C)cc1 ZINC000777693398 1128243254 /nfs/dbraw/zinc/24/32/54/1128243254.db2.gz JVEDCFZXLPMTPF-ZDUSSCGKSA-N 1 1 294.402 3.812 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)c1 ZINC000915803558 1128340010 /nfs/dbraw/zinc/34/00/10/1128340010.db2.gz HNDAICPQRMLMPK-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2c(O)ccc3ccncc32)c1 ZINC000917487175 1128501860 /nfs/dbraw/zinc/50/18/60/1128501860.db2.gz UFJLZPFZQATAKM-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc2c(c1)CCCN2C ZINC001138359125 1128628760 /nfs/dbraw/zinc/62/87/60/1128628760.db2.gz LMLMQQLDTSHJQQ-QGZVFWFLSA-N 1 1 272.436 3.689 20 10 CHCDMO C[N@@H+](CCc1ccc(F)cc1)Cc1cc2c(cc1O)CCC2 ZINC000919948288 1128653688 /nfs/dbraw/zinc/65/36/88/1128653688.db2.gz IHEDMBQPHWTLRI-UHFFFAOYSA-N 1 1 299.389 3.695 20 10 CHCDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779020213 1128683407 /nfs/dbraw/zinc/68/34/07/1128683407.db2.gz KEAFAGRMOGOHEB-LLVKDONJSA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CC1)C1CCC1)c1ccc(F)cc1O ZINC000324775593 1128708756 /nfs/dbraw/zinc/70/87/56/1128708756.db2.gz FCAQGBLUMIHYER-QFYYESIMSA-N 1 1 263.356 3.761 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)CCOc2ccccc2)c1 ZINC000216023662 1128736711 /nfs/dbraw/zinc/73/67/11/1128736711.db2.gz MQOPXRDAJUVFIS-UHFFFAOYSA-N 1 1 285.387 3.520 20 10 CHCDMO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)c1 ZINC000185471716 1117827344 /nfs/dbraw/zinc/82/73/44/1117827344.db2.gz JKNSBHUHXYNLIS-PBHICJAKSA-N 1 1 292.467 3.718 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000748081659 1117923344 /nfs/dbraw/zinc/92/33/44/1117923344.db2.gz BICAPOFLWQLOFV-ZDUSSCGKSA-N 1 1 259.393 3.503 20 10 CHCDMO C[C@@H]1CCCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000705477087 1117973366 /nfs/dbraw/zinc/97/33/66/1117973366.db2.gz LJZWTYPWCPJRRZ-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000179564968 1128748988 /nfs/dbraw/zinc/74/89/88/1128748988.db2.gz IDRDXRRRCOIDGZ-KRWDZBQOSA-N 1 1 297.398 3.608 20 10 CHCDMO CS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(F)cc1O ZINC000300419239 1118028527 /nfs/dbraw/zinc/02/85/27/1118028527.db2.gz UACCZZSLTSDLRK-WDBKCZKBSA-N 1 1 283.412 3.856 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)CC1 ZINC000211466085 1118055763 /nfs/dbraw/zinc/05/57/63/1118055763.db2.gz ZJDJPIJELGPYKP-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)CC1 ZINC000211466085 1118055768 /nfs/dbraw/zinc/05/57/68/1118055768.db2.gz ZJDJPIJELGPYKP-LLVKDONJSA-N 1 1 298.224 3.777 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NCCC[NH+](CC)CC)cc1 ZINC000764432076 1118091363 /nfs/dbraw/zinc/09/13/63/1118091363.db2.gz HYFPEDGGADZNQU-INIZCTEOSA-N 1 1 291.483 3.525 20 10 CHCDMO Cc1cccc(C[N@@H+](C)CCc2ccc(F)cc2)c1O ZINC000179797042 1128759908 /nfs/dbraw/zinc/75/99/08/1128759908.db2.gz KMMYHKNHUXVHJN-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO CC[C@H](C)[N@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653570 1118188143 /nfs/dbraw/zinc/18/81/43/1118188143.db2.gz BOCUDLJRWPBEGN-JKSUJKDBSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@H](C)[N@@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653570 1118188144 /nfs/dbraw/zinc/18/81/44/1118188144.db2.gz BOCUDLJRWPBEGN-JKSUJKDBSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccccc1O ZINC000188579844 1128763243 /nfs/dbraw/zinc/76/32/43/1128763243.db2.gz KDVTUMLJKOGUIC-LJQANCHMSA-N 1 1 299.414 3.555 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Cl)ccc1O ZINC000128029104 1118578336 /nfs/dbraw/zinc/57/83/36/1118578336.db2.gz UTSZLSGJXVBMKI-PHIMTYICSA-N 1 1 253.773 3.809 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1Br)CC1CCCC1 ZINC000707152547 1118651753 /nfs/dbraw/zinc/65/17/53/1118651753.db2.gz OFBSEHATKAYAPF-UHFFFAOYSA-N 1 1 298.224 3.777 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140462826 1118721279 /nfs/dbraw/zinc/72/12/79/1118721279.db2.gz LQSAPEIZCMYZCW-UHFFFAOYSA-N 1 1 289.753 3.913 20 10 CHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cccc(C)c2O)C1 ZINC000180668051 1128801647 /nfs/dbraw/zinc/80/16/47/1128801647.db2.gz GDHRUIZDRNBNCX-CABCVRRESA-N 1 1 279.449 3.807 20 10 CHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668229 1128801827 /nfs/dbraw/zinc/80/18/27/1128801827.db2.gz ODWQRYCQDXHAOW-DZGCQCFKSA-N 1 1 295.448 3.507 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])[C@@H](C)C1 ZINC000224468484 1119003876 /nfs/dbraw/zinc/00/38/76/1119003876.db2.gz DYEPTGJAWCQUAM-MNOVXSKESA-N 1 1 253.773 3.666 20 10 CHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000728562209 1119339399 /nfs/dbraw/zinc/33/93/99/1119339399.db2.gz IJXJBNKQVGVQJA-OAHLLOKOSA-N 1 1 289.419 3.770 20 10 CHCDMO CC[C@@H]([NH2+]CCc1ccccc1)c1ccc(F)cc1O ZINC000796665369 1119736757 /nfs/dbraw/zinc/73/67/57/1119736757.db2.gz HERUIVBSCBKHTI-MRXNPFEDSA-N 1 1 273.351 3.815 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccccc2O)[C@@H]1c1ccccc1 ZINC000179584510 1119751442 /nfs/dbraw/zinc/75/14/42/1119751442.db2.gz 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UQECNDFLVOZKBJ-BLLLJJGKSA-N 1 1 253.345 3.530 20 10 CHCDMO CCC[N@@H+](Cc1ccc(OCC)cc1O)[C@H](C)CC ZINC001237044700 1131038919 /nfs/dbraw/zinc/03/89/19/1131038919.db2.gz MIVOXZCEGIAVPL-CYBMUJFWSA-N 1 1 265.397 3.801 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001237049791 1131040445 /nfs/dbraw/zinc/04/04/45/1131040445.db2.gz JNTJKXZHEWAFBM-UHFFFAOYSA-N 1 1 289.419 3.947 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c(O)c1 ZINC001237051476 1131040518 /nfs/dbraw/zinc/04/05/18/1131040518.db2.gz LEXYVGOHQVJUQY-QANKJYHBSA-N 1 1 289.419 3.515 20 10 CHCDMO CC1CC[NH+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237078376 1131046965 /nfs/dbraw/zinc/04/69/65/1131046965.db2.gz QJRVFKOEAGGRJQ-UHFFFAOYSA-N 1 1 274.191 3.931 20 10 CHCDMO C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816481112 1131098394 /nfs/dbraw/zinc/09/83/94/1131098394.db2.gz JJZUBJMFHKSPKR-SECBINFHSA-N 1 1 257.736 3.559 20 10 CHCDMO C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816481112 1131098401 /nfs/dbraw/zinc/09/84/01/1131098401.db2.gz JJZUBJMFHKSPKR-SECBINFHSA-N 1 1 257.736 3.559 20 10 CHCDMO C[C@H]1CC[C@H](C)[NH+]1Cc1cc(Cl)c(F)cc1O ZINC000816520791 1131104076 /nfs/dbraw/zinc/10/40/76/1131104076.db2.gz YFPIHQYQVPAXOZ-IUCAKERBSA-N 1 1 257.736 3.558 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237488095 1131104597 /nfs/dbraw/zinc/10/45/97/1131104597.db2.gz QRAZDRQWWGOALQ-UHFFFAOYSA-N 1 1 269.388 3.895 20 10 CHCDMO C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816554792 1131109857 /nfs/dbraw/zinc/10/98/57/1131109857.db2.gz JDZADDBOOUGMMO-SJORKVTESA-N 1 1 298.430 3.508 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@]3(C2)CCCOC3)ccc2ccccc21 ZINC000816603182 1131114154 /nfs/dbraw/zinc/11/41/54/1131114154.db2.gz BQVGWEUDZBZLAO-IBGZPJMESA-N 1 1 297.398 3.548 20 10 CHCDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000816648342 1131119482 /nfs/dbraw/zinc/11/94/82/1131119482.db2.gz IZCHZJKZDGFWOI-LSDHHAIUSA-N 1 1 258.409 3.517 20 10 CHCDMO C[C@@H]1CC[N@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641530 1131123161 /nfs/dbraw/zinc/12/31/61/1131123161.db2.gz SXSLBYITZNHRTB-GFCCVEGCSA-N 1 1 271.335 3.793 20 10 CHCDMO CCCCC[N@@H+](C)Cc1cc(F)cc(Cl)c1[O-] ZINC001237807856 1131141962 /nfs/dbraw/zinc/14/19/62/1131141962.db2.gz NHVNVOKGKWUXOV-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237807806 1131142874 /nfs/dbraw/zinc/14/28/74/1131142874.db2.gz MJQJDTBDFPSJIM-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116442374 1131147137 /nfs/dbraw/zinc/14/71/37/1131147137.db2.gz TXTCXUWXDLKPJI-UHFFFAOYSA-N 1 1 284.403 3.820 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[NH+]1CCCCCCC1 ZINC001237937746 1131153551 /nfs/dbraw/zinc/15/35/51/1131153551.db2.gz UOEUYEWIJXFOTG-UHFFFAOYSA-N 1 1 271.763 3.951 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237939754 1131153663 /nfs/dbraw/zinc/15/36/63/1131153663.db2.gz FSBHUIWINRWOST-AOOOYVTPSA-N 1 1 271.763 3.663 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237939754 1131153667 /nfs/dbraw/zinc/15/36/67/1131153667.db2.gz FSBHUIWINRWOST-AOOOYVTPSA-N 1 1 271.763 3.663 20 10 CHCDMO CC[N@H+](Cc1ccccn1)Cc1cc(F)c(Cl)cc1O ZINC001237948630 1131154871 /nfs/dbraw/zinc/15/48/71/1131154871.db2.gz FREOTWKEPJAQQQ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO CC[N@@H+](Cc1ccccn1)Cc1cc(F)c(Cl)cc1O ZINC001237948630 1131154875 /nfs/dbraw/zinc/15/48/75/1131154875.db2.gz FREOTWKEPJAQQQ-UHFFFAOYSA-N 1 1 294.757 3.602 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)c1O ZINC001238057406 1131165192 /nfs/dbraw/zinc/16/51/92/1131165192.db2.gz KPJKTCICHCTCAT-NSHDSACASA-N 1 1 287.325 3.707 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)c1O ZINC001238061904 1131166134 /nfs/dbraw/zinc/16/61/34/1131166134.db2.gz LEZXYWNNGPPJNO-KGLIPLIRSA-N 1 1 277.383 3.852 20 10 CHCDMO CCC(CC)[N@@H+](CC)Cc1cc(F)cc(C)c1O ZINC001238069511 1131167790 /nfs/dbraw/zinc/16/77/90/1131167790.db2.gz IZUZVMQNLMREMQ-UHFFFAOYSA-N 1 1 253.361 3.850 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1O ZINC001238069976 1131168484 /nfs/dbraw/zinc/16/84/84/1131168484.db2.gz LSUSDSVURGWIDB-UHFFFAOYSA-N 1 1 294.757 3.520 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1ccc(F)cc1O ZINC000817587428 1131174308 /nfs/dbraw/zinc/17/43/08/1131174308.db2.gz WYIRKVURXMFWSX-GUTXKFCHSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1ccc(F)cc1O ZINC000817587431 1131174390 /nfs/dbraw/zinc/17/43/90/1131174390.db2.gz WYIRKVURXMFWSX-UMVBOHGHSA-N 1 1 281.371 3.530 20 10 CHCDMO CCCC[C@H](C[NH3+])[NH2+][C@H](CC)c1cccc(Cl)c1[O-] ZINC000817963700 1131192373 /nfs/dbraw/zinc/19/23/73/1131192373.db2.gz XENVGSXPEBFCAN-BXUZGUMPSA-N 1 1 284.831 3.604 20 10 CHCDMO CC[C@H]([NH2+]CC([NH3+])(CC)CC)c1cc(Cl)ccc1[O-] ZINC000817960821 1131192820 /nfs/dbraw/zinc/19/28/20/1131192820.db2.gz QXCQQRSXBQIXBB-ZDUSSCGKSA-N 1 1 284.831 3.604 20 10 CHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])c1[O-] ZINC000817959257 1131192878 /nfs/dbraw/zinc/19/28/78/1131192878.db2.gz DMBJCLVRFPCBLD-YWPYICTPSA-N 1 1 296.842 3.522 20 10 CHCDMO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccc(F)cc1O ZINC000817980395 1131194955 /nfs/dbraw/zinc/19/49/55/1131194955.db2.gz LBXRVKMADKWTAP-INIZCTEOSA-N 1 1 288.366 3.663 20 10 CHCDMO C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1[O-] ZINC000817986852 1131195051 /nfs/dbraw/zinc/19/50/51/1131195051.db2.gz USPWNYRKEZYTMX-AWEZNQCLSA-N 1 1 296.414 3.506 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1cccc(Cl)c1[O-] ZINC000817982097 1131195218 /nfs/dbraw/zinc/19/52/18/1131195218.db2.gz POQCJPWVQCGJFI-CABCVRRESA-N 1 1 296.842 3.604 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC12CC2)c1cc(Cl)c(Cl)cc1O ZINC000818357196 1131211248 /nfs/dbraw/zinc/21/12/48/1131211248.db2.gz WNCHDVCOVFOETF-JVXZTZIISA-N 1 1 272.175 3.902 20 10 CHCDMO CC[N@@H+](Cc1cnc(C2CC2)c(C)c1)Cc1ccccc1O ZINC001238626653 1131225430 /nfs/dbraw/zinc/22/54/30/1131225430.db2.gz YQUWZIDGNMQBOI-UHFFFAOYSA-N 1 1 296.414 3.995 20 10 CHCDMO CC(C)[N@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137831796 1131420515 /nfs/dbraw/zinc/42/05/15/1131420515.db2.gz NZYAQBPXXDOFOK-UHFFFAOYSA-N 1 1 273.351 3.942 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1c(O)cccc1F ZINC001137831796 1131420520 /nfs/dbraw/zinc/42/05/20/1131420520.db2.gz NZYAQBPXXDOFOK-UHFFFAOYSA-N 1 1 273.351 3.942 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001137838449 1131421052 /nfs/dbraw/zinc/42/10/52/1131421052.db2.gz AEQDAAHTDDNVLQ-LBPRGKRZSA-N 1 1 281.346 3.636 20 10 CHCDMO CC[N@H+](Cc1ccccc1F)Cc1cccc(F)c1O ZINC001138128778 1131470290 /nfs/dbraw/zinc/47/02/90/1131470290.db2.gz ZYOWGIHLNGCWSA-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC[N@@H+](Cc1ccccc1F)Cc1cccc(F)c1O ZINC001138128778 1131470292 /nfs/dbraw/zinc/47/02/92/1131470292.db2.gz ZYOWGIHLNGCWSA-UHFFFAOYSA-N 1 1 277.314 3.693 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(Br)cc1O)C1CC1 ZINC000824575621 1131474799 /nfs/dbraw/zinc/47/47/99/1131474799.db2.gz KXWLPNFULGOZJY-UHFFFAOYSA-N 1 1 284.197 3.528 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138213896 1131477755 /nfs/dbraw/zinc/47/77/55/1131477755.db2.gz FGUSFPAGXDPUPU-MRXNPFEDSA-N 1 1 272.436 3.909 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138213895 1131478054 /nfs/dbraw/zinc/47/80/54/1131478054.db2.gz FGUSFPAGXDPUPU-INIZCTEOSA-N 1 1 272.436 3.909 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000824714791 1131480599 /nfs/dbraw/zinc/48/05/99/1131480599.db2.gz GIWFOCNJRMTSAU-AAEUAGOBSA-N 1 1 287.325 3.863 20 10 CHCDMO Cc1c(C[N@H+](C)C2CC(C)C2)c2ccccc2n1C ZINC001138252764 1131482569 /nfs/dbraw/zinc/48/25/69/1131482569.db2.gz TVEGBNBSFCQWSL-UHFFFAOYSA-N 1 1 256.393 3.717 20 10 CHCDMO Cc1c(C[N@H+]2CCc3occc3C2)c2ccccc2n1C ZINC001138258241 1131483040 /nfs/dbraw/zinc/48/30/40/1131483040.db2.gz NGMDUSKFYFUWCK-UHFFFAOYSA-N 1 1 280.371 3.638 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCCCC34CC4)ccc21 ZINC001138355723 1131494156 /nfs/dbraw/zinc/49/41/56/1131494156.db2.gz AHBLYBQJZTYACL-UHFFFAOYSA-N 1 1 270.420 3.588 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)CCCN2C ZINC001138359124 1131494268 /nfs/dbraw/zinc/49/42/68/1131494268.db2.gz LMLMQQLDTSHJQQ-KRWDZBQOSA-N 1 1 272.436 3.689 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H]2C)c(OC)c1 ZINC001138387788 1131496923 /nfs/dbraw/zinc/49/69/23/1131496923.db2.gz LGNUQCRVAICUNB-OAHLLOKOSA-N 1 1 290.451 3.916 20 10 CHCDMO COC[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000825321960 1131506859 /nfs/dbraw/zinc/50/68/59/1131506859.db2.gz SSKBJBJMWOOMDQ-HNNXBMFYSA-N 1 1 299.414 3.794 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc3occc3c1)CC2 ZINC001138825736 1131553377 /nfs/dbraw/zinc/55/33/77/1131553377.db2.gz VDKUWZZWZYMZOF-UHFFFAOYSA-N 1 1 279.339 3.697 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH2+]C2(C3CCC3)CC2)c1O ZINC000844419749 1131560059 /nfs/dbraw/zinc/56/00/59/1131560059.db2.gz QTZVQOUUONKETO-UHFFFAOYSA-N 1 1 293.794 3.671 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1 ZINC000844442463 1131566109 /nfs/dbraw/zinc/56/61/09/1131566109.db2.gz YJHXRWYUFPJVOA-MRXNPFEDSA-N 1 1 294.389 3.764 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000844747668 1131595515 /nfs/dbraw/zinc/59/55/15/1131595515.db2.gz XPMKQXHPUVVEEK-OAHLLOKOSA-N 1 1 281.346 3.630 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000844756319 1131595683 /nfs/dbraw/zinc/59/56/83/1131595683.db2.gz ABFDUQNQGXCRCP-MRXNPFEDSA-N 1 1 289.325 3.777 20 10 CHCDMO Cc1cc(C[N@H+]2CCCCC23CC3)ccc1N(C)C ZINC001139673027 1131627540 /nfs/dbraw/zinc/62/75/40/1131627540.db2.gz OZKHQYFIYAHFQY-UHFFFAOYSA-N 1 1 258.409 3.580 20 10 CHCDMO CCC[N@@H+](CCCc1ccc(C)nc1)Cc1ccccc1O ZINC000792797831 1131653259 /nfs/dbraw/zinc/65/32/59/1131653259.db2.gz ILYRQOHGXDNIIS-UHFFFAOYSA-N 1 1 298.430 3.940 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCCC2(CC(F)C2)CC1 ZINC001140059203 1131660604 /nfs/dbraw/zinc/66/06/04/1131660604.db2.gz YSLPCVFZMWPSHS-UHFFFAOYSA-N 1 1 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CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(F)cc1O ZINC000857080433 1123584947 /nfs/dbraw/zinc/58/49/47/1123584947.db2.gz GLVCHKFYXDEPJE-BXKDBHETSA-N 1 1 273.298 3.617 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCCC[C@H]2C)c1O ZINC000211390537 1125304306 /nfs/dbraw/zinc/30/43/06/1125304306.db2.gz PMNXCMBEDMHUSO-CYBMUJFWSA-N 1 1 263.381 3.555 20 10 CHCDMO Cc1cc(C)c(C[N@@H+]2CCCCC(F)(F)C2)c(O)c1 ZINC001231841666 1132374948 /nfs/dbraw/zinc/37/49/48/1132374948.db2.gz CWEDZFPDFTYPIG-UHFFFAOYSA-N 1 1 269.335 3.630 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCCCC(F)(F)C2)c(O)c1 ZINC001231841666 1132374956 /nfs/dbraw/zinc/37/49/56/1132374956.db2.gz CWEDZFPDFTYPIG-UHFFFAOYSA-N 1 1 269.335 3.630 20 10 CHCDMO CC1(C)CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233417712 1132618461 /nfs/dbraw/zinc/61/84/61/1132618461.db2.gz FKNXMARFKHEQLC-UHFFFAOYSA-N 1 1 273.298 3.643 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233417712 1132618464 /nfs/dbraw/zinc/61/84/64/1132618464.db2.gz FKNXMARFKHEQLC-UHFFFAOYSA-N 1 1 273.298 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C[C@@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886648126 1125702754 /nfs/dbraw/zinc/70/27/54/1125702754.db2.gz MEKYAXZOPHSDTD-IUODEOHRSA-N 1 1 293.382 3.674 20 10 CHCDMO COc1cccc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000093867532 1125774611 /nfs/dbraw/zinc/77/46/11/1125774611.db2.gz ZBHAQJIOGXDSDZ-DYVFJYSZSA-N 1 1 283.371 3.594 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2O)[C@H]1C1CC1 ZINC000811513272 1130618216 /nfs/dbraw/zinc/61/82/16/1130618216.db2.gz FMPVQCNIMXDUCT-AWEZNQCLSA-N 1 1 265.784 3.666 20 10 CHCDMO COCCC1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CCCC1 ZINC000185747475 1126902000 /nfs/dbraw/zinc/90/20/00/1126902000.db2.gz ZYMPOPBGOGNGBA-ZDUSSCGKSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc(F)cc1O ZINC000796753826 1129214406 /nfs/dbraw/zinc/21/44/06/1129214406.db2.gz NQXRNLMPDKIALN-RDJZCZTQSA-N 1 1 295.398 3.513 20 10 CHCDMO C[C@@H]([NH2+]CC1(C)CC1)c1cccc(C(F)(F)F)c1O ZINC000815595685 1131006219 /nfs/dbraw/zinc/00/62/19/1131006219.db2.gz YDSHAWDWLTZFPK-SECBINFHSA-N 1 1 273.298 3.862 20 10 CHCDMO COc1cc(O)c(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c(Cl)c1 ZINC001236801205 1131012461 /nfs/dbraw/zinc/01/24/61/1131012461.db2.gz BQEXIUUCZYJYHL-PHIMTYICSA-N 1 1 283.799 3.817 20 10 CHCDMO CCCCC[N@@H+](C)Cc1c(O)ccc(F)c1Cl ZINC001237121427 1131056171 /nfs/dbraw/zinc/05/61/71/1131056171.db2.gz NAMZGVGEPUDXOJ-UHFFFAOYSA-N 1 1 259.752 3.807 20 10 CHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000164226297 1127156936 /nfs/dbraw/zinc/15/69/36/1127156936.db2.gz LCCOBSTXBGEIGD-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](CC2CC2)C2CC2)c1O ZINC001237687462 1131129005 /nfs/dbraw/zinc/12/90/05/1131129005.db2.gz CJCLDUHGYRYARA-UHFFFAOYSA-N 1 1 265.784 3.728 20 10 CHCDMO Cc1ncccc1C[N@@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237941262 1131153944 /nfs/dbraw/zinc/15/39/44/1131153944.db2.gz UISQYWHURYYSFB-UHFFFAOYSA-N 1 1 294.757 3.520 20 10 CHCDMO Cc1ncccc1C[N@H+](C)Cc1cc(F)c(Cl)cc1O ZINC001237941262 1131153946 /nfs/dbraw/zinc/15/39/46/1131153946.db2.gz UISQYWHURYYSFB-UHFFFAOYSA-N 1 1 294.757 3.520 20 10 CHCDMO CC[C@@H]([NH2+]CC1(CCO)CCCC1)c1ccc(F)cc1O ZINC000285955926 1127248863 /nfs/dbraw/zinc/24/88/63/1127248863.db2.gz GKIQFEISQIUJGO-OAHLLOKOSA-N 1 1 295.398 3.515 20 10 CHCDMO CC[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000286107479 1127258750 /nfs/dbraw/zinc/25/87/50/1127258750.db2.gz MYRTWMXECQMXCG-UKRRQHHQSA-N 1 1 281.371 3.531 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c1O ZINC001238059044 1131164653 /nfs/dbraw/zinc/16/46/53/1131164653.db2.gz ZCPRGHWEVAKWQB-TXEJJXNPSA-N 1 1 251.345 3.603 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(F)c2[O-])[C@@H](C)[C@H]1C ZINC001308826188 1127498325 /nfs/dbraw/zinc/49/83/25/1127498325.db2.gz UTIAKTMPTBTGRI-UTLUCORTSA-N 1 1 271.763 3.661 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)ccc1N(C)C ZINC000293771697 1127519218 /nfs/dbraw/zinc/51/92/18/1127519218.db2.gz KYWRPFSXLYWHIY-HNNXBMFYSA-N 1 1 283.419 3.649 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)ccc1N(C)C ZINC000293749624 1127517573 /nfs/dbraw/zinc/51/75/73/1127517573.db2.gz IOTFSXMOYJIPLC-OAHLLOKOSA-N 1 1 283.419 3.649 20 10 CHCDMO C[N@H+](Cc1cccc(O)c1)Cc1cc(F)c(Cl)cc1O ZINC001237933690 1129219997 /nfs/dbraw/zinc/21/99/97/1129219997.db2.gz FXCZUMOUISMBJF-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO C[N@@H+](Cc1cccc(O)c1)Cc1cc(F)c(Cl)cc1O ZINC001237933690 1129220002 /nfs/dbraw/zinc/22/00/02/1129220002.db2.gz FXCZUMOUISMBJF-UHFFFAOYSA-N 1 1 295.741 3.522 20 10 CHCDMO CC[N@@H+](CCC1CC1)Cc1cc(Cl)ccc1O ZINC000761226868 1127552046 /nfs/dbraw/zinc/55/20/46/1127552046.db2.gz WHADKXWPHODKHY-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC2(CCCC2)C1 ZINC001237935455 1129220445 /nfs/dbraw/zinc/22/04/45/1129220445.db2.gz DSTFFKBPMPDCHV-UHFFFAOYSA-N 1 1 283.774 3.951 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[N@H+]1CCC2(CCCC2)C1 ZINC001237935455 1129220449 /nfs/dbraw/zinc/22/04/49/1129220449.db2.gz DSTFFKBPMPDCHV-UHFFFAOYSA-N 1 1 283.774 3.951 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000295210665 1127627479 /nfs/dbraw/zinc/62/74/79/1127627479.db2.gz LMLPEQCBPQHOIZ-PBHICJAKSA-N 1 1 298.434 3.525 20 10 CHCDMO Oc1cc2c(cc1C[N@H+](CC(F)F)CC1CCC1)CCC2 ZINC000761294083 1127642062 /nfs/dbraw/zinc/64/20/62/1127642062.db2.gz VQECSWLZTSRKLO-UHFFFAOYSA-N 1 1 295.373 3.748 20 10 CHCDMO Oc1cc2c(cc1C[N@@H+](CC(F)F)CC1CCC1)CCC2 ZINC000761294083 1127642066 /nfs/dbraw/zinc/64/20/66/1127642066.db2.gz VQECSWLZTSRKLO-UHFFFAOYSA-N 1 1 295.373 3.748 20 10 CHCDMO C[C@H]([NH2+]Cc1ccc(F)cc1)c1ccc(F)cc1O ZINC000062744886 1127772531 /nfs/dbraw/zinc/77/25/31/1127772531.db2.gz MGNWQENHXXVDPF-JTQLQIEISA-N 1 1 263.287 3.521 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc(F)cc1O ZINC000062748438 1127773754 /nfs/dbraw/zinc/77/37/54/1127773754.db2.gz DVPLQYDGDYCSFP-MLGOLLRUSA-N 1 1 285.362 3.739 20 10 CHCDMO Cc1nc(NCc2ccc(N3CCCC3)cc2)c(C)c(C)[nH+]1 ZINC000174421463 1127892954 /nfs/dbraw/zinc/89/29/54/1127892954.db2.gz CLRNVRGLDSRZGY-UHFFFAOYSA-N 1 1 296.418 3.614 20 10 CHCDMO CC[C@@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(F)cc1O ZINC000926917209 1128202263 /nfs/dbraw/zinc/20/22/63/1128202263.db2.gz YQWQHKLSTAMEFS-DJIMGWMZSA-N 1 1 293.382 3.531 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000927101892 1128217661 /nfs/dbraw/zinc/21/76/61/1128217661.db2.gz PTAPCRWQLQAHDI-NEPJUHHUSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)c2ccccc2n1C ZINC001138252516 1128281439 /nfs/dbraw/zinc/28/14/39/1128281439.db2.gz JOOODJRMUHIUGG-IRXDYDNUSA-N 1 1 292.373 3.759 20 10 CHCDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000777825264 1128288264 /nfs/dbraw/zinc/28/82/64/1128288264.db2.gz RUONYXIEMLTNER-OAHLLOKOSA-N 1 1 269.388 3.764 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1snnc1C ZINC000929753967 1128285128 /nfs/dbraw/zinc/28/51/28/1128285128.db2.gz YYISCOIVNGOKDU-LBPRGKRZSA-N 1 1 291.420 3.525 20 10 CHCDMO CCC[N@@H+](Cc1c(C)noc1CC)Cc1ccccc1O ZINC000929752686 1128285261 /nfs/dbraw/zinc/28/52/61/1128285261.db2.gz DNEIAISVOYMXMO-UHFFFAOYSA-N 1 1 288.391 3.663 20 10 CHCDMO COc1cc(C)cc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000915838551 1128351530 /nfs/dbraw/zinc/35/15/30/1128351530.db2.gz GJEMMTWYMKCEQK-CQSZACIVSA-N 1 1 297.398 3.829 20 10 CHCDMO Cc1ccc(C)c(C[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000763379997 1128428947 /nfs/dbraw/zinc/42/89/47/1128428947.db2.gz LRPHDBKDPHWKFT-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C)cn1)Cc1ccccc1O ZINC000154157061 1128453268 /nfs/dbraw/zinc/45/32/68/1128453268.db2.gz OICNGISILNTISZ-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO CC[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccccc1O ZINC000155868526 1128617123 /nfs/dbraw/zinc/61/71/23/1128617123.db2.gz ZELQKZIZXMCOMW-RDJZCZTQSA-N 1 1 292.467 3.799 20 10 CHCDMO CC(C)[C@@H](C)[N@@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778988667 1128673778 /nfs/dbraw/zinc/67/37/78/1128673778.db2.gz KFRUNMOBAXHXBT-LLVKDONJSA-N 1 1 251.345 3.540 20 10 CHCDMO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1ccccc1O)CC3 ZINC000779000723 1128675291 /nfs/dbraw/zinc/67/52/91/1128675291.db2.gz ZUSOYWYHQWSNSA-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)Cc2ccccc21 ZINC000778995383 1128675297 /nfs/dbraw/zinc/67/52/97/1128675297.db2.gz RJLJRPFURCUAGD-GFCCVEGCSA-N 1 1 271.335 3.651 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000779009704 1128677032 /nfs/dbraw/zinc/67/70/32/1128677032.db2.gz DMUOPRMSMMLTMV-KRWDZBQOSA-N 1 1 281.399 3.847 20 10 CHCDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779020214 1128683466 /nfs/dbraw/zinc/68/34/66/1128683466.db2.gz KEAFAGRMOGOHEB-NSHDSACASA-N 1 1 289.325 3.790 20 10 CHCDMO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1cc(F)ccc1O ZINC000185472180 1117828619 /nfs/dbraw/zinc/82/86/19/1117828619.db2.gz YDHCUGSVKSFKNS-LRDDRELGSA-N 1 1 296.430 3.548 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)c(O)c1 ZINC000185471971 1117829078 /nfs/dbraw/zinc/82/90/78/1117829078.db2.gz SVJLIERDAQNINP-PBHICJAKSA-N 1 1 292.467 3.718 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccccc1Cl)CC2 ZINC001203385075 1117835707 /nfs/dbraw/zinc/83/57/07/1117835707.db2.gz IOCZPLLDQCYQQT-UHFFFAOYSA-N 1 1 273.763 3.604 20 10 CHCDMO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(F)cc1O)C(C)C ZINC000185625432 1117859934 /nfs/dbraw/zinc/85/99/34/1117859934.db2.gz AQTUKKRXSNAEAO-LRDDRELGSA-N 1 1 283.387 3.633 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCC1)CCC2 ZINC000728198737 1117869010 /nfs/dbraw/zinc/86/90/10/1117869010.db2.gz FHAHQDVLZRXTGS-KRWDZBQOSA-N 1 1 271.404 3.645 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000049099605 1128743192 /nfs/dbraw/zinc/74/31/92/1128743192.db2.gz WHQASOXOKWWEDV-MRXNPFEDSA-N 1 1 270.376 3.561 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000705476326 1117973337 /nfs/dbraw/zinc/97/33/37/1117973337.db2.gz IVWLSLRUMCCUNK-NSHDSACASA-N 1 1 253.773 3.668 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000179555485 1128747937 /nfs/dbraw/zinc/74/79/37/1128747937.db2.gz QAIAKOMVXIYADA-QGZVFWFLSA-N 1 1 267.372 3.599 20 10 CHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179647538 1128752686 /nfs/dbraw/zinc/75/26/86/1128752686.db2.gz MJSQBUXBCPQAHC-YJBOKZPZSA-N 1 1 299.414 3.726 20 10 CHCDMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC001650660160 1118081177 /nfs/dbraw/zinc/08/11/77/1118081177.db2.gz YUYWNXUADZXHLY-NSHDSACASA-N 1 1 293.411 3.507 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NCC[N@H+](CC)C(C)C)cc1 ZINC000765626840 1118184499 /nfs/dbraw/zinc/18/44/99/1118184499.db2.gz DGNGROLLNDLBNP-INIZCTEOSA-N 1 1 291.483 3.524 20 10 CHCDMO CCN(C)c1ccc([C@H](C)NCC[N@@H+](CC)C(C)C)cc1 ZINC000765626840 1118184502 /nfs/dbraw/zinc/18/45/02/1118184502.db2.gz DGNGROLLNDLBNP-INIZCTEOSA-N 1 1 291.483 3.524 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000179944244 1128768172 /nfs/dbraw/zinc/76/81/72/1128768172.db2.gz IAKYFJVGEZSPON-QGZVFWFLSA-N 1 1 297.398 3.910 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001203556181 1118368687 /nfs/dbraw/zinc/36/86/87/1118368687.db2.gz MKPRKNMKCJCVOT-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000180234959 1128782489 /nfs/dbraw/zinc/78/24/89/1128782489.db2.gz PSEQHFQVZRPVKW-IOASZLSFSA-N 1 1 275.392 3.554 20 10 CHCDMO CCC[N@@H+](Cc1csc(C)n1)Cc1ccccc1O ZINC000076724907 1128787636 /nfs/dbraw/zinc/78/76/36/1128787636.db2.gz LXFGTQROTLLXPP-UHFFFAOYSA-N 1 1 276.405 3.569 20 10 CHCDMO C[C@H]1CC[C@H](C)[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707146235 1118648405 /nfs/dbraw/zinc/64/84/05/1118648405.db2.gz KLNFQHYYTWAKHP-QWRGUYRKSA-N 1 1 298.224 3.775 20 10 CHCDMO CCOCC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176673085 1119092611 /nfs/dbraw/zinc/09/26/11/1119092611.db2.gz CNGKRBQFXIGULQ-MRXNPFEDSA-N 1 1 299.414 3.992 20 10 CHCDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562211 1119156840 /nfs/dbraw/zinc/15/68/40/1119156840.db2.gz AWELTMRVDQJAAH-SMDDNHRTSA-N 1 1 251.345 3.542 20 10 CHCDMO CCCC1CC[NH+](Cc2cc(F)cc(F)c2O)CC1 ZINC000708402196 1119437954 /nfs/dbraw/zinc/43/79/54/1119437954.db2.gz VOCSVFMJUMBGBT-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc(F)cc1O ZINC000252817226 1119467218 /nfs/dbraw/zinc/46/72/18/1119467218.db2.gz XTKDPJQCGFXZLM-NQBHXWOUSA-N 1 1 251.345 3.761 20 10 CHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@H]1CCOC(C)(C)C1 ZINC000291536351 1119649194 /nfs/dbraw/zinc/64/91/94/1119649194.db2.gz KUZPRJBFPSPSHL-INIZCTEOSA-N 1 1 291.435 3.789 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000179575787 1119751546 /nfs/dbraw/zinc/75/15/46/1119751546.db2.gz MTJPDPXSBOJCMI-KRWDZBQOSA-N 1 1 257.377 3.715 20 10 CHCDMO Cc1csc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000921668374 1120062925 /nfs/dbraw/zinc/06/29/25/1120062925.db2.gz XSUPXAGDNFVTTO-GFCCVEGCSA-N 1 1 288.416 3.627 20 10 CHCDMO COc1cccc(C[N@H+]2CCc3sccc3[C@H]2C)c1O ZINC000271018986 1120226500 /nfs/dbraw/zinc/22/65/00/1120226500.db2.gz AYZAPYHKWGZKDK-LLVKDONJSA-N 1 1 289.400 3.582 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC000228173059 1120272781 /nfs/dbraw/zinc/27/27/81/1120272781.db2.gz HBAIIESLPVJOEN-UKRRQHHQSA-N 1 1 275.392 3.555 20 10 CHCDMO CSCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000309883154 1120282881 /nfs/dbraw/zinc/28/28/81/1120282881.db2.gz WOILVXYYMYXAQK-ZETCQYMHSA-N 1 1 280.220 3.713 20 10 CHCDMO CC(C)[C@H]1OCCC[C@@H]1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000186093430 1120391313 /nfs/dbraw/zinc/39/13/13/1120391313.db2.gz VAFKWDHZGKSFHD-OGHNNQOOSA-N 1 1 295.398 3.633 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1c(C)noc1C ZINC000186186842 1120393231 /nfs/dbraw/zinc/39/32/31/1120393231.db2.gz UWBKAWCRPHGNTB-XPTSAGLGSA-N 1 1 292.354 3.938 20 10 CHCDMO CC[N@H+](Cc1cc(C)cc(Br)c1O)CC1CC1 ZINC000781912429 1120524115 /nfs/dbraw/zinc/52/41/15/1120524115.db2.gz PVMAIZBMNDDELD-UHFFFAOYSA-N 1 1 298.224 3.695 20 10 CHCDMO CC[N@@H+](Cc1cc(C)cc(Br)c1O)CC1CC1 ZINC000781912429 1120524111 /nfs/dbraw/zinc/52/41/11/1120524111.db2.gz PVMAIZBMNDDELD-UHFFFAOYSA-N 1 1 298.224 3.695 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC000093336668 1120785536 /nfs/dbraw/zinc/78/55/36/1120785536.db2.gz RNRWFYODFQOJFI-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CCN(C[C@H]1CCCC[N@H+]1C(C)C)c1ccc(OC)cc1 ZINC001167835455 1121035912 /nfs/dbraw/zinc/03/59/12/1121035912.db2.gz QQPDEMYLAHFNSK-QGZVFWFLSA-N 1 1 290.451 3.784 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000006209132 1121043565 /nfs/dbraw/zinc/04/35/65/1121043565.db2.gz NMFGWMOADGXYIR-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001137831861 1121179260 /nfs/dbraw/zinc/17/92/60/1121179260.db2.gz QDTABWJOSVMFMP-CQSZACIVSA-N 1 1 271.335 3.521 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC001137831861 1121179261 /nfs/dbraw/zinc/17/92/61/1121179261.db2.gz QDTABWJOSVMFMP-CQSZACIVSA-N 1 1 271.335 3.521 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H](CC(C)C)N(C)C)c1ccc(F)cc1O ZINC000796686541 1121216902 /nfs/dbraw/zinc/21/69/02/1121216902.db2.gz YXEBGYAKFJXPFV-GDBMZVCRSA-N 1 1 296.430 3.548 20 10 CHCDMO Oc1ccc(F)c(Cl)c1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001237122774 1128979024 /nfs/dbraw/zinc/97/90/24/1128979024.db2.gz YQBWMLCDGHROFS-PHIMTYICSA-N 1 1 283.774 3.807 20 10 CHCDMO COc1ccc([C@@H](C)[N@H+](C)Cc2c(O)cccc2F)cc1 ZINC001137838669 1121421539 /nfs/dbraw/zinc/42/15/39/1121421539.db2.gz GWTWHTPIIKMICB-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(O)cccc2F)cc1 ZINC001137838669 1121421543 /nfs/dbraw/zinc/42/15/43/1121421543.db2.gz GWTWHTPIIKMICB-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706225413 1121421822 /nfs/dbraw/zinc/42/18/22/1121421822.db2.gz IWFINHNGSNCMRB-RYUDHWBXSA-N 1 1 263.356 3.762 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH+]2CCC3(CC3)CC2)c1O ZINC000707120341 1121450719 /nfs/dbraw/zinc/45/07/19/1121450719.db2.gz 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ZINC001180613846 1122001289 /nfs/dbraw/zinc/00/12/89/1122001289.db2.gz VPASUVVECQQTDU-UHFFFAOYSA-N 1 1 260.425 3.683 20 10 CHCDMO CCOC1CC([N@@H+](C)Cc2cc(C(C)C)ccc2O)C1 ZINC001182129499 1122112385 /nfs/dbraw/zinc/11/23/85/1122112385.db2.gz YBFCUSOUOZZJNX-UHFFFAOYSA-N 1 1 277.408 3.515 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c(O)c1 ZINC000779605574 1129032010 /nfs/dbraw/zinc/03/20/10/1129032010.db2.gz UUFJBDBYCLJZAK-AWEZNQCLSA-N 1 1 289.419 3.803 20 10 CHCDMO CCOC[C@H](C)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774359680 1122157106 /nfs/dbraw/zinc/15/71/06/1122157106.db2.gz OGYVXIAHVCEBJO-DTWKUNHWSA-N 1 1 292.206 3.775 20 10 CHCDMO CCc1cccc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1O ZINC001182574065 1122175876 /nfs/dbraw/zinc/17/58/76/1122175876.db2.gz JMQADULOYPNRFH-SFHVURJKSA-N 1 1 297.398 3.608 20 10 CHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000271896626 1122181448 /nfs/dbraw/zinc/18/14/48/1122181448.db2.gz YGMUHIVRLBVJAI-OAHLLOKOSA-N 1 1 297.398 3.699 20 10 CHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001206544662 1122195642 /nfs/dbraw/zinc/19/56/42/1122195642.db2.gz MZFOYWIYTCKXKW-QGZVFWFLSA-N 1 1 291.435 3.905 20 10 CHCDMO CC1(C)C[C@@]1(C)C[NH2+]Cc1ccc(Cl)cc1O ZINC001183573847 1122229814 /nfs/dbraw/zinc/22/98/14/1122229814.db2.gz WGLIZCJYBUHPRJ-AWEZNQCLSA-N 1 1 253.773 3.571 20 10 CHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2)c1 ZINC000273422114 1122232401 /nfs/dbraw/zinc/23/24/01/1122232401.db2.gz SLMNPGIQBHLQER-OLZOCXBDSA-N 1 1 299.370 3.591 20 10 CHCDMO Cc1ccc2c(c1)C[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC001203651011 1122415286 /nfs/dbraw/zinc/41/52/86/1122415286.db2.gz HVNJQFJJQWJLHL-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+](C)[C@@H](C)C2CC2)c1O ZINC000775649393 1122862962 /nfs/dbraw/zinc/86/29/62/1122862962.db2.gz KCYZGWFDSHEGKM-JTQLQIEISA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)cc(C[N@H+](C(C)C)C2CC2)c1O ZINC000775653978 1122865040 /nfs/dbraw/zinc/86/50/40/1122865040.db2.gz PWWDXWNXDQMGEB-UHFFFAOYSA-N 1 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/nfs/dbraw/zinc/93/50/11/1122935011.db2.gz SRAUAJMYWWDBHQ-UHFFFAOYSA-N 1 1 259.393 3.879 20 10 CHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@H]2C(C)C)c1O ZINC000775763096 1122948491 /nfs/dbraw/zinc/94/84/91/1122948491.db2.gz DITVITDCIOMIGG-ZDUSSCGKSA-N 1 1 298.224 3.693 20 10 CHCDMO C[C@H]1c2sccc2CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001197432373 1122957007 /nfs/dbraw/zinc/95/70/07/1122957007.db2.gz ULQSXQWRZBCEJO-ZDUSSCGKSA-N 1 1 286.444 3.933 20 10 CHCDMO CC(=O)Nc1cc(Nc2ccc(NC(C)C)cc2)cc[nH+]1 ZINC001201489358 1123108801 /nfs/dbraw/zinc/10/88/01/1123108801.db2.gz OWRZTQVWEGREAB-UHFFFAOYSA-N 1 1 284.363 3.604 20 10 CHCDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201511566 1123113896 /nfs/dbraw/zinc/11/38/96/1123113896.db2.gz OGEOOUSICNDMCB-OAHLLOKOSA-N 1 1 260.425 3.765 20 10 CHCDMO Cc1ccc(CCC[N@H+](C)Cc2ccc(N(C)C)cc2)cn1 ZINC000776266494 1123194944 /nfs/dbraw/zinc/19/49/44/1123194944.db2.gz WGDCMGQGFOOJRE-UHFFFAOYSA-N 1 1 297.446 3.521 20 10 CHCDMO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccccc1O ZINC000895133303 1123246273 /nfs/dbraw/zinc/24/62/73/1123246273.db2.gz IJWLRGSKCXCZOH-CYBMUJFWSA-N 1 1 288.391 3.919 20 10 CHCDMO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cscn1 ZINC000850359700 1123256492 /nfs/dbraw/zinc/25/64/92/1123256492.db2.gz OMBCRTUUIRENEU-IHVVCDCBSA-N 1 1 287.432 3.573 20 10 CHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccccn1 ZINC000850483169 1123274590 /nfs/dbraw/zinc/27/45/90/1123274590.db2.gz ULSRSWJZDWCYCV-VXGBXAGGSA-N 1 1 290.794 3.895 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1ccc(F)cc1O ZINC000850535695 1123287036 /nfs/dbraw/zinc/28/70/36/1123287036.db2.gz ZJKJLVBCAYZLHI-ZLDLUXBVSA-N 1 1 281.371 3.530 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(F)cc1Cl ZINC000109771862 1123326226 /nfs/dbraw/zinc/32/62/26/1123326226.db2.gz IDQPNWUJBVVIPL-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CC(C)=CCC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000851841117 1123384253 /nfs/dbraw/zinc/38/42/53/1123384253.db2.gz NFZPNDIZJAWLGB-QGZVFWFLSA-N 1 1 289.419 3.730 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CC2=CCSC2)cc1C(C)C ZINC000853618586 1123445300 /nfs/dbraw/zinc/44/53/00/1123445300.db2.gz HPWRONVTFRBSIC-UHFFFAOYSA-N 1 1 291.460 3.929 20 10 CHCDMO CC[C@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000112465876 1123491768 /nfs/dbraw/zinc/49/17/68/1123491768.db2.gz KVAQZXRDXZYTRO-AWEZNQCLSA-N 1 1 255.361 3.920 20 10 CHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000112961944 1123506110 /nfs/dbraw/zinc/50/61/10/1123506110.db2.gz FTIAOWRGOVHDOP-HNNXBMFYSA-N 1 1 291.435 3.682 20 10 CHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(C(F)F)c(F)c1)C2 ZINC000895785454 1123514320 /nfs/dbraw/zinc/51/43/20/1123514320.db2.gz QNKFRNFYLSOLOI-UHFFFAOYSA-N 1 1 293.288 3.985 20 10 CHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(C(F)F)c(F)c1)C2 ZINC000895785454 1123514322 /nfs/dbraw/zinc/51/43/22/1123514322.db2.gz QNKFRNFYLSOLOI-UHFFFAOYSA-N 1 1 293.288 3.985 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c1O ZINC001237687804 1129129524 /nfs/dbraw/zinc/12/95/24/1129129524.db2.gz VHTMLUWJEUIEBP-ZYHUDNBSSA-N 1 1 267.800 3.974 20 10 CHCDMO CC[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(F)cc1O ZINC000857080434 1123584900 /nfs/dbraw/zinc/58/49/00/1123584900.db2.gz GLVCHKFYXDEPJE-CABZTGNLSA-N 1 1 273.298 3.617 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC000228631178 1123634111 /nfs/dbraw/zinc/63/41/11/1123634111.db2.gz SKMCTMWNNIIWDB-BXUZGUMPSA-N 1 1 295.810 3.819 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC(F)(F)C[C@@H]2C)cc1 ZINC000859837236 1123713371 /nfs/dbraw/zinc/71/33/71/1123713371.db2.gz FLZGINIRRXIGKE-ZDUSSCGKSA-N 1 1 282.378 3.762 20 10 CHCDMO C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000896953250 1123792850 /nfs/dbraw/zinc/79/28/50/1123792850.db2.gz WPVAJXQCFYQCHA-WCBMZHEXSA-N 1 1 289.803 3.558 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCCC(F)(F)CC2)cc1C ZINC000862467072 1123812919 /nfs/dbraw/zinc/81/29/19/1123812919.db2.gz NZUBKJBOYOZVNP-UHFFFAOYSA-N 1 1 269.335 3.630 20 10 CHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1cnc(C)cn1 ZINC000794545975 1123885994 /nfs/dbraw/zinc/88/59/94/1123885994.db2.gz NKHOOELFROSBRU-HNNXBMFYSA-N 1 1 299.418 3.854 20 10 CHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H](C)[NH+](CC)CC)cc1 ZINC000794828568 1123962442 /nfs/dbraw/zinc/96/24/42/1123962442.db2.gz CCHBHNRAXXKJJQ-HZPDHXFCSA-N 1 1 291.483 3.524 20 10 CHCDMO CCc1cccc(C[N@@H+](CC)CCC(F)(F)F)c1O ZINC000688518020 1124040041 /nfs/dbraw/zinc/04/00/41/1124040041.db2.gz BPCLZYWBCAHVIZ-UHFFFAOYSA-N 1 1 275.314 3.729 20 10 CHCDMO Nc1ccc([NH2+]CCCCOc2ccccc2)cc1 ZINC000841040349 1124112235 /nfs/dbraw/zinc/11/22/35/1124112235.db2.gz POXQWFSYJZKTTA-UHFFFAOYSA-N 1 1 256.349 3.540 20 10 CHCDMO C/C(Cl)=C\C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000528419753 1124658111 /nfs/dbraw/zinc/65/81/11/1124658111.db2.gz PGNBAEAHRIIZQO-XETPBLJFSA-N 1 1 295.810 3.516 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)C1CC(OC(C)(C)C)C1 ZINC000783650276 1124671813 /nfs/dbraw/zinc/67/18/13/1124671813.db2.gz MSTIQKMONKJILT-UHFFFAOYSA-N 1 1 291.435 3.950 20 10 CHCDMO CCCOc1ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1C ZINC000873129267 1124739628 /nfs/dbraw/zinc/73/96/28/1124739628.db2.gz JHZVKCPWTHEXDW-ZBFHGGJFSA-N 1 1 299.418 3.776 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Cl)c(C)cc2O)nc1 ZINC000825671926 1124760186 /nfs/dbraw/zinc/76/01/86/1124760186.db2.gz UCBHHVBOICEOKE-UHFFFAOYSA-N 1 1 290.794 3.689 20 10 CHCDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)c(O)c1 ZINC000876721615 1124972555 /nfs/dbraw/zinc/97/25/55/1124972555.db2.gz WFFBULQXLAPAKV-ZDUSSCGKSA-N 1 1 271.360 3.599 20 10 CHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2c(C)cccc2O)n1 ZINC000876741348 1124974246 /nfs/dbraw/zinc/97/42/46/1124974246.db2.gz SXICKBWIVAUTJJ-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO CCCC[N@@H+](CCC[C@H]1CCO1)Cc1ccccc1O ZINC000877503421 1125036718 /nfs/dbraw/zinc/03/67/18/1125036718.db2.gz LPNYYOLSNGYPQD-INIZCTEOSA-N 1 1 277.408 3.563 20 10 CHCDMO CCC[N@@H+](CCc1ccccn1)Cc1c(C)cccc1O ZINC000877523113 1125039295 /nfs/dbraw/zinc/03/92/95/1125039295.db2.gz WPVYNHNLOVSDBG-UHFFFAOYSA-N 1 1 284.403 3.550 20 10 CHCDMO Cc1ccc(C[N@H+](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000877533993 1125041334 /nfs/dbraw/zinc/04/13/34/1125041334.db2.gz YWHCXTLHWNTMNU-UHFFFAOYSA-N 1 1 269.335 3.710 20 10 CHCDMO C[C@@H](C[N@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877702965 1125066485 /nfs/dbraw/zinc/06/64/85/1125066485.db2.gz MLRZJTWCALLCEX-ZDUSSCGKSA-N 1 1 253.345 3.512 20 10 CHCDMO CC[N@@H+](Cc1[nH]nc2c1cccc2C)Cc1ccccc1O ZINC001137149002 1125241954 /nfs/dbraw/zinc/24/19/54/1125241954.db2.gz ABJSGBCBRKRYPN-UHFFFAOYSA-N 1 1 295.386 3.599 20 10 CHCDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(F)cc1 ZINC000882971962 1125364505 /nfs/dbraw/zinc/36/45/05/1125364505.db2.gz YNBQHIXPFIKALQ-UHFFFAOYSA-N 1 1 295.304 3.834 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1c(C)noc1C ZINC000883076932 1125370782 /nfs/dbraw/zinc/37/07/82/1125370782.db2.gz RQJKIQROPHLRSF-CYBMUJFWSA-N 1 1 296.317 3.516 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000131076726 1125373887 /nfs/dbraw/zinc/37/38/87/1125373887.db2.gz ZHHZAJXVWFXJKM-SNVBAGLBSA-N 1 1 265.740 3.832 20 10 CHCDMO CC(C)(C[NH2+]Cc1cc(F)cc(F)c1O)CC(F)(F)F ZINC000883182904 1125374925 /nfs/dbraw/zinc/37/49/25/1125374925.db2.gz NOBKXWUGNXDECW-UHFFFAOYSA-N 1 1 297.267 3.739 20 10 CHCDMO C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccc(F)cc1O ZINC000088455958 1129205865 /nfs/dbraw/zinc/20/58/65/1129205865.db2.gz AXIVTSUMNWBXPG-SNVBAGLBSA-N 1 1 263.356 3.618 20 10 CHCDMO COc1ccc(CNc2cc[nH+]c3ccsc32)c(O)c1 ZINC000795285477 1129210393 /nfs/dbraw/zinc/21/03/93/1129210393.db2.gz PXFLHUXBBIQCOD-UHFFFAOYSA-N 1 1 286.356 3.623 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1F ZINC000184910075 1129261648 /nfs/dbraw/zinc/26/16/48/1129261648.db2.gz DITAKPUTIJXCMS-LLVKDONJSA-N 1 1 277.314 3.830 20 10 CHCDMO C[C@@H]1SCC[N@@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000735668131 1129356463 /nfs/dbraw/zinc/35/64/63/1129356463.db2.gz POLZXCWPNSQWGK-STQMWFEESA-N 1 1 287.428 3.871 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc(Cl)c1F ZINC000091974640 1129376525 /nfs/dbraw/zinc/37/65/25/1129376525.db2.gz XEBYCRZMUHBYFT-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CCC[N@@H+](Cc1ccc(C)o1)Cc1ccccc1O ZINC000092704973 1129404601 /nfs/dbraw/zinc/40/46/01/1129404601.db2.gz NWTNJBDUAGBBDY-UHFFFAOYSA-N 1 1 259.349 3.706 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CCC=C(c3ccco3)C1)CCC2 ZINC000795651221 1129406970 /nfs/dbraw/zinc/40/69/70/1129406970.db2.gz QQNNUAHOCGLYKW-UHFFFAOYSA-N 1 1 295.382 3.763 20 10 CHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000093317126 1129421196 /nfs/dbraw/zinc/42/11/96/1129421196.db2.gz ZCNMYJDDLKDVRX-HNNXBMFYSA-N 1 1 297.826 3.827 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC=C(c3ccncc3)C2)c1 ZINC000795737436 1129446913 /nfs/dbraw/zinc/44/69/13/1129446913.db2.gz KNKRQDCYXJILED-UHFFFAOYSA-N 1 1 294.398 3.693 20 10 CHCDMO CCOC1CC(C[N@H+](CC(C)C)c2ccc(OC)cc2)C1 ZINC000795952743 1129460899 /nfs/dbraw/zinc/46/08/99/1129460899.db2.gz YEPXINFRNHASNV-UHFFFAOYSA-N 1 1 291.435 3.973 20 10 CHCDMO CCOC1CC(C[N@@H+](CC(C)C)c2ccc(OC)cc2)C1 ZINC000795952743 1129460900 /nfs/dbraw/zinc/46/09/00/1129460900.db2.gz YEPXINFRNHASNV-UHFFFAOYSA-N 1 1 291.435 3.973 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC2(CCCC2)C1 ZINC000743390856 1129521601 /nfs/dbraw/zinc/52/16/01/1129521601.db2.gz KQMRNMWZSPVKDM-UHFFFAOYSA-N 1 1 282.387 3.707 20 10 CHCDMO CC(C)[N@@H+](CCC1CC1)Cc1ccc(N(C)C)cc1 ZINC000743841790 1129537394 /nfs/dbraw/zinc/53/73/94/1129537394.db2.gz XEDUFOZOFDGJEO-UHFFFAOYSA-N 1 1 260.425 3.763 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000097987271 1129634209 /nfs/dbraw/zinc/63/42/09/1129634209.db2.gz QBNFLDXZMLHTBT-UHFFFAOYSA-N 1 1 255.361 3.777 20 10 CHCDMO CC[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1ccc(F)cc1O ZINC000796790595 1129777214 /nfs/dbraw/zinc/77/72/14/1129777214.db2.gz SIPURINQYPMDKC-USXIJHARSA-N 1 1 295.398 3.513 20 10 CHCDMO CC/C=C\CC[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000767307144 1129784978 /nfs/dbraw/zinc/78/49/78/1129784978.db2.gz VYBJULBJPGIGJS-PLNGDYQASA-N 1 1 288.435 3.564 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CC)Cc2ccccc2)c1 ZINC000768141335 1129833432 /nfs/dbraw/zinc/83/34/32/1129833432.db2.gz XDSWLMHDODOUSF-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO CC(C)(C)C(C)(C)C[NH2+]Cc1cccc(F)c1O ZINC000380928866 1129833644 /nfs/dbraw/zinc/83/36/44/1129833644.db2.gz GVDSLLLSSMCECK-UHFFFAOYSA-N 1 1 253.361 3.693 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccco2)C(C)C)c1 ZINC000768250431 1129846954 /nfs/dbraw/zinc/84/69/54/1129846954.db2.gz QOMDPKXXWNBMTA-UHFFFAOYSA-N 1 1 259.349 3.704 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000768247542 1129847307 /nfs/dbraw/zinc/84/73/07/1129847307.db2.gz BMDKWBCIJKERLH-QGZVFWFLSA-N 1 1 299.439 3.991 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000768237972 1129847800 /nfs/dbraw/zinc/84/78/00/1129847800.db2.gz OISLHZZYVJQGPL-GOSISDBHSA-N 1 1 297.398 3.670 20 10 CHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC000768359291 1129853572 /nfs/dbraw/zinc/85/35/72/1129853572.db2.gz CCLYRLWIGDLLNG-MRXNPFEDSA-N 1 1 297.398 3.780 20 10 CHCDMO C[N@@H+](Cc1cc2c(cc1O)CCCC2)C1CCCC1 ZINC000768442475 1129857674 /nfs/dbraw/zinc/85/76/74/1129857674.db2.gz QBRQAZZPLQRIMN-UHFFFAOYSA-N 1 1 259.393 3.645 20 10 CHCDMO CCC1(CC)C[N@@H+](Cc2cc(F)ccc2O)CCS1 ZINC000768528936 1129860019 /nfs/dbraw/zinc/86/00/19/1129860019.db2.gz MPSJBSBPERPXGH-UHFFFAOYSA-N 1 1 283.412 3.639 20 10 CHCDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1Cc1ccccc1O ZINC000768534614 1129861693 /nfs/dbraw/zinc/86/16/93/1129861693.db2.gz GWVMHQPBYSMHBU-IBGZPJMESA-N 1 1 281.399 3.989 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c(O)c1 ZINC000768545329 1129864016 /nfs/dbraw/zinc/86/40/16/1129864016.db2.gz XVNZPCRKCCSISN-LBPRGKRZSA-N 1 1 265.397 3.657 20 10 CHCDMO Cc1cc[nH+]c2cc(NCc3ccc(O)c(O)c3)ccc12 ZINC001169994509 1129870401 /nfs/dbraw/zinc/87/04/01/1129870401.db2.gz CJEVUVIZUJMAPC-UHFFFAOYSA-N 1 1 280.327 3.567 20 10 CHCDMO C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(F)cc1O ZINC000800501437 1129880974 /nfs/dbraw/zinc/88/09/74/1129880974.db2.gz PNSPSOLXKGJHOY-LBPRGKRZSA-N 1 1 298.361 3.906 20 10 CHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cc(Cl)ccc1O ZINC000768925363 1129881397 /nfs/dbraw/zinc/88/13/97/1129881397.db2.gz GTJZCIIPFKTIJF-UHFFFAOYSA-N 1 1 290.794 3.851 20 10 CHCDMO COc1cccc(C[N@@H+](CC2CCCCC2)C2CC2)c1O ZINC000768920329 1129881530 /nfs/dbraw/zinc/88/15/30/1129881530.db2.gz KUMXMFRSGAJIDX-UHFFFAOYSA-N 1 1 289.419 3.946 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3cc(F)cc(C)c3C2)c1 ZINC000800535757 1129882043 /nfs/dbraw/zinc/88/20/43/1129882043.db2.gz HDZJOAAXACOXMP-UHFFFAOYSA-N 1 1 285.362 3.706 20 10 CHCDMO COc1cccc(C[N@@H+](C)C2CCCCCCC2)c1O ZINC000769222631 1129896134 /nfs/dbraw/zinc/89/61/34/1129896134.db2.gz LBTZNZGYDRIXKA-UHFFFAOYSA-N 1 1 277.408 3.946 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000769319136 1129902417 /nfs/dbraw/zinc/90/24/17/1129902417.db2.gz RIVGGOCCWABTDF-HNNXBMFYSA-N 1 1 297.398 3.670 20 10 CHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1 ZINC000769331644 1129903205 /nfs/dbraw/zinc/90/32/05/1129903205.db2.gz VFVRVJARGSTKFG-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC000769354022 1129904323 /nfs/dbraw/zinc/90/43/23/1129904323.db2.gz ZCVGPVKLNJTDGO-ZDUSSCGKSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000769399099 1129906170 /nfs/dbraw/zinc/90/61/70/1129906170.db2.gz VSRDCUVQPDRLSR-OAHLLOKOSA-N 1 1 285.362 3.829 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCC3(CCCC3)C2)c(O)c1 ZINC000769402130 1129906334 /nfs/dbraw/zinc/90/63/34/1129906334.db2.gz BHRSSOIYAUJRCZ-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CCOc1ccc(C[N@H+]2CCCCC[C@@H]2C)c(O)c1 ZINC000769405952 1129907158 /nfs/dbraw/zinc/90/71/58/1129907158.db2.gz ZFMZSAGPCBCSPU-ZDUSSCGKSA-N 1 1 263.381 3.555 20 10 CHCDMO COc1cccc(C[N@H+]2Cc3ccccc3C(C)(C)C2)c1O ZINC000769427158 1129907688 /nfs/dbraw/zinc/90/76/88/1129907688.db2.gz DNQYRNSHGAGBKX-UHFFFAOYSA-N 1 1 297.398 3.694 20 10 CHCDMO CCOc1cccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC000769483368 1129909546 /nfs/dbraw/zinc/90/95/46/1129909546.db2.gz PIGCHVSEFJJWSK-AWEZNQCLSA-N 1 1 297.398 3.738 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)c1O ZINC000769452315 1129911230 /nfs/dbraw/zinc/91/12/30/1129911230.db2.gz WFTWRKAGZIDEEO-KGLIPLIRSA-N 1 1 277.408 3.801 20 10 CHCDMO CC(C)[N@@H+](Cc1cc(Cl)ccc1O)C1CCC1 ZINC000769471027 1129912541 /nfs/dbraw/zinc/91/25/41/1129912541.db2.gz QBIZMDWLHZAVKS-UHFFFAOYSA-N 1 1 253.773 3.809 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H](CC(C)C)C2)c1O ZINC000769506610 1129914823 /nfs/dbraw/zinc/91/48/23/1129914823.db2.gz ZNAWRKBQXFNMII-AWEZNQCLSA-N 1 1 277.408 3.659 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000769506891 1129915120 /nfs/dbraw/zinc/91/51/20/1129915120.db2.gz XZASGVIFVQRJOO-CQSZACIVSA-N 1 1 287.790 3.863 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1 ZINC000769541281 1129916342 /nfs/dbraw/zinc/91/63/42/1129916342.db2.gz TXCZYWOCSHVHOP-IFXJQAMLSA-N 1 1 297.398 3.984 20 10 CHCDMO CCCC[N@@H+](Cc1ncc(CC)o1)Cc1ccccc1O ZINC000801595660 1129930878 /nfs/dbraw/zinc/93/08/78/1129930878.db2.gz HXPDMYHSCPONQC-UHFFFAOYSA-N 1 1 288.391 3.745 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1CC[C@H](C)O1 ZINC000801594584 1129930916 /nfs/dbraw/zinc/93/09/16/1129930916.db2.gz GUKJFJLTGAGNIT-GOEBONIOSA-N 1 1 277.408 3.562 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CCCCO1 ZINC000801596013 1129931651 /nfs/dbraw/zinc/93/16/51/1129931651.db2.gz ZBGKZNVZIHMPDF-INIZCTEOSA-N 1 1 277.408 3.563 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)c1 ZINC000770349845 1129945735 /nfs/dbraw/zinc/94/57/35/1129945735.db2.gz NLCKDUGRVIICAC-LIRRHRJNSA-N 1 1 297.398 3.525 20 10 CHCDMO CCCOc1ccc2c(c1)CC[N@H+](Cc1ccccc1O)C2 ZINC000770505270 1129947797 /nfs/dbraw/zinc/94/77/97/1129947797.db2.gz MODFZCCNBRBWSX-UHFFFAOYSA-N 1 1 297.398 3.739 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1O ZINC000770509105 1129948358 /nfs/dbraw/zinc/94/83/58/1129948358.db2.gz IENDUOAUELPSNS-UHFFFAOYSA-N 1 1 298.430 3.869 20 10 CHCDMO Oc1ccccc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000770510625 1129949040 /nfs/dbraw/zinc/94/90/40/1129949040.db2.gz OQGUVCSIGIRNOI-AWEZNQCLSA-N 1 1 271.335 3.521 20 10 CHCDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1O ZINC000770509833 1129949361 /nfs/dbraw/zinc/94/93/61/1129949361.db2.gz UNJCLUYGYFCXMP-CQSZACIVSA-N 1 1 273.401 3.963 20 10 CHCDMO CC(C)[N@@H+](CCc1cccnc1)Cc1ccc(N(C)C)cc1 ZINC000771790873 1129989863 /nfs/dbraw/zinc/98/98/63/1129989863.db2.gz IJYRDPMIEXSWID-UHFFFAOYSA-N 1 1 297.446 3.601 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000802656923 1130027969 /nfs/dbraw/zinc/02/79/69/1130027969.db2.gz SCHOGRRXRALMTE-GOSISDBHSA-N 1 1 285.362 3.771 20 10 CHCDMO CCOc1ccc(CNc2ccc3c(c2)[nH+]cn3C)cc1F ZINC000785497658 1130036844 /nfs/dbraw/zinc/03/68/44/1130036844.db2.gz VHAFFVYJZFFPSZ-UHFFFAOYSA-N 1 1 299.349 3.723 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@H+]2C[C@@H]1CCO[C@H](C)C1 ZINC000785762726 1130054432 /nfs/dbraw/zinc/05/44/32/1130054432.db2.gz XVJNRZJZKHHIPC-HUUCEWRRSA-N 1 1 289.419 3.653 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@@H+]2C[C@@H]1CCO[C@H](C)C1 ZINC000785762726 1130054437 /nfs/dbraw/zinc/05/44/37/1130054437.db2.gz XVJNRZJZKHHIPC-HUUCEWRRSA-N 1 1 289.419 3.653 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC[C@H]2CCCO2)cc1 ZINC000786577870 1130106347 /nfs/dbraw/zinc/10/63/47/1130106347.db2.gz RHJMBKCROBUCGN-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCSC2)cc1 ZINC000787063219 1130130541 /nfs/dbraw/zinc/13/05/41/1130130541.db2.gz AJCGNJKFCJKSPC-MRXNPFEDSA-N 1 1 292.492 3.718 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CCOC(C)(C)C)C2CC2)cc1 ZINC000746651246 1130137051 /nfs/dbraw/zinc/13/70/51/1130137051.db2.gz QMBSUBHHORXZPI-UHFFFAOYSA-N 1 1 290.451 3.532 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1O ZINC000903262495 1130139265 /nfs/dbraw/zinc/13/92/65/1130139265.db2.gz FGWAKKBOLSBLEW-RCBQFDQVSA-N 1 1 295.398 3.513 20 10 CHCDMO C[C@@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc(Cl)cc1O ZINC000903279836 1130144287 /nfs/dbraw/zinc/14/42/87/1130144287.db2.gz QJTMQIBSDOMJDE-WIZUOIALSA-N 1 1 295.810 3.654 20 10 CHCDMO CC[C@H]([NH2+]CCc1cccnc1C)c1ccc(F)cc1O ZINC000903417562 1130173422 /nfs/dbraw/zinc/17/34/22/1130173422.db2.gz CQHYKTVDQXDFSM-INIZCTEOSA-N 1 1 288.366 3.518 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cccc(C(F)(F)F)c1O ZINC000788688281 1130200531 /nfs/dbraw/zinc/20/05/31/1130200531.db2.gz RZCOENMHDPSTHC-DTWKUNHWSA-N 1 1 299.296 3.546 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)c1cn[nH]c1 ZINC000788688285 1130201051 /nfs/dbraw/zinc/20/10/51/1130201051.db2.gz RZCOENMHDPSTHC-RKDXNWHRSA-N 1 1 299.296 3.546 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)C1CCCCC1 ZINC000789325601 1130244046 /nfs/dbraw/zinc/24/40/46/1130244046.db2.gz BOYFCKKBIPDCCB-GOSISDBHSA-N 1 1 291.435 3.545 20 10 CHCDMO CC[C@@H](C)[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790956924 1130340840 /nfs/dbraw/zinc/34/08/40/1130340840.db2.gz XPSRVYQQHSLKER-BDAKNGLRSA-N 1 1 259.752 3.709 20 10 CHCDMO 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ZINC001140183713 1131674077 /nfs/dbraw/zinc/67/40/77/1131674077.db2.gz IDPWUMUCCWVGMA-UHFFFAOYSA-N 1 1 298.430 3.707 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1O ZINC001140182704 1131674255 /nfs/dbraw/zinc/67/42/55/1131674255.db2.gz XRRJAXYUNGMBDX-QGZVFWFLSA-N 1 1 267.372 3.956 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC12CCCC2 ZINC000845999331 1131676872 /nfs/dbraw/zinc/67/68/72/1131676872.db2.gz HMKFPMIFBOQDJU-UHFFFAOYSA-N 1 1 251.757 3.564 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1(C2CCC2)CC1 ZINC000846054698 1131685532 /nfs/dbraw/zinc/68/55/32/1131685532.db2.gz DUUAAJHUKLMZLN-UHFFFAOYSA-N 1 1 269.747 3.607 20 10 CHCDMO CC[C@@H]([NH2+]CC1(OC)CCCC1)c1ccc(F)cc1O ZINC000834814134 1131707265 /nfs/dbraw/zinc/70/72/65/1131707265.db2.gz FSASLFJSZQURJW-CQSZACIVSA-N 1 1 281.371 3.531 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001140465429 1131751620 /nfs/dbraw/zinc/75/16/20/1131751620.db2.gz NAGBPWHMYKRBBB-RISCZKNCSA-N 1 1 265.784 3.810 20 10 CHCDMO CC(C)OCCC[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835025911 1131759785 /nfs/dbraw/zinc/75/97/85/1131759785.db2.gz NJLQZACAVUVHPB-SOFGYWHQSA-N 1 1 290.451 3.513 20 10 CHCDMO C[C@H]1CCSCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835049400 1131764908 /nfs/dbraw/zinc/76/49/08/1131764908.db2.gz RDRBANMEMZXUEO-RGDDUWESSA-N 1 1 290.476 3.593 20 10 CHCDMO CN(C)c1ccc(/C=C\C[N@@H+](C)Cc2ccc(O)cc2)cc1 ZINC000835054762 1131766308 /nfs/dbraw/zinc/76/63/08/1131766308.db2.gz YBCPJKYAEZJENJ-PLNGDYQASA-N 1 1 296.414 3.603 20 10 CHCDMO C[N@H+]1CC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228420290 1131879299 /nfs/dbraw/zinc/87/92/99/1131879299.db2.gz UIFTVWMMZMANHM-NIVDNSEKSA-N 1 1 297.358 3.891 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC001140745547 1131905109 /nfs/dbraw/zinc/90/51/09/1131905109.db2.gz KHMQAGQAWLAMJX-MRXNPFEDSA-N 1 1 283.371 3.743 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1O ZINC001140749133 1131906576 /nfs/dbraw/zinc/90/65/76/1131906576.db2.gz 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/nfs/dbraw/zinc/96/93/96/1131969396.db2.gz VRILDJFXBBJDGN-AWEZNQCLSA-N 1 1 285.362 3.829 20 10 CHCDMO Cc1cc([NH+]2CCCC2)ccc1NCc1ccccc1O ZINC000036955702 1131982078 /nfs/dbraw/zinc/98/20/78/1131982078.db2.gz ZLZIBDJEDAPUJB-UHFFFAOYSA-N 1 1 282.387 3.913 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC001141156602 1132028986 /nfs/dbraw/zinc/02/89/86/1132028986.db2.gz OIDZIKCGVWAMDJ-MRXNPFEDSA-N 1 1 287.334 3.574 20 10 CHCDMO Oc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccccc2F)c1 ZINC001141159330 1132031519 /nfs/dbraw/zinc/03/15/19/1132031519.db2.gz FDBLPQSCKXJMKL-INIZCTEOSA-N 1 1 287.334 3.574 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)CC)cc2)[C@H](CC)CO1 ZINC001171778860 1132098703 /nfs/dbraw/zinc/09/87/03/1132098703.db2.gz QULLHEQMNXDWPE-SJLPKXTDSA-N 1 1 290.451 3.532 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000228136792 1132107791 /nfs/dbraw/zinc/10/77/91/1132107791.db2.gz GYJLSXKQXNQORD-GOEBONIOSA-N 1 1 259.393 3.855 20 10 CHCDMO CCN(CC)c1ccc(C[NH+]2CC3(CC(F)C3)C2)cc1F ZINC000839141091 1132184911 /nfs/dbraw/zinc/18/49/11/1132184911.db2.gz YGVMTVCMIZHABT-UHFFFAOYSA-N 1 1 294.389 3.606 20 10 CHCDMO CC[C@H](CC(C)C)[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001172404222 1132196407 /nfs/dbraw/zinc/19/64/07/1132196407.db2.gz SXSAUUDQNGMFMC-OAHLLOKOSA-N 1 1 277.408 3.671 20 10 CHCDMO COC[C@]1(C)CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840108687 1132247294 /nfs/dbraw/zinc/24/72/94/1132247294.db2.gz RLORZTFUPLRSFK-GOSISDBHSA-N 1 1 291.435 3.682 20 10 CHCDMO CC[C@@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)c1ccc(F)cc1O ZINC000840766157 1132285031 /nfs/dbraw/zinc/28/50/31/1132285031.db2.gz IMNACMOBUPMHIF-VNHYZAJKSA-N 1 1 281.371 3.528 20 10 CHCDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc3cncn3c2)c(O)c1C ZINC000840781302 1132286680 /nfs/dbraw/zinc/28/66/80/1132286680.db2.gz ZVTCXYIZDUZPAP-AWEZNQCLSA-N 1 1 295.386 3.508 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)[C@@](C)(OC)C1CC1)c1ccc(F)cc1O ZINC000840858660 1132296156 /nfs/dbraw/zinc/29/61/56/1132296156.db2.gz FURVOAHOPLMRLP-XQAQDONZSA-N 1 1 295.398 3.776 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000840908198 1132308353 /nfs/dbraw/zinc/30/83/53/1132308353.db2.gz PSYTVYMCUKHENE-SFHVURJKSA-N 1 1 283.419 3.726 20 10 CHCDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840950629 1132311490 /nfs/dbraw/zinc/31/14/90/1132311490.db2.gz PPSUIORROIFJJA-HNNXBMFYSA-N 1 1 292.492 3.636 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001231591163 1132317066 /nfs/dbraw/zinc/31/70/66/1132317066.db2.gz VDLGDXMVWBXYMZ-GFCCVEGCSA-N 1 1 269.335 3.568 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001231587365 1132318396 /nfs/dbraw/zinc/31/83/96/1132318396.db2.gz ADUBTGPLRYJTQP-OAHLLOKOSA-N 1 1 295.304 3.725 20 10 CHCDMO CCCO[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231588991 1132318791 /nfs/dbraw/zinc/31/87/91/1132318791.db2.gz ULORAGHMBVQGIG-OAHLLOKOSA-N 1 1 285.387 3.546 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1O ZINC001231593717 1132319939 /nfs/dbraw/zinc/31/99/39/1132319939.db2.gz LKYJOLHHHWFZAB-UHFFFAOYSA-N 1 1 279.383 3.990 20 10 CHCDMO COc1cccc([C@@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594845 1132322173 /nfs/dbraw/zinc/32/21/73/1132322173.db2.gz PYSCDWSSRBRSDS-MRXNPFEDSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1ccc2c(c1)C[C@@H]([N@@H+](C)Cc1ccccc1O)CC2 ZINC001172840390 1132333694 /nfs/dbraw/zinc/33/36/94/1132333694.db2.gz BFVPHIVMQCBNOQ-SFHVURJKSA-N 1 1 281.399 3.690 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3c(C)cccc3C2)c(O)c1 ZINC001231842246 1132375623 /nfs/dbraw/zinc/37/56/23/1132375623.db2.gz LQUQKKOYRHFMJL-UHFFFAOYSA-N 1 1 281.399 3.876 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001231854013 1132378462 /nfs/dbraw/zinc/37/84/62/1132378462.db2.gz VOAPIPIECUUKJT-YOEHRIQHSA-N 1 1 288.435 3.526 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231845906 1132378676 /nfs/dbraw/zinc/37/86/76/1132378676.db2.gz UEGONGRMTNAWED-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1cc(C)c(C[N@@H+](C)Cc2nc3ccccc3o2)c(O)c1 ZINC001231849546 1132379976 /nfs/dbraw/zinc/37/99/76/1132379976.db2.gz RGSBDGHWRQEXIW-UHFFFAOYSA-N 1 1 296.370 3.782 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](CC2CC2)C(C)C)cc1Cl ZINC001231870733 1132385040 /nfs/dbraw/zinc/38/50/40/1132385040.db2.gz QUHCSJVWSPTXDP-UHFFFAOYSA-N 1 1 267.800 3.974 20 10 CHCDMO Cc1cc(O)c(C[N@H+](CC2CC2)C(C)C)cc1Cl ZINC001231870733 1132385049 /nfs/dbraw/zinc/38/50/49/1132385049.db2.gz QUHCSJVWSPTXDP-UHFFFAOYSA-N 1 1 267.800 3.974 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C(F)F)C2)cc1Cl ZINC001231870851 1132385378 /nfs/dbraw/zinc/38/53/78/1132385378.db2.gz VFSWXWWGDMLORH-SNVBAGLBSA-N 1 1 289.753 3.831 20 10 CHCDMO CC(C)OCCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841744293 1132387837 /nfs/dbraw/zinc/38/78/37/1132387837.db2.gz NQUXWENLBYSADA-LLVKDONJSA-N 1 1 271.788 3.511 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCC[C@@]1(C)O ZINC001231879574 1132389075 /nfs/dbraw/zinc/38/90/75/1132389075.db2.gz IZCXNJXCKWVHOW-IFXJQAMLSA-N 1 1 299.414 3.528 20 10 CHCDMO C[C@@H]([NH2+]CC1(CO)CCCCC1)c1ccc(Cl)cc1O ZINC000841747288 1132391035 /nfs/dbraw/zinc/39/10/35/1132391035.db2.gz AEWFZRHUDOKJOR-GFCCVEGCSA-N 1 1 297.826 3.639 20 10 CHCDMO C[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841753020 1132391762 /nfs/dbraw/zinc/39/17/62/1132391762.db2.gz DNTIQEFEJZPQSX-QMMMGPOBSA-N 1 1 275.726 3.742 20 10 CHCDMO Oc1c(C[N@H+]2CCCC[C@@H](F)C2)ccc2ccccc21 ZINC001231879615 1132392372 /nfs/dbraw/zinc/39/23/72/1132392372.db2.gz KQWUXYXZOIFHKB-OAHLLOKOSA-N 1 1 273.351 3.869 20 10 CHCDMO Oc1c(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)ccc2ccccc21 ZINC001231879347 1132392401 /nfs/dbraw/zinc/39/24/01/1132392401.db2.gz CGPTXAFTCKNZNF-MAUKXSAKSA-N 1 1 297.398 3.546 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(Cl)cc1O ZINC000841757138 1132393411 /nfs/dbraw/zinc/39/34/11/1132393411.db2.gz FBGDOQRBEMRFLQ-GHMZBOCLSA-N 1 1 283.799 3.511 20 10 CHCDMO Cc1ncsc1CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841758525 1132393533 /nfs/dbraw/zinc/39/35/33/1132393533.db2.gz SRLLMTVDTYYTFF-VIFPVBQESA-N 1 1 296.823 3.704 20 10 CHCDMO Cc1ncsc1CC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841758518 1132394229 /nfs/dbraw/zinc/39/42/29/1132394229.db2.gz SRLLMTVDTYYTFF-SECBINFHSA-N 1 1 296.823 3.704 20 10 CHCDMO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(Cl)cc1O ZINC000841758325 1132394406 /nfs/dbraw/zinc/39/44/06/1132394406.db2.gz LDBHMYCGPAPWDQ-HZMBPMFUSA-N 1 1 285.840 3.982 20 10 CHCDMO CSCC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841761910 1132396421 /nfs/dbraw/zinc/39/64/21/1132396421.db2.gz HRWJXQBKMDLJPX-UWVGGRQHSA-N 1 1 273.829 3.838 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001142508553 1132403582 /nfs/dbraw/zinc/40/35/82/1132403582.db2.gz CQHRMGIRFZIDJO-UHFFFAOYSA-N 1 1 281.346 3.827 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCCC2(CCCC2)C1 ZINC001142508553 1132403588 /nfs/dbraw/zinc/40/35/88/1132403588.db2.gz CQHRMGIRFZIDJO-UHFFFAOYSA-N 1 1 281.346 3.827 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH+]1C2CCCC1CCC2 ZINC001142531455 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/nfs/dbraw/zinc/51/47/24/1125514724.db2.gz LFDMPUSBCDVBID-UHFFFAOYSA-N 1 1 267.372 3.649 20 10 CHCDMO Oc1ccccc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000282917395 1125554490 /nfs/dbraw/zinc/55/44/90/1125554490.db2.gz DVNJSGASJPVSSG-AWEZNQCLSA-N 1 1 299.336 3.947 20 10 CHCDMO COc1cccc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886507681 1125681023 /nfs/dbraw/zinc/68/10/23/1125681023.db2.gz VDCIQRXAMHRSAW-NWDGAFQWSA-N 1 1 289.350 3.952 20 10 CHCDMO Cc1ccsc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886512667 1125682633 /nfs/dbraw/zinc/68/26/33/1125682633.db2.gz KTYQAKFMEINFDO-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1c(O)cccc1F ZINC000886522250 1125683285 /nfs/dbraw/zinc/68/32/85/1125683285.db2.gz FVYNJCFRNZTCJE-NWDGAFQWSA-N 1 1 289.350 3.519 20 10 CHCDMO COc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(C)c1 ZINC000886551776 1125689880 /nfs/dbraw/zinc/68/98/80/1125689880.db2.gz OHAQPDBMDCAUDB-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO CC(C)OC1CCC([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886555026 1125689977 /nfs/dbraw/zinc/68/99/77/1125689977.db2.gz JBHSQKWSHHKEIT-HSBZDZAISA-N 1 1 295.398 3.918 20 10 CHCDMO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1c(O)cccc1F ZINC000886572108 1125691228 /nfs/dbraw/zinc/69/12/28/1125691228.db2.gz YNDHQSGWZDVING-LBPRGKRZSA-N 1 1 271.335 3.871 20 10 CHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886589995 1125694066 /nfs/dbraw/zinc/69/40/66/1125694066.db2.gz LIYHFOYGFAFUTQ-BDAKNGLRSA-N 1 1 279.277 3.913 20 10 CHCDMO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886606671 1125697174 /nfs/dbraw/zinc/69/71/74/1125697174.db2.gz CZCMMJAZPLLRTQ-SNVBAGLBSA-N 1 1 294.757 3.739 20 10 CHCDMO CSC[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000798181869 1129826801 /nfs/dbraw/zinc/82/68/01/1129826801.db2.gz AOUQHIUNKHORJN-RKDXNWHRSA-N 1 1 293.354 3.813 20 10 CHCDMO C[N@H+](Cc1cscc1Cl)Cc1ccccc1O ZINC000768873597 1129878523 /nfs/dbraw/zinc/87/85/23/1129878523.db2.gz QOMZSADWZMZLMC-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO C[N@@H+](Cc1cscc1Cl)Cc1ccccc1O ZINC000768873597 1129878525 /nfs/dbraw/zinc/87/85/25/1129878525.db2.gz QOMZSADWZMZLMC-UHFFFAOYSA-N 1 1 267.781 3.739 20 10 CHCDMO CC(C)[N@@H+](Cc1cccs1)Cc1ccccc1O ZINC000770509173 1129947896 /nfs/dbraw/zinc/94/78/96/1129947896.db2.gz JDUUIOHLBWETSD-UHFFFAOYSA-N 1 1 261.390 3.864 20 10 CHCDMO C[C@@H]1CCC[N@H+](Cc2cccc(Br)c2O)[C@@H]1C ZINC000133713052 1126787269 /nfs/dbraw/zinc/78/72/69/1126787269.db2.gz BZRFDNOIEJTVHA-GHMZBOCLSA-N 1 1 298.224 3.775 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cccc(Br)c2O)[C@@H]1C ZINC000133713052 1126787272 /nfs/dbraw/zinc/78/72/72/1126787272.db2.gz BZRFDNOIEJTVHA-GHMZBOCLSA-N 1 1 298.224 3.775 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccccn2)cc1C ZINC000182067355 1126865489 /nfs/dbraw/zinc/86/54/89/1126865489.db2.gz AWKKSQODNOIXKL-AWEZNQCLSA-N 1 1 270.376 3.597 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)c2ccncc2)cc1C ZINC000183705542 1126890918 /nfs/dbraw/zinc/89/09/18/1126890918.db2.gz NIDKJNXLXNNGLX-CQSZACIVSA-N 1 1 270.376 3.597 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccncc1 ZINC000185541020 1126900599 /nfs/dbraw/zinc/90/05/99/1126900599.db2.gz MVJKWRSYELLVFW-IAQYHMDHSA-N 1 1 274.339 3.728 20 10 CHCDMO CC[C@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192841665 1126964692 /nfs/dbraw/zinc/96/46/92/1126964692.db2.gz GDNKLPMUSLGTEM-SDBXPKJASA-N 1 1 292.206 3.511 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1ccc(F)cc1O ZINC000698085003 1127061512 /nfs/dbraw/zinc/06/15/12/1127061512.db2.gz JJKKWOPHIAEGBP-MRVPVSSYSA-N 1 1 269.703 3.629 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(N(C)C)cc1 ZINC000271429302 1127080715 /nfs/dbraw/zinc/08/07/15/1127080715.db2.gz AWFGVTZZPMBLSK-DLBZAZTESA-N 1 1 298.434 3.594 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001236796494 1131008064 /nfs/dbraw/zinc/00/80/64/1131008064.db2.gz PPOWXJGFZSMRLV-VIFPVBQESA-N 1 1 292.181 3.881 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@H](CF)C1 ZINC001236796494 1131008070 /nfs/dbraw/zinc/00/80/70/1131008070.db2.gz PPOWXJGFZSMRLV-VIFPVBQESA-N 1 1 292.181 3.881 20 10 CHCDMO Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@H](F)CC1 ZINC001237121380 1131055201 /nfs/dbraw/zinc/05/52/01/1131055201.db2.gz LUQZVDLYMNWUKM-VIFPVBQESA-N 1 1 275.726 3.509 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000164383100 1127161706 /nfs/dbraw/zinc/16/17/06/1127161706.db2.gz FCWFAEUQTAHYHO-MNOVXSKESA-N 1 1 253.773 3.524 20 10 CHCDMO Cc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816529099 1131108059 /nfs/dbraw/zinc/10/80/59/1131108059.db2.gz GOLUCOLCVAVGTJ-UHFFFAOYSA-N 1 1 279.742 3.783 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@](C)(F)C2)c1O ZINC001237681811 1131127414 /nfs/dbraw/zinc/12/74/14/1131127414.db2.gz SXMWVBGWTFZOLS-AWEZNQCLSA-N 1 1 271.763 3.678 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237935064 1131153700 /nfs/dbraw/zinc/15/37/00/1131153700.db2.gz PPMQWQPFTKOORI-CQSZACIVSA-N 1 1 289.753 3.899 20 10 CHCDMO C[C@@]1(F)CCC[N@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237935064 1131153703 /nfs/dbraw/zinc/15/37/03/1131153703.db2.gz PPMQWQPFTKOORI-CQSZACIVSA-N 1 1 289.753 3.899 20 10 CHCDMO C[C@@]1(F)CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237935064 1131153711 /nfs/dbraw/zinc/15/37/11/1131153711.db2.gz PPMQWQPFTKOORI-CQSZACIVSA-N 1 1 289.753 3.899 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237936590 1131153971 /nfs/dbraw/zinc/15/39/71/1131153971.db2.gz KPBCSRGMOGNYDQ-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237936590 1131153973 /nfs/dbraw/zinc/15/39/73/1131153973.db2.gz KPBCSRGMOGNYDQ-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237936590 1131153976 /nfs/dbraw/zinc/15/39/76/1131153976.db2.gz KPBCSRGMOGNYDQ-VHSXEESVSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(F)ccc1O ZINC000285773612 1127242321 /nfs/dbraw/zinc/24/23/21/1127242321.db2.gz UFBXYZMTMZTAQH-RKDXNWHRSA-N 1 1 296.292 3.616 20 10 CHCDMO CC[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(F)cc1O ZINC000286109871 1127258555 /nfs/dbraw/zinc/25/85/55/1127258555.db2.gz NPKCQISKASSRGF-ZDUSSCGKSA-N 1 1 294.757 3.821 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@H]21)c1ccc(F)cc1O ZINC000286153104 1127261231 /nfs/dbraw/zinc/26/12/31/1127261231.db2.gz PMZHGUGCGDVRTH-LJIGWXMPSA-N 1 1 293.382 3.530 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000286202295 1127262514 /nfs/dbraw/zinc/26/25/14/1127262514.db2.gz RKKXCYLQEOIEMH-DIOULYMOSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000760908510 1127326155 /nfs/dbraw/zinc/32/61/55/1127326155.db2.gz VZRBDKQVUINIRJ-WPRPVWTQSA-N 1 1 279.277 3.913 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccsc2)c1O ZINC000761183457 1127507257 /nfs/dbraw/zinc/50/72/57/1127507257.db2.gz KMEZMKHWEYWSFM-UHFFFAOYSA-N 1 1 297.807 3.748 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2C2CCC2)c1O ZINC000761195815 1127517950 /nfs/dbraw/zinc/51/79/50/1127517950.db2.gz OYZKPGXFHQCBIG-AWEZNQCLSA-N 1 1 295.810 3.819 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](CC(C)C)C(C)C)c1O ZINC000228629795 1127576216 /nfs/dbraw/zinc/57/62/16/1127576216.db2.gz ONQRJHHPJHYRKG-UHFFFAOYSA-N 1 1 285.815 3.921 20 10 CHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)C(C)(C)C)c1O ZINC000228627022 1127576479 /nfs/dbraw/zinc/57/64/79/1127576479.db2.gz NTNZMYICGNEYAQ-SNVBAGLBSA-N 1 1 285.815 3.921 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(C)C)C2)c1O ZINC000228667828 1127583214 /nfs/dbraw/zinc/58/32/14/1127583214.db2.gz NEYVAVZXSUWMFS-LLVKDONJSA-N 1 1 283.799 3.532 20 10 CHCDMO C[C@H]1CCC[C@@H]([NH2+]Cc2c(O)cccc2F)CC1 ZINC001308947532 1127597930 /nfs/dbraw/zinc/59/79/30/1127597930.db2.gz GDGPWNYCHZXVBX-NWDGAFQWSA-N 1 1 251.345 3.590 20 10 CHCDMO Cc1cccc(CC[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000062748444 1127773759 /nfs/dbraw/zinc/77/37/59/1127773759.db2.gz UNHNIDFZDMPVHJ-CYBMUJFWSA-N 1 1 273.351 3.733 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC000245755530 1129222343 /nfs/dbraw/zinc/22/23/43/1129222343.db2.gz ONDZUCMEOFNYOJ-GDBMZVCRSA-N 1 1 277.433 3.561 20 10 CHCDMO CC[N@H+](Cc1ccc(F)cc1)Cc1c(O)ccc(F)c1F ZINC001233335495 1127951977 /nfs/dbraw/zinc/95/19/77/1127951977.db2.gz XXYDMUTTZHITMD-UHFFFAOYSA-N 1 1 295.304 3.832 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(O)ccc(F)c1F ZINC001233335495 1127951980 /nfs/dbraw/zinc/95/19/80/1127951980.db2.gz XXYDMUTTZHITMD-UHFFFAOYSA-N 1 1 295.304 3.832 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)ccc2O)[C@H]1C ZINC000252151797 1128115616 /nfs/dbraw/zinc/11/56/16/1128115616.db2.gz MPKSUGGPLSTEDZ-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO CC(C)[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)C1CC1 ZINC000324207779 1128160672 /nfs/dbraw/zinc/16/06/72/1128160672.db2.gz CJUROFCSBPOJQB-MEBBXXQBSA-N 1 1 251.345 3.617 20 10 CHCDMO CCCC(CCC)[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001257341405 1128252934 /nfs/dbraw/zinc/25/29/34/1128252934.db2.gz ZUANRQAULJARGZ-UHFFFAOYSA-N 1 1 277.408 3.815 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC2(CCC2)O1)c1c(O)cccc1F ZINC000927010246 1128207325 /nfs/dbraw/zinc/20/73/25/1128207325.db2.gz JKJQCJZRXQHVPG-OLZOCXBDSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000927101896 1128217161 /nfs/dbraw/zinc/21/71/61/1128217161.db2.gz PTAPCRWQLQAHDI-RYUDHWBXSA-N 1 1 295.398 3.776 20 10 CHCDMO C[C@@H](Cc1cccc(F)c1)[N@H+]1CCc2cccc(O)c2C1 ZINC001168497272 1128329897 /nfs/dbraw/zinc/32/98/97/1128329897.db2.gz NGUAWEHJEURNIZ-ZDUSSCGKSA-N 1 1 285.362 3.521 20 10 CHCDMO C[C@H](Cc1cccc(F)c1)[N@H+]1CCc2cccc(O)c2C1 ZINC001168497265 1128329943 /nfs/dbraw/zinc/32/99/43/1128329943.db2.gz NGUAWEHJEURNIZ-CYBMUJFWSA-N 1 1 285.362 3.521 20 10 CHCDMO COc1cc(C[N@H+]2CCC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915790404 1128338692 /nfs/dbraw/zinc/33/86/92/1128338692.db2.gz ICTVYRPCRYBFBL-ZDUSSCGKSA-N 1 1 291.435 3.930 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccccc2C)c1 ZINC000915810551 1128340329 /nfs/dbraw/zinc/34/03/29/1128340329.db2.gz AIZWBZUYGQZRIZ-UHFFFAOYSA-N 1 1 269.388 3.949 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2cccs2)cc1C ZINC000915809686 1128340476 /nfs/dbraw/zinc/34/04/76/1128340476.db2.gz ZXAHJZACOGEVCR-UHFFFAOYSA-N 1 1 261.390 3.703 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cc(C)cc(OC)c2O)cc1 ZINC000915807303 1128340774 /nfs/dbraw/zinc/34/07/74/1128340774.db2.gz DCHCRUKVCAGCIS-UHFFFAOYSA-N 1 1 299.414 3.904 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cc(C)ccc1C ZINC000763378890 1128427047 /nfs/dbraw/zinc/42/70/47/1128427047.db2.gz GEHPFRVWUBSUKC-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO COc1cccc(C[N@@H+](Cc2ccccc2)C(C)C)c1O ZINC000154666487 1128539365 /nfs/dbraw/zinc/53/93/65/1128539365.db2.gz SXDFFACNTJLVJU-UHFFFAOYSA-N 1 1 285.387 3.811 20 10 CHCDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000778995537 1128674862 /nfs/dbraw/zinc/67/48/62/1128674862.db2.gz ZBNLVSWCSSGRQI-SNVBAGLBSA-N 1 1 277.364 3.712 20 10 CHCDMO CC1(C)C[N@@H+](Cc2ccccc2O)[C@H]1c1ccccc1 ZINC000778998904 1128675408 /nfs/dbraw/zinc/67/54/08/1128675408.db2.gz FEKWABHUIMDREI-KRWDZBQOSA-N 1 1 267.372 3.975 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000778995150 1128675825 /nfs/dbraw/zinc/67/58/25/1128675825.db2.gz RAKFCAPRQYIPLX-UHFFFAOYSA-N 1 1 289.325 3.835 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC000779010359 1128677116 /nfs/dbraw/zinc/67/71/16/1128677116.db2.gz ULETZOWZSBQRCV-AWEZNQCLSA-N 1 1 251.345 3.542 20 10 CHCDMO COc1cc(C[N@@H+](C2CC2)C2CCCC2)c(O)cc1C ZINC000159786909 1128728532 /nfs/dbraw/zinc/72/85/32/1128728532.db2.gz MCSPTKJAEVKOES-UHFFFAOYSA-N 1 1 275.392 3.616 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)Oc1ccccc1 ZINC000186040818 1117974691 /nfs/dbraw/zinc/97/46/91/1117974691.db2.gz FTCDHGUPITYGAP-OLZOCXBDSA-N 1 1 289.350 3.649 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1Cl)CC1CCCC1 ZINC000211491369 1118063374 /nfs/dbraw/zinc/06/33/74/1118063374.db2.gz IPGREWFLIDHTBS-UHFFFAOYSA-N 1 1 253.773 3.668 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC2(CC2)C1 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Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000080271794 1129079578 /nfs/dbraw/zinc/07/95/78/1129079578.db2.gz GUZGBVKJYWZCGU-VHSXEESVSA-N 1 1 280.368 3.708 20 10 CHCDMO CCC[N@@H+](Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000775652205 1122866063 /nfs/dbraw/zinc/86/60/63/1122866063.db2.gz IBSZFFHLWMDDBG-UHFFFAOYSA-N 1 1 253.773 3.728 20 10 CHCDMO COc1ccc(O)c(C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000775651657 1122869061 /nfs/dbraw/zinc/86/90/61/1122869061.db2.gz PPQLWUBBRQWZDY-UHFFFAOYSA-N 1 1 275.392 3.698 20 10 CHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@@H](C)CC(C)C)cc1 ZINC001195791179 1122889131 /nfs/dbraw/zinc/88/91/31/1122889131.db2.gz YJIWSMMDIGNSNC-INIZCTEOSA-N 1 1 292.467 3.745 20 10 CHCDMO CCCC[N@@H+](Cc1[nH]nc(C)c1C)Cc1ccccc1O ZINC000894678442 1122890285 /nfs/dbraw/zinc/89/02/85/1122890285.db2.gz BLQJLNCBUKAEAF-UHFFFAOYSA-N 1 1 287.407 3.534 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c1O ZINC000775700264 1122911726 /nfs/dbraw/zinc/91/17/26/1122911726.db2.gz LYDOXGQIHSVYJJ-ZDUSSCGKSA-N 1 1 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CCC[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000184232639 1129178101 /nfs/dbraw/zinc/17/81/01/1129178101.db2.gz WDNHNJAAKHGTPS-CQSZACIVSA-N 1 1 293.407 3.564 20 10 CHCDMO C/C(Cl)=C\C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000528419750 1124658446 /nfs/dbraw/zinc/65/84/46/1124658446.db2.gz PGNBAEAHRIIZQO-NRUITVPNSA-N 1 1 295.810 3.516 20 10 CHCDMO CCC[N@@H+](Cc1nc2ccccc2[nH]1)Cc1ccccc1O ZINC000124041784 1124704737 /nfs/dbraw/zinc/70/47/37/1124704737.db2.gz XFPNHRWWYMVDFC-UHFFFAOYSA-N 1 1 295.386 3.681 20 10 CHCDMO CC(C)[N@@H+](CCC[C@@H]1CCO1)Cc1ccc(N(C)C)cc1 ZINC000876584718 1124964849 /nfs/dbraw/zinc/96/48/49/1124964849.db2.gz NFGAIXHXGAXRNI-GOSISDBHSA-N 1 1 290.451 3.532 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H]2C2CC2)c(O)c(C(C)(C)C)c1 ZINC000826043625 1125158270 /nfs/dbraw/zinc/15/82/70/1125158270.db2.gz MSTUQJHWBQESRC-INIZCTEOSA-N 1 1 289.419 3.683 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)c(C)cc2O)CC1(C)C ZINC000826062421 1125168706 /nfs/dbraw/zinc/16/87/06/1125168706.db2.gz 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1129224049 /nfs/dbraw/zinc/22/40/49/1129224049.db2.gz PZVHFWPBAYRNFV-KSSFIOAISA-N 1 1 297.398 3.984 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1O ZINC000245859431 1129229849 /nfs/dbraw/zinc/22/98/49/1129229849.db2.gz OKPFWYRNUGWYSC-QAPCUYQASA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1cc([NH+](C)C)cc(C)c1NCc1cc(F)ccc1O ZINC000184786132 1129251246 /nfs/dbraw/zinc/25/12/46/1129251246.db2.gz BWKRSZDHIUFZNK-UHFFFAOYSA-N 1 1 288.366 3.826 20 10 CHCDMO Cn1ccc2c1cc[nH+]c2-c1cncc(C(F)(F)F)c1 ZINC001240790399 1129356386 /nfs/dbraw/zinc/35/63/86/1129356386.db2.gz UETPQGKHJMNEOH-UHFFFAOYSA-N 1 1 277.249 3.654 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@@H](SC)C2)c1 ZINC000092064250 1129379531 /nfs/dbraw/zinc/37/95/31/1129379531.db2.gz XZPMMFMWNAFUPM-OAHLLOKOSA-N 1 1 295.448 3.508 20 10 CHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(C)ccc3O)C2)cc1 ZINC000092783530 1129407486 /nfs/dbraw/zinc/40/74/86/1129407486.db2.gz OCBIRTRAIZSUOE-MRXNPFEDSA-N 1 1 297.398 3.699 20 10 CHCDMO 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C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)CO1 ZINC000768536270 1129861082 /nfs/dbraw/zinc/86/10/82/1129861082.db2.gz GXYXNOKJJIAITC-LSDHHAIUSA-N 1 1 297.398 3.668 20 10 CHCDMO CCCOc1cccc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000768873687 1129878393 /nfs/dbraw/zinc/87/83/93/1129878393.db2.gz UKFOWCNKYDWDSG-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000769006778 1129888368 /nfs/dbraw/zinc/88/83/68/1129888368.db2.gz IDSCCMZXIGVNHK-HNNXBMFYSA-N 1 1 275.392 3.555 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C(C2CC2)C2CC2)cc1F ZINC000769192700 1129892334 /nfs/dbraw/zinc/89/23/34/1129892334.db2.gz UKIHNNKTAMXXPX-UHFFFAOYSA-N 1 1 276.399 3.512 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccccc1OC ZINC000769201628 1129896533 /nfs/dbraw/zinc/89/65/33/1129896533.db2.gz YIIBTFZMRAUKAK-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000769246231 1129898154 /nfs/dbraw/zinc/89/81/54/1129898154.db2.gz XYWVVKOUGLBDIZ-KRWDZBQOSA-N 1 1 258.409 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/nfs/dbraw/zinc/42/33/20/1133423320.db2.gz GPULYQAOKYXBOW-UHFFFAOYSA-N 1 1 298.430 3.517 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1ccc(N2CCCC2)cc1 ZINC001204328140 1133437818 /nfs/dbraw/zinc/43/78/18/1133437818.db2.gz CRMXKCPVPRAVFZ-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(Cl)cc1[O-] ZINC001204401658 1133442958 /nfs/dbraw/zinc/44/29/58/1133442958.db2.gz KRUQUKNGYUXCTF-NSHDSACASA-N 1 1 255.789 3.914 20 10 CHCDMO CC[C@H](C)C[N@H+](CC)Cc1ccc(Cl)cc1O ZINC001204401658 1133442960 /nfs/dbraw/zinc/44/29/60/1133442960.db2.gz KRUQUKNGYUXCTF-NSHDSACASA-N 1 1 255.789 3.914 20 10 CHCDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(Cl)cc1O ZINC001204401658 1133442965 /nfs/dbraw/zinc/44/29/65/1133442965.db2.gz KRUQUKNGYUXCTF-NSHDSACASA-N 1 1 255.789 3.914 20 10 CHCDMO CCC[N@@H+](Cc1cc(C)co1)Cc1ccccc1O ZINC001204756824 1133481861 /nfs/dbraw/zinc/48/18/61/1133481861.db2.gz PHAAEPONMIZVMU-UHFFFAOYSA-N 1 1 259.349 3.706 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001204887939 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C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1c(F)cccc1F ZINC000020146050 171031675 /nfs/dbraw/zinc/03/16/75/171031675.db2.gz AIISBDGCBCAKNW-LBPRGKRZSA-N 1 1 290.357 3.882 20 10 CHCDMO CCC[N@@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1O ZINC000172013384 261490565 /nfs/dbraw/zinc/49/05/65/261490565.db2.gz CWOOJSZSKUIAQH-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1O ZINC000186129157 262081154 /nfs/dbraw/zinc/08/11/54/262081154.db2.gz UUHSBRYFKFDLMN-TZMCWYRMSA-N 1 1 293.382 3.674 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC000289886286 263112873 /nfs/dbraw/zinc/11/28/73/263112873.db2.gz SIVNLRBWLHXLAZ-KRWDZBQOSA-N 1 1 299.393 3.624 20 10 CHCDMO CC(C)[N@@H+](Cc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000265988456 519662914 /nfs/dbraw/zinc/66/29/14/519662914.db2.gz FBSYJYHBEJSQFG-UHFFFAOYSA-N 1 1 283.419 3.558 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](CCC(F)(F)F)C2CC2)cc1 ZINC000265877336 522174021 /nfs/dbraw/zinc/17/40/21/522174021.db2.gz BEPIPBWEGQCPFM-UHFFFAOYSA-N 1 1 286.341 3.669 20 10 CHCDMO COCCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000118000217 523139543 /nfs/dbraw/zinc/13/95/43/523139543.db2.gz LAWRYRJGVNJMKQ-UHFFFAOYSA-N 1 1 290.451 3.535 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCCO1 ZINC000281106057 523449732 /nfs/dbraw/zinc/44/97/32/523449732.db2.gz AVDUXTWIUZEHEU-OAHLLOKOSA-N 1 1 285.387 3.546 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2F)c1O ZINC000129727302 525918247 /nfs/dbraw/zinc/91/82/47/525918247.db2.gz UKKXBQMQSSRHHI-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000367721910 526345967 /nfs/dbraw/zinc/34/59/67/526345967.db2.gz ABODDPZPFPCXEE-OAHLLOKOSA-N 1 1 288.778 3.778 20 10 CHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000290343621 526514377 /nfs/dbraw/zinc/51/43/77/526514377.db2.gz FPEAINRNZQGIHU-INIZCTEOSA-N 1 1 299.418 3.686 20 10 CHCDMO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1ccccc1O ZINC000109772072 1125469225 /nfs/dbraw/zinc/46/92/25/1125469225.db2.gz VOUDGHJIVLBXBC-GFCCVEGCSA-N 1 1 259.324 3.724 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000133692080 1125484845 /nfs/dbraw/zinc/48/48/45/1125484845.db2.gz VDACMDCKHBIRGO-INIZCTEOSA-N 1 1 267.372 3.690 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](COC)C(C)C ZINC001167522279 1118987198 /nfs/dbraw/zinc/98/71/98/1118987198.db2.gz XEZFVJMAGHEJDY-MRXNPFEDSA-N 1 1 279.424 3.523 20 10 CHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000091024533 1120056250 /nfs/dbraw/zinc/05/62/50/1120056250.db2.gz GTEAFTCTSBRZEN-AWEZNQCLSA-N 1 1 267.438 3.582 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)C[C@@H]2C)c(Cl)c1 ZINC001179898776 1121918799 /nfs/dbraw/zinc/91/87/99/1121918799.db2.gz UIQUZOGPDXCUSL-QWRGUYRKSA-N 1 1 253.773 3.584 20 10 CHCDMO CC(C)C[N@@H+](Cc1c(O)cccc1Br)C1CC1 ZINC001179985120 1121934956 /nfs/dbraw/zinc/93/49/56/1121934956.db2.gz XNVLDXOKBNUFEN-UHFFFAOYSA-N 1 1 298.224 3.775 20 10 CHCDMO CO[C@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858584938 1123665803 /nfs/dbraw/zinc/66/58/03/1123665803.db2.gz YKIGWETXJPITFR-IWSPIJDZSA-N 1 1 290.190 3.527 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCSC2(CCC2)CC1 ZINC000877588381 1125049513 /nfs/dbraw/zinc/04/95/13/1125049513.db2.gz ZNAXEPWJEIYEPC-UHFFFAOYSA-N 1 1 277.433 3.562 20 10 CHCDMO CC[C@H]1CCC[N@H+](Cc2cccc(Br)c2O)C1 ZINC000132247663 1125416742 /nfs/dbraw/zinc/41/67/42/1125416742.db2.gz DLBOAIRGEZSWHV-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2cccc(Br)c2O)C1 ZINC000132247663 1125416744 /nfs/dbraw/zinc/41/67/44/1125416744.db2.gz DLBOAIRGEZSWHV-NSHDSACASA-N 1 1 298.224 3.777 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2C)cc1 ZINC001171381785 1131942869 /nfs/dbraw/zinc/94/28/69/1131942869.db2.gz PQQQLFSXRHGGOB-HUUCEWRRSA-N 1 1 260.425 3.763 20 10 CHCDMO C[N@@H+](Cc1cc(F)c(F)cc1O)CC1CCCCC1 ZINC001142526986 1132403330 /nfs/dbraw/zinc/40/33/30/1132403330.db2.gz FHVNAXBQBVUMDB-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO C[N@H+](Cc1cc(F)c(F)cc1O)CC1CCCCC1 ZINC001142526986 1132403333 /nfs/dbraw/zinc/40/33/33/1132403333.db2.gz FHVNAXBQBVUMDB-UHFFFAOYSA-N 1 1 269.335 3.683 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CCOCC1 ZINC000841748662 1125577482 /nfs/dbraw/zinc/57/74/82/1125577482.db2.gz BBINLPMTLKMOJV-XHDPSFHLSA-N 1 1 297.826 3.901 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)cc1 ZINC000215913293 1125581871 /nfs/dbraw/zinc/58/18/71/1125581871.db2.gz VTGYBUOEEOUSJB-UHFFFAOYSA-N 1 1 290.357 3.663 20 10 CHCDMO C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)cc1[O-] ZINC000841757994 1125597772 /nfs/dbraw/zinc/59/77/72/1125597772.db2.gz QXFGYOUZLWNKKE-LBPRGKRZSA-N 1 1 296.842 3.571 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC000093480704 1125611655 /nfs/dbraw/zinc/61/16/55/1125611655.db2.gz SZMRSYPRGFZBKG-UKRRQHHQSA-N 1 1 275.392 3.555 20 10 CHCDMO CO[C@H](C[NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886508833 1125681880 /nfs/dbraw/zinc/68/18/80/1125681880.db2.gz OEWPTTQFQHSQTN-MLGOLLRUSA-N 1 1 289.350 3.570 20 10 CHCDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886519378 1125682725 /nfs/dbraw/zinc/68/27/25/1125682725.db2.gz UHBKCAAUWDXFQB-NWDGAFQWSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@@H]([NH2+]CC1(CCO)CCCCC1)c1c(O)cccc1F ZINC000886536084 1125685753 /nfs/dbraw/zinc/68/57/53/1125685753.db2.gz AFFIVOWKSVTSAX-CYBMUJFWSA-N 1 1 295.398 3.515 20 10 CHCDMO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1c(O)cccc1F ZINC000886557258 1125689906 /nfs/dbraw/zinc/68/99/06/1125689906.db2.gz XAJDPAQIHMDLAY-PIGZYNQJSA-N 1 1 286.350 3.728 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1c(O)cccc1F ZINC000886552234 1125690701 /nfs/dbraw/zinc/69/07/01/1125690701.db2.gz XARXQEQWAHLCII-VHSXEESVSA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1c(O)cccc1F ZINC000886558275 1125690781 /nfs/dbraw/zinc/69/07/81/1125690781.db2.gz FTNWUGPIOLKXCX-VIFPVBQESA-N 1 1 273.298 3.760 20 10 CHCDMO C[C@@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886648125 1125702598 /nfs/dbraw/zinc/70/25/98/1125702598.db2.gz MEKYAXZOPHSDTD-DOMZBBRYSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1ccc(F)cc1O ZINC000886731124 1125713990 /nfs/dbraw/zinc/71/39/90/1125713990.db2.gz VSJFDMYTVHZVPX-OCCSQVGLSA-N 1 1 293.382 3.531 20 10 CHCDMO COc1cccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1O ZINC000092483925 1125758671 /nfs/dbraw/zinc/75/86/71/1125758671.db2.gz PAHAUMCHAQDNEF-LBPRGKRZSA-N 1 1 287.359 3.719 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)c2cccc(O)c2)c1 ZINC000093316058 1125766688 /nfs/dbraw/zinc/76/66/88/1125766688.db2.gz PSZHVAVHPPMUKA-ZDUSSCGKSA-N 1 1 271.360 3.599 20 10 CHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)CC1 ZINC000093316595 1125766960 /nfs/dbraw/zinc/76/69/60/1125766960.db2.gz BJUZTCZJXAPXSP-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)c2cccc(O)c2)c1 ZINC000093316060 1125767350 /nfs/dbraw/zinc/76/73/50/1125767350.db2.gz PSZHVAVHPPMUKA-CYBMUJFWSA-N 1 1 271.360 3.599 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@H]1C ZINC000769487682 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COc1ccc([C@H](C)[N@@H+](C)Cc2cccc(F)c2O)cc1 ZINC000272239081 1122196030 /nfs/dbraw/zinc/19/60/30/1122196030.db2.gz GENWMSYOCRPPKR-LBPRGKRZSA-N 1 1 289.350 3.733 20 10 CHCDMO CCc1cccc(C[N@H+]2CCC[C@H](C3CCC3)C2)c1O ZINC001182959508 1122197639 /nfs/dbraw/zinc/19/76/39/1122197639.db2.gz JBEVUXDDMPLMHB-INIZCTEOSA-N 1 1 273.420 3.967 20 10 CHCDMO C[C@H](C[N@@H+](C)Cc1c(O)cccc1Cl)c1nccs1 ZINC000273150055 1122221106 /nfs/dbraw/zinc/22/11/06/1122221106.db2.gz HKVCDFXDLKYUTO-SNVBAGLBSA-N 1 1 296.823 3.738 20 10 CHCDMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccc(F)cc1O ZINC000796856721 1122301825 /nfs/dbraw/zinc/30/18/25/1122301825.db2.gz SUVLUDOMSLDBMI-ZDUSSCGKSA-N 1 1 260.312 3.798 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001237487420 1129055766 /nfs/dbraw/zinc/05/57/66/1129055766.db2.gz INNYIYDMGVABFD-MRXNPFEDSA-N 1 1 253.345 3.648 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]2C)c1O ZINC001193392842 1122688344 /nfs/dbraw/zinc/68/83/44/1122688344.db2.gz NHDIZUGAGMWMFA-LKFCYVNXSA-N 1 1 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ZINC000850540436 1123287992 /nfs/dbraw/zinc/28/79/92/1123287992.db2.gz MTKJVTAEJNIDLQ-UONOGXRCSA-N 1 1 251.345 3.761 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(F)cc1O ZINC000850551825 1123289901 /nfs/dbraw/zinc/28/99/01/1123289901.db2.gz KAZYLZHCDKPRDC-YPMHNXCESA-N 1 1 287.325 3.863 20 10 CHCDMO C[N@H+](Cc1c(O)ccc2ccccc21)C[C@H]1CCCCO1 ZINC000108643341 1123364559 /nfs/dbraw/zinc/36/45/59/1123364559.db2.gz DBIJLVDJCJJHEE-OAHLLOKOSA-N 1 1 285.387 3.546 20 10 CHCDMO CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000854230377 1123478690 /nfs/dbraw/zinc/47/86/90/1123478690.db2.gz OAJOXTNDMQBJMX-CXAGYDPISA-N 1 1 286.419 3.569 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1CCO[C@H](CC)C1 ZINC000780758815 1123543823 /nfs/dbraw/zinc/54/38/23/1123543823.db2.gz WTEZANFHGIOTLU-DOTOQJQBSA-N 1 1 291.435 3.809 20 10 CHCDMO CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(F)cc1O ZINC000857080437 1123584854 /nfs/dbraw/zinc/58/48/54/1123584854.db2.gz GLVCHKFYXDEPJE-SKDRFNHKSA-N 1 1 273.298 3.617 20 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VLJHOOUUJVUHIJ-ZDUSSCGKSA-N 1 1 283.371 3.520 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccsc2)cc1F ZINC000120464319 1123965842 /nfs/dbraw/zinc/96/58/42/1123965842.db2.gz VLVQTXXOMJIAAB-UHFFFAOYSA-N 1 1 278.396 3.585 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)C1(OC)CCC1)c1ccc(F)cc1O ZINC000840884349 1123996083 /nfs/dbraw/zinc/99/60/83/1123996083.db2.gz KWDRIGCBTUJNKM-BXUZGUMPSA-N 1 1 281.371 3.530 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000794880384 1124026319 /nfs/dbraw/zinc/02/63/19/1124026319.db2.gz LCCNZWTZSNGOLP-UHFFFAOYSA-N 1 1 289.419 3.937 20 10 CHCDMO Nc1ccc(C[N@@H+]2CCc3sc(Cl)cc3C2)cc1 ZINC001120269042 1131273696 /nfs/dbraw/zinc/27/36/96/1131273696.db2.gz LZDXZBPGBMAEGI-UHFFFAOYSA-N 1 1 278.808 3.542 20 10 CHCDMO Nc1ccc(C[N@H+]2CCc3sc(Cl)cc3C2)cc1 ZINC001120269042 1131273700 /nfs/dbraw/zinc/27/37/00/1131273700.db2.gz LZDXZBPGBMAEGI-UHFFFAOYSA-N 1 1 278.808 3.542 20 10 CHCDMO Cc1cccc(O)c1C[N@H+](CCc1nccs1)C(C)C ZINC000876776256 1124977122 /nfs/dbraw/zinc/97/71/22/1124977122.db2.gz AUBUBVFQFLCGBC-UHFFFAOYSA-N 1 1 290.432 3.610 20 10 CHCDMO Cc1cccc(O)c1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000876806574 1124980201 /nfs/dbraw/zinc/98/02/01/1124980201.db2.gz QSOOYYPBUMUVGT-UHFFFAOYSA-N 1 1 287.325 3.865 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(C3CC3)no2)cc1 ZINC000876945243 1124991582 /nfs/dbraw/zinc/99/15/82/1124991582.db2.gz WGSDWLRIEMCHRS-UHFFFAOYSA-N 1 1 299.418 3.688 20 10 CHCDMO Cc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)c(O)c1 ZINC000877343211 1125023911 /nfs/dbraw/zinc/02/39/11/1125023911.db2.gz VXDAANLUIBIBSB-WMLDXEAASA-N 1 1 282.387 3.679 20 10 CHCDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc(C)cc1O ZINC000877521936 1125038206 /nfs/dbraw/zinc/03/82/06/1125038206.db2.gz GMQSCCGSWQBKSS-UHFFFAOYSA-N 1 1 284.403 3.550 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCCCC[C@@H]2C)c1O ZINC000228666467 1125251237 /nfs/dbraw/zinc/25/12/37/1125251237.db2.gz ILXDMJHDZSHKHQ-NSHDSACASA-N 1 1 283.799 3.819 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(Cl)n1 ZINC000883301869 1125391958 /nfs/dbraw/zinc/39/19/58/1125391958.db2.gz KMBZRIYMPHHMHK-JTQLQIEISA-N 1 1 294.757 3.739 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)c1ccc(F)cc1O)[C@H]1CCCOC1 ZINC000883352974 1125400106 /nfs/dbraw/zinc/40/01/06/1125400106.db2.gz LVDSUBYHAJTGGN-MAZHCROVSA-N 1 1 295.398 3.777 20 10 CHCDMO CC[C@H]([NH2+]C1CCC2(COC2)CC1)c1ccc(F)cc1O ZINC000883383409 1125407342 /nfs/dbraw/zinc/40/73/42/1125407342.db2.gz YBMLUUACBNDHRH-HNNXBMFYSA-N 1 1 293.382 3.531 20 10 CHCDMO Cc1cc(O)c(CNc2[nH+]c3cc(F)ccc3n2C)cc1C ZINC000184256170 1129180056 /nfs/dbraw/zinc/18/00/56/1129180056.db2.gz CCVDXVOVCNGUOW-UHFFFAOYSA-N 1 1 299.349 3.647 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)c1 ZINC000245700138 1129218528 /nfs/dbraw/zinc/21/85/28/1129218528.db2.gz CZCYRQQWZGTWTL-BEFAXECRSA-N 1 1 297.398 3.663 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC000245755536 1129222851 /nfs/dbraw/zinc/22/28/51/1129222851.db2.gz ONDZUCMEOFNYOJ-ZBFHGGJFSA-N 1 1 277.433 3.561 20 10 CHCDMO Cc1csc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000379133698 1129286069 /nfs/dbraw/zinc/28/60/69/1129286069.db2.gz QBFIAQYTHVMVLT-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056766 1129389888 /nfs/dbraw/zinc/38/98/88/1129389888.db2.gz QCDCZOYKQCPWRK-GXTWGEPZSA-N 1 1 291.391 3.522 20 10 CHCDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000742159866 1129468343 /nfs/dbraw/zinc/46/83/43/1129468343.db2.gz TYUQQUQCXMJCJH-AWEZNQCLSA-N 1 1 293.410 3.828 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1C ZINC000743407381 1129522747 /nfs/dbraw/zinc/52/27/47/1129522747.db2.gz WWCASOZYBRCWQM-GOSISDBHSA-N 1 1 297.398 3.583 20 10 CHCDMO CCC[N@@H+](Cc1cccc(OC)c1)Cc1ccccc1O ZINC000743870598 1129542323 /nfs/dbraw/zinc/54/23/23/1129542323.db2.gz YQTZYTSWPDLHCJ-UHFFFAOYSA-N 1 1 285.387 3.813 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c1O ZINC000796534511 1129776772 /nfs/dbraw/zinc/77/67/72/1129776772.db2.gz 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RMPWJPBKXKFKDI-OAHLLOKOSA-N 1 1 281.399 3.956 20 10 CHCDMO C[N@@H+](CCc1ccc(F)cc1)Cc1c(O)cccc1Cl ZINC001140341393 1131703767 /nfs/dbraw/zinc/70/37/67/1131703767.db2.gz LVVOHDKAKBNAAM-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO CC(C)[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)CCO1 ZINC000834884833 1131717982 /nfs/dbraw/zinc/71/79/82/1131717982.db2.gz DAKWALGPNPEMOD-OGHNNQOOSA-N 1 1 295.398 3.633 20 10 CHCDMO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)co1 ZINC000834896416 1131721310 /nfs/dbraw/zinc/72/13/10/1131721310.db2.gz AVXZSIBCRKJCOD-SNVBAGLBSA-N 1 1 294.782 3.755 20 10 CHCDMO CCc1nc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)co1 ZINC000834899014 1131723787 /nfs/dbraw/zinc/72/37/87/1131723787.db2.gz DTSKRWSISKJPPV-MRXNPFEDSA-N 1 1 287.407 3.544 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)C/C=C/c2ccccc2)c1 ZINC001140622979 1131830641 /nfs/dbraw/zinc/83/06/41/1131830641.db2.gz JUFOFNGOFIDXFV-RMKNXTFCSA-N 1 1 267.372 3.846 20 10 CHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC001140677401 1131858080 /nfs/dbraw/zinc/85/80/80/1131858080.db2.gz MEGXDTOSYNHXJJ-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO CC[N@@H+](Cc1ccc(O)c(C)c1O)C1CCCCC1 ZINC001140741789 1131905509 /nfs/dbraw/zinc/90/55/09/1131905509.db2.gz CDPCXLPBWIBYLQ-UHFFFAOYSA-N 1 1 263.381 3.561 20 10 CHCDMO Cc1c(O)ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)c1O ZINC001140746189 1131906065 /nfs/dbraw/zinc/90/60/65/1131906065.db2.gz VRGWTBBJFFSGRT-UHFFFAOYSA-N 1 1 291.778 3.692 20 10 CHCDMO CCC[N@@H+](CCSC(C)C)Cc1ccccc1O ZINC000801518460 1131934615 /nfs/dbraw/zinc/93/46/15/1131934615.db2.gz IYSWAZBJXPTNAA-UHFFFAOYSA-N 1 1 267.438 3.746 20 10 CHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(N(CC)CC)cc1O ZINC001140855440 1131949449 /nfs/dbraw/zinc/94/94/49/1131949449.db2.gz YZUPGOUQBZFLTJ-OAHLLOKOSA-N 1 1 276.424 3.613 20 10 CHCDMO Nc1cc(Cl)cc(NCc2cc3ccccc3cc2O)[nH+]1 ZINC001171399113 1131965621 /nfs/dbraw/zinc/96/56/21/1131965621.db2.gz CSNGQAKSNFWISI-UHFFFAOYSA-N 1 1 299.761 3.788 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(O)c1 ZINC001140949652 1131969469 /nfs/dbraw/zinc/96/94/69/1131969469.db2.gz HCFCPCLDCGSFGS-QGZVFWFLSA-N 1 1 281.399 3.765 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140949732 1131969922 /nfs/dbraw/zinc/96/99/22/1131969922.db2.gz JZPVKYSIJNQXJJ-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1ccc(C[N@@H+](C)CCCc2ccccc2)c(O)c1 ZINC001140949735 1131970496 /nfs/dbraw/zinc/97/04/96/1131970496.db2.gz KFJCSRBIICSBTD-UHFFFAOYSA-N 1 1 269.388 3.765 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC001140951119 1131971329 /nfs/dbraw/zinc/97/13/29/1131971329.db2.gz ZOSNWXPCVLPRJK-GDBMZVCRSA-N 1 1 259.393 3.855 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077990 1132007537 /nfs/dbraw/zinc/00/75/37/1132007537.db2.gz HZJMZZOMHNDOCI-UHFFFAOYSA-N 1 1 284.447 3.617 20 10 CHCDMO CC[C@H](CSC)[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000773257491 1132012515 /nfs/dbraw/zinc/01/25/15/1132012515.db2.gz YERDLTGCFSGWAF-CYBMUJFWSA-N 1 1 290.432 3.514 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccc(C)cc1F ZINC001141195117 1132039666 /nfs/dbraw/zinc/03/96/66/1132039666.db2.gz AXOZAOMPGYEHGE-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO C[C@@H](c1ccccc1)[N@@H+](CCCCO)Cc1ccccc1O ZINC000839532688 1132221902 /nfs/dbraw/zinc/22/19/02/1132221902.db2.gz ZKHFMUSLTKJDRE-INIZCTEOSA-N 1 1 299.414 3.728 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000840142300 1132247738 /nfs/dbraw/zinc/24/77/38/1132247738.db2.gz FRQPCQNQDVRDFQ-KRWDZBQOSA-N 1 1 291.460 3.728 20 10 CHCDMO CC[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(F)cc1O ZINC000840820094 1132290934 /nfs/dbraw/zinc/29/09/34/1132290934.db2.gz JVFUHXDKFBVTTN-AQNFWKISSA-N 1 1 263.356 3.761 20 10 CHCDMO CC[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(F)cc1O ZINC000840875733 1132298891 /nfs/dbraw/zinc/29/88/91/1132298891.db2.gz GLDXFMXFSPUSGF-HNNXBMFYSA-N 1 1 295.398 3.777 20 10 CHCDMO Cc1nc(C[NH2+]Cc2c(O)cc(C)cc2Cl)sc1C ZINC000840900252 1132306742 /nfs/dbraw/zinc/30/67/42/1132306742.db2.gz BLAKYGDLXAGMQF-UHFFFAOYSA-N 1 1 296.823 3.717 20 10 CHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2C)on1 ZINC000840910773 1132308396 /nfs/dbraw/zinc/30/83/96/1132308396.db2.gz LWAACHKSAIOAMS-QGZVFWFLSA-N 1 1 299.418 3.695 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000840945391 1132311224 /nfs/dbraw/zinc/31/12/24/1132311224.db2.gz MEMMJWFZVMQBIF-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO COC[C@@H]1CCC[N@@H+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840952478 1132311605 /nfs/dbraw/zinc/31/16/05/1132311605.db2.gz ATSVJLCZYVIWPL-CYBMUJFWSA-N 1 1 297.826 3.603 20 10 CHCDMO C[C@H](CCc1ccccc1)C[NH2+]c1ccc(N)cc1 ZINC000841039920 1132322639 /nfs/dbraw/zinc/32/26/39/1132322639.db2.gz FCSJFADRHKCHEW-CQSZACIVSA-N 1 1 254.377 3.950 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c(O)c1 ZINC001231841882 1132375199 /nfs/dbraw/zinc/37/51/99/1132375199.db2.gz FOBLZDBYCMREFU-AWEZNQCLSA-N 1 1 287.325 3.578 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c(O)c1 ZINC001231843813 1132375948 /nfs/dbraw/zinc/37/59/48/1132375948.db2.gz BIXMIWNXXDQTOW-QGZVFWFLSA-N 1 1 282.387 3.741 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001231846480 1132378766 /nfs/dbraw/zinc/37/87/66/1132378766.db2.gz MRDJIWPXTDEHAK-UHFFFAOYSA-N 1 1 281.399 3.957 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001231853970 1132378801 /nfs/dbraw/zinc/37/88/01/1132378801.db2.gz VOAPIPIECUUKJT-PBHICJAKSA-N 1 1 288.435 3.526 20 10 CHCDMO COc1cc(N(C)C)ccc1C[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC001231848673 1132379504 /nfs/dbraw/zinc/37/95/04/1132379504.db2.gz JTJIZPVBNISXPB-OKILXGFUSA-N 1 1 276.424 3.524 20 10 CHCDMO C[C@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc(Cl)cc1O ZINC000841745525 1132388203 /nfs/dbraw/zinc/38/82/03/1132388203.db2.gz ZNNBZZHTYDNTLB-LBPRGKRZSA-N 1 1 296.842 3.571 20 10 CHCDMO CCC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCOCC1 ZINC000841748553 1132389529 /nfs/dbraw/zinc/38/95/29/1132389529.db2.gz AOPYWZCGKYBKCJ-LBPRGKRZSA-N 1 1 297.826 3.903 20 10 CHCDMO CCCO[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231881974 1132390281 /nfs/dbraw/zinc/39/02/81/1132390281.db2.gz LVSYKISBGCNGCG-INIZCTEOSA-N 1 1 285.387 3.546 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(Cl)cc1O ZINC000841747508 1132390380 /nfs/dbraw/zinc/39/03/80/1132390380.db2.gz CDITVPQKBVULTK-WCQYABFASA-N 1 1 295.810 3.798 20 10 CHCDMO Oc1c(C[N@H+]2CCC3(CC3)C2)ccc2ccccc21 ZINC001231879605 1132390596 /nfs/dbraw/zinc/39/05/96/1132390596.db2.gz KENQXMJKFSXDDD-UHFFFAOYSA-N 1 1 253.345 3.531 20 10 CHCDMO CC1(C)CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC001231879956 1132392341 /nfs/dbraw/zinc/39/23/41/1132392341.db2.gz YFSDVUZHGFKAPD-UHFFFAOYSA-N 1 1 255.361 3.920 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(Cl)cc1O ZINC000841756860 1132395324 /nfs/dbraw/zinc/39/53/24/1132395324.db2.gz KXYUJOXAKSEBLU-NEPJUHHUSA-N 1 1 283.799 3.513 20 10 CHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccncc1 ZINC000841760895 1132396585 /nfs/dbraw/zinc/39/65/85/1132396585.db2.gz VSESTFJRCPURRM-NEPJUHHUSA-N 1 1 290.794 3.895 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2cc(F)c(F)cc2O)cc1 ZINC001142521034 1132402837 /nfs/dbraw/zinc/40/28/37/1132402837.db2.gz VCTIXVAUAFRXSB-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(F)c(F)cc2O)cc1 ZINC001142521034 1132402841 /nfs/dbraw/zinc/40/28/41/1132402841.db2.gz VCTIXVAUAFRXSB-UHFFFAOYSA-N 1 1 277.314 3.611 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C ZINC001142508944 1132403055 /nfs/dbraw/zinc/40/30/55/1132403055.db2.gz QMRLKQCXAANDQX-WDEREUQCSA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C ZINC001142508944 1132403059 /nfs/dbraw/zinc/40/30/59/1132403059.db2.gz QMRLKQCXAANDQX-WDEREUQCSA-N 1 1 269.335 3.538 20 10 CHCDMO CCCC[N@@H+](CCC)Cc1cc(Cl)c(O)cc1O ZINC001232261669 1132444800 /nfs/dbraw/zinc/44/48/00/1132444800.db2.gz LWABYNAPMWYBNQ-UHFFFAOYSA-N 1 1 271.788 3.763 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(O)cc1O ZINC001232258542 1132445600 /nfs/dbraw/zinc/44/56/00/1132445600.db2.gz KBBFKYSKWORSQV-UHFFFAOYSA-N 1 1 291.778 3.773 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CC2(CCC2)O1 ZINC000842642331 1132447812 /nfs/dbraw/zinc/44/78/12/1132447812.db2.gz JFNNHBSZIIRCMT-AWEZNQCLSA-N 1 1 297.398 3.689 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1ccc(Cl)cc1O ZINC000842930027 1132478131 /nfs/dbraw/zinc/47/81/31/1132478131.db2.gz RONWXWMBIGYYSU-YGOYTEALSA-N 1 1 271.813 3.590 20 10 CHCDMO CC[N@@H+](Cc1cc2ccoc2cn1)Cc1ccccc1O ZINC001232554466 1132487964 /nfs/dbraw/zinc/48/79/64/1132487964.db2.gz VVROEBFGHCRRKO-UHFFFAOYSA-N 1 1 282.343 3.556 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)[C@H](C)C1 ZINC001143117058 1132504390 /nfs/dbraw/zinc/50/43/90/1132504390.db2.gz RAPMIYMVUNJDBL-UKRRQHHQSA-N 1 1 291.435 3.689 20 10 CHCDMO COc1cccc(C[N@H+]2CC3(CC=CC3)[C@H]2C(C)C)c1O ZINC000843431903 1132534518 /nfs/dbraw/zinc/53/45/18/1132534518.db2.gz NDCQSEZXTIYBFD-QGZVFWFLSA-N 1 1 287.403 3.577 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CC2(CCC2)O1 ZINC000843432791 1132535175 /nfs/dbraw/zinc/53/51/75/1132535175.db2.gz PZBDPVJAAMOWKF-AWEZNQCLSA-N 1 1 297.398 3.689 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233283482 1132595583 /nfs/dbraw/zinc/59/55/83/1132595583.db2.gz ILPZNIVJYQQJSN-CYBMUJFWSA-N 1 1 261.409 3.922 20 10 CHCDMO CC(C)[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233287113 1132596563 /nfs/dbraw/zinc/59/65/63/1132596563.db2.gz WXZZJOQZJGVKDT-QGZVFWFLSA-N 1 1 291.435 3.547 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001233335366 1132603428 /nfs/dbraw/zinc/60/34/28/1132603428.db2.gz RWALIQPJWUGOOP-SMDDNHRTSA-N 1 1 281.346 3.825 20 10 CHCDMO Oc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001233335366 1132603431 /nfs/dbraw/zinc/60/34/31/1132603431.db2.gz RWALIQPJWUGOOP-SMDDNHRTSA-N 1 1 281.346 3.825 20 10 CHCDMO Cc1ccc(C[N@@H+](C)Cc2c(O)ccc(F)c2F)cc1C ZINC001233336085 1132604601 /nfs/dbraw/zinc/60/46/01/1132604601.db2.gz YDNDLVXIXDIHOH-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2c(O)ccc(F)c2F)cc1C ZINC001233336085 1132604606 /nfs/dbraw/zinc/60/46/06/1132604606.db2.gz YDNDLVXIXDIHOH-UHFFFAOYSA-N 1 1 291.341 3.919 20 10 CHCDMO Oc1c(C[N@@H+]2CCC[C@H](CF)C2)cccc1C(F)(F)F ZINC001233418322 1132618628 /nfs/dbraw/zinc/61/86/28/1132618628.db2.gz BMROIXANRGXZGU-SNVBAGLBSA-N 1 1 291.288 3.593 20 10 CHCDMO Oc1c(C[N@H+]2CCC[C@H](CF)C2)cccc1C(F)(F)F ZINC001233418322 1132618632 /nfs/dbraw/zinc/61/86/32/1132618632.db2.gz BMROIXANRGXZGU-SNVBAGLBSA-N 1 1 291.288 3.593 20 10 CHCDMO Oc1c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)cccc1C(F)(F)F ZINC001233415599 1132619418 /nfs/dbraw/zinc/61/94/18/1132619418.db2.gz BXMAVWDGUKMSIX-PHIMTYICSA-N 1 1 285.309 3.643 20 10 CHCDMO Oc1c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cccc1C(F)(F)F ZINC001233415599 1132619420 /nfs/dbraw/zinc/61/94/20/1132619420.db2.gz BXMAVWDGUKMSIX-PHIMTYICSA-N 1 1 285.309 3.643 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233736528 1132672904 /nfs/dbraw/zinc/67/29/04/1132672904.db2.gz MFHJILISNMJJRC-SECBINFHSA-N 1 1 277.286 3.521 20 10 CHCDMO COc1cccc(C[N@@H+](C)C/C=C/c2ccccc2)c1O ZINC001203596803 1133344309 /nfs/dbraw/zinc/34/43/09/1133344309.db2.gz NBCMVOIRSNODCA-JXMROGBWSA-N 1 1 283.371 3.546 20 10 CHCDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879958 1133378031 /nfs/dbraw/zinc/37/80/31/1133378031.db2.gz KWGJXACMQVVZFX-LLVKDONJSA-N 1 1 291.778 3.944 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC(C)(C)C2)cc1 ZINC001203938816 1133385795 /nfs/dbraw/zinc/38/57/95/1133385795.db2.gz FWUZTTHOCJAPBI-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cn1 ZINC001203937872 1133385947 /nfs/dbraw/zinc/38/59/47/1133385947.db2.gz WRTMEIIUOIRNAO-IBGZPJMESA-N 1 1 295.430 3.793 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@](C)(CF)C2)cc1 ZINC001203940626 1133386083 /nfs/dbraw/zinc/38/60/83/1133386083.db2.gz RTGDFWQCMWOKEU-KRWDZBQOSA-N 1 1 278.415 3.714 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC3(CC3)C2)cc1 ZINC001203940049 1133386221 /nfs/dbraw/zinc/38/62/21/1133386221.db2.gz HXKOVTSGKGDLGR-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC001203939013 1133386235 /nfs/dbraw/zinc/38/62/35/1133386235.db2.gz ISMXDCMAFFIJLM-UHFFFAOYSA-N 1 1 260.425 3.907 20 10 CHCDMO Cc1cccc2c1CC[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203929837 1133386252 /nfs/dbraw/zinc/38/62/52/1133386252.db2.gz HHPBKAPTENPHAU-UHFFFAOYSA-N 1 1 280.415 3.619 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCCC3(CCCC3)C2)cc1 ZINC001203930801 1133386593 /nfs/dbraw/zinc/38/65/93/1133386593.db2.gz IEBWPVZCKGKZJQ-UHFFFAOYSA-N 1 1 272.436 3.909 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H](F)C2)cc1 ZINC001203936275 1133386817 /nfs/dbraw/zinc/38/68/17/1133386817.db2.gz LJECGTOZEBJCRJ-MRXNPFEDSA-N 1 1 278.415 3.857 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2C2CCCCC2)c(O)c1 ZINC001204281500 1133427574 /nfs/dbraw/zinc/42/75/74/1133427574.db2.gz SEGTYJJOWQWMLB-INIZCTEOSA-N 1 1 275.392 3.643 20 10 CHCDMO Fc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204322205 1133436475 /nfs/dbraw/zinc/43/64/75/1133436475.db2.gz PJAXBVCZGFBQPF-UHFFFAOYSA-N 1 1 296.389 3.942 20 10 CHCDMO Fc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204322205 1133436478 /nfs/dbraw/zinc/43/64/78/1133436478.db2.gz PJAXBVCZGFBQPF-UHFFFAOYSA-N 1 1 296.389 3.942 20 10 CHCDMO FC1(F)CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324124 1133437200 /nfs/dbraw/zinc/43/72/00/1133437200.db2.gz KSVKUHAEVOOYBA-UHFFFAOYSA-N 1 1 294.389 3.908 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]1CC1(C)C ZINC001204320869 1133437285 /nfs/dbraw/zinc/43/72/85/1133437285.db2.gz BSPLWEWYRRIVIV-MRXNPFEDSA-N 1 1 272.436 3.765 20 10 CHCDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1O ZINC001204348031 1133437926 /nfs/dbraw/zinc/43/79/26/1133437926.db2.gz NPRZNCRGFNSRKY-CYBMUJFWSA-N 1 1 267.438 3.664 20 10 CHCDMO CC1(C)CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001204533139 1133459750 /nfs/dbraw/zinc/45/97/50/1133459750.db2.gz BWWGQVKNARLLQW-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cc1Cl ZINC001204983921 1133512505 /nfs/dbraw/zinc/51/25/05/1133512505.db2.gz DKQIPPIXDZEIOS-ZANVPECISA-N 1 1 271.763 3.534 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cc1Cl ZINC001204983921 1133512511 /nfs/dbraw/zinc/51/25/11/1133512511.db2.gz DKQIPPIXDZEIOS-ZANVPECISA-N 1 1 271.763 3.534 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001205082297 1133525648 /nfs/dbraw/zinc/52/56/48/1133525648.db2.gz NPJZAVPJZRIZCY-RYUDHWBXSA-N 1 1 281.346 3.683 20 10 CHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001205082297 1133525652 /nfs/dbraw/zinc/52/56/52/1133525652.db2.gz NPJZAVPJZRIZCY-RYUDHWBXSA-N 1 1 281.346 3.683 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2c(C)cc(OC)cc2O)cc1 ZINC001205148231 1133537267 /nfs/dbraw/zinc/53/72/67/1133537267.db2.gz DLXSBEDLNSPWJM-UHFFFAOYSA-N 1 1 299.414 3.904 20 10 CHCDMO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2O)C[C@H]1C ZINC001205320634 1133560540 /nfs/dbraw/zinc/56/05/40/1133560540.db2.gz LPXRYPJTQWSZQQ-GYSYKLTISA-N 1 1 267.800 3.960 20 10 CHCDMO Oc1cc(Cl)ccc1C[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC001206385891 1133697435 /nfs/dbraw/zinc/69/74/35/1133697435.db2.gz ZRAGUUZZBDCXPQ-JSGCOSHPSA-N 1 1 265.784 3.571 20 10 CHCDMO C[C@@]1(CC[NH2+]Cc2ccc(Cl)cc2O)C[C@]1(F)Cl ZINC001206516831 1133712863 /nfs/dbraw/zinc/71/28/63/1133712863.db2.gz GAOFKKAJXAZPOZ-CHWSQXEVSA-N 1 1 292.181 3.840 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCO[C@@](C)(C3CC3)C2)c1 ZINC001206644902 1133731025 /nfs/dbraw/zinc/73/10/25/1133731025.db2.gz KUVAPHZRNAIEAR-GOSISDBHSA-N 1 1 289.419 3.517 20 10 CHCDMO C[C@@H](C[N@H+]1CCc2cccc(O)c2C1)c1ccccc1 ZINC001207911531 1133861735 /nfs/dbraw/zinc/86/17/35/1133861735.db2.gz DJYXSHFLPSSOJY-AWEZNQCLSA-N 1 1 267.372 3.554 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000166371293 1133917239 /nfs/dbraw/zinc/91/72/39/1133917239.db2.gz NKBZERYUKXVGLD-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000166371293 1133917244 /nfs/dbraw/zinc/91/72/44/1133917244.db2.gz NKBZERYUKXVGLD-MRXNPFEDSA-N 1 1 271.335 3.868 20 10 CHCDMO CC1(C[N@H+]2CCc3cccc(O)c3C2)CCCCC1 ZINC001208902097 1133960018 /nfs/dbraw/zinc/96/00/18/1133960018.db2.gz HRJGNODWOLHITJ-UHFFFAOYSA-N 1 1 259.393 3.721 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](C)C(F)(F)F ZINC001208902364 1133960785 /nfs/dbraw/zinc/96/07/85/1133960785.db2.gz RDKOEBBICHVWDB-LBPRGKRZSA-N 1 1 288.357 3.773 20 10 CHCDMO CC[N@@H+](CCc1cc(F)cc(F)c1)Cc1ccccc1O ZINC001209131754 1133979642 /nfs/dbraw/zinc/97/96/42/1133979642.db2.gz DAPHUOZRIMIRRE-UHFFFAOYSA-N 1 1 291.341 3.735 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N)cc1 ZINC001218337428 1135089862 /nfs/dbraw/zinc/08/98/62/1135089862.db2.gz YYZFFZJSYLGRKL-HNAYVOBHSA-N 1 1 296.414 3.558 20 10 CHCDMO Cc1cccc(N2CC=C(c3c[nH]c4ncccc34)CC2)[nH+]1 ZINC000354872709 227188567 /nfs/dbraw/zinc/18/85/67/227188567.db2.gz AZFREKXLWPIOIS-UHFFFAOYSA-N 1 1 290.370 3.560 20 10 CHCDMO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)s1 ZINC000186766293 262109549 /nfs/dbraw/zinc/10/95/49/262109549.db2.gz AGBZONXJJQWLDU-MWLCHTKSSA-N 1 1 294.395 3.751 20 10 CHCDMO CC1(C)C[N@H+](Cc2cc(F)ccc2O)[C@H]1c1cccnc1 ZINC000292800194 520477224 /nfs/dbraw/zinc/47/72/24/520477224.db2.gz NMOJVHGMKRCQFB-INIZCTEOSA-N 1 1 286.350 3.509 20 10 CHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)[C@H]1c1cccnc1 ZINC000292800194 520477231 /nfs/dbraw/zinc/47/72/31/520477231.db2.gz NMOJVHGMKRCQFB-INIZCTEOSA-N 1 1 286.350 3.509 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccco2)c1 ZINC000131125567 521143392 /nfs/dbraw/zinc/14/33/92/521143392.db2.gz KFYFXAUVSBQIAW-GFCCVEGCSA-N 1 1 275.348 3.577 20 10 CHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1O ZINC000292757608 524387156 /nfs/dbraw/zinc/38/71/56/524387156.db2.gz JDIBQWRDVSUTHH-QGZVFWFLSA-N 1 1 282.387 3.679 20 10 CHCDMO COc1ccc(O)c([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)c1 ZINC000290081987 524767438 /nfs/dbraw/zinc/76/74/38/524767438.db2.gz GUNHCTAZZCUFSL-LLVKDONJSA-N 1 1 284.359 3.846 20 10 CHCDMO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062744974 524784086 /nfs/dbraw/zinc/78/40/86/524784086.db2.gz GIWGALUMECGIER-RYUDHWBXSA-N 1 1 289.350 3.952 20 10 CHCDMO C[C@]12CC[N@@H+](Cc3c(O)cccc3Cl)C[C@H]1C2(F)F ZINC000292751283 525347216 /nfs/dbraw/zinc/34/72/16/525347216.db2.gz IMMCFQGMWZPWAS-OLZOCXBDSA-N 1 1 287.737 3.523 20 10 CHCDMO C[C@@H]([NH2+][C@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278803967 525677404 /nfs/dbraw/zinc/67/74/04/525677404.db2.gz RKDGKZIWFBULDG-BDAKNGLRSA-N 1 1 290.190 3.529 20 10 CHCDMO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1 ZINC000037786564 525723230 /nfs/dbraw/zinc/72/32/30/525723230.db2.gz LLBRBDSYRVNZLW-CQSZACIVSA-N 1 1 290.451 3.614 20 10 CHCDMO Cc1ccsc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000094875171 525858856 /nfs/dbraw/zinc/85/88/56/525858856.db2.gz FMKDOGQLEVXKDV-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC000228137299 1125462206 /nfs/dbraw/zinc/46/22/06/1125462206.db2.gz SZMRSYPRGFZBKG-DZGCQCFKSA-N 1 1 275.392 3.555 20 10 CHCDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccccc1O ZINC000111235035 1125480854 /nfs/dbraw/zinc/48/08/54/1125480854.db2.gz FJQLSAFJVPGHCR-LBPRGKRZSA-N 1 1 259.324 3.724 20 10 CHCDMO CC[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)CC(F)(F)F ZINC000708494648 1121468316 /nfs/dbraw/zinc/46/83/16/1121468316.db2.gz NGEBAFQRNALPKO-MRVPVSSYSA-N 1 1 297.267 3.739 20 10 CHCDMO CC[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140465663 1131750398 /nfs/dbraw/zinc/75/03/98/1131750398.db2.gz QIIHWYQDJXFZQB-NSHDSACASA-N 1 1 253.773 3.668 20 10 CHCDMO CCn1cc[nH+]c1NCc1cc(Cl)cc(Cl)c1O ZINC000840886629 1132302647 /nfs/dbraw/zinc/30/26/47/1132302647.db2.gz JLTYXQQDKOVCEN-UHFFFAOYSA-N 1 1 286.162 3.528 20 10 CHCDMO C[C@@H]([NH2+]CCCOCC1CC1)c1ccc(Cl)cc1O ZINC000841744231 1132387354 /nfs/dbraw/zinc/38/73/54/1132387354.db2.gz NDYHPIQNNCLVMW-LLVKDONJSA-N 1 1 283.799 3.513 20 10 CHCDMO CC1=C[C@H](C)[C@@H](C[N@@H+](C)Cc2ccccc2O)CC1 ZINC001208179761 1133899689 /nfs/dbraw/zinc/89/96/89/1133899689.db2.gz BZTRLSXBPHQPQB-LSDHHAIUSA-N 1 1 259.393 3.816 20 10 CHCDMO CC(C)[C@H](O)C(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841751087 1125583350 /nfs/dbraw/zinc/58/33/50/1125583350.db2.gz KLNGTRADEXMGOS-NHYWBVRUSA-N 1 1 299.842 3.739 20 10 CHCDMO C[C@H]([NH2+]C(C1CC1)C1CC1)c1ccc(Cl)cc1O ZINC000841747860 1125580103 /nfs/dbraw/zinc/58/01/03/1125580103.db2.gz UKDJBBHUFNUPNL-VIFPVBQESA-N 1 1 265.784 3.885 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000841755022 1125593847 /nfs/dbraw/zinc/59/38/47/1125593847.db2.gz XLNCJYKOLAKZNY-SRVKXCTJSA-N 1 1 283.799 3.511 20 10 CHCDMO CCOc1cccc(C[N@H+]2[C@H](C)CC[C@H]2CC)c1O ZINC000136821670 1125647241 /nfs/dbraw/zinc/64/72/41/1125647241.db2.gz QXRZNKQAVXPVON-TZMCWYRMSA-N 1 1 263.381 3.554 20 10 CHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc(Cl)ccc1O ZINC000136819824 1125647752 /nfs/dbraw/zinc/64/77/52/1125647752.db2.gz ANPCJPKVEYGTCG-ZWNOBZJWSA-N 1 1 253.773 3.809 20 10 CHCDMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000137278438 1125657845 /nfs/dbraw/zinc/65/78/45/1125657845.db2.gz VVEHKOLCSQTJQO-AWEZNQCLSA-N 1 1 255.361 3.894 20 10 CHCDMO Cc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccc1F ZINC000886495163 1125680524 /nfs/dbraw/zinc/68/05/24/1125680524.db2.gz KPHJTAJGDQTPEX-NSHDSACASA-N 1 1 277.314 3.830 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1c(O)cccc1F ZINC000886501305 1125681434 /nfs/dbraw/zinc/68/14/34/1125681434.db2.gz FFDGNWLPNCCGPU-ZWNOBZJWSA-N 1 1 275.323 3.853 20 10 CHCDMO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886542610 1125686456 /nfs/dbraw/zinc/68/64/56/1125686456.db2.gz CPTQVEQXTIECLU-NWDGAFQWSA-N 1 1 274.339 3.647 20 10 CHCDMO COc1cc(C)ccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886539293 1125687610 /nfs/dbraw/zinc/68/76/10/1125687610.db2.gz XNTGSGBHKVHVFA-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO CCOCCC1(C[NH2+][C@H](C)c2c(O)cccc2F)CCC1 ZINC000886551280 1125689989 /nfs/dbraw/zinc/68/99/89/1125689989.db2.gz FTUHDHLTRSYWAY-CYBMUJFWSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1c(C)noc1C ZINC000886556980 1125690386 /nfs/dbraw/zinc/69/03/86/1125690386.db2.gz OFZQENJGUIMNME-RNCFNFMXSA-N 1 1 292.354 3.938 20 10 CHCDMO C[C@@H](C[NH2+][C@H](C)c1c(O)cccc1F)CC(F)(F)F ZINC000886625585 1125699731 /nfs/dbraw/zinc/69/97/31/1125699731.db2.gz VHTWNCROOSKYOO-RKDXNWHRSA-N 1 1 279.277 3.770 20 10 CHCDMO C[C@@H](C[NH2+][C@@H](C)c1c(O)cccc1F)CC(F)(F)F ZINC000886625582 1125699925 /nfs/dbraw/zinc/69/99/25/1125699925.db2.gz VHTWNCROOSKYOO-BDAKNGLRSA-N 1 1 279.277 3.770 20 10 CHCDMO COCc1csc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886637690 1125700696 /nfs/dbraw/zinc/70/06/96/1125700696.db2.gz CJDIZYUEIWTQEG-JTQLQIEISA-N 1 1 295.379 3.590 20 10 CHCDMO C[C@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1c(O)cccc1F ZINC000886634539 1125701489 /nfs/dbraw/zinc/70/14/89/1125701489.db2.gz GRSMLNJPAWNUGN-STQMWFEESA-N 1 1 293.382 3.674 20 10 CHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC000122184235 1125785329 /nfs/dbraw/zinc/78/53/29/1125785329.db2.gz ZDGUROOHROZSKM-GFCCVEGCSA-N 1 1 289.350 3.733 20 10 CHCDMO CC(C)[N@@H+](CCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000741053482 1129427615 /nfs/dbraw/zinc/42/76/15/1129427615.db2.gz JMQPETYBJPLWSQ-UHFFFAOYSA-N 1 1 288.357 3.915 20 10 CHCDMO CC(C)SCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000801510894 1129923067 /nfs/dbraw/zinc/92/30/67/1129923067.db2.gz JCKVXQJNUWVZOK-UHFFFAOYSA-N 1 1 292.492 3.859 20 10 CHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC001462123245 1130198269 /nfs/dbraw/zinc/19/82/69/1130198269.db2.gz ATGXFJBSBPHUES-CABZTGNLSA-N 1 1 271.763 3.805 20 10 CHCDMO CC[N@@H+](Cc1ccc(N2CCCC2)cc1)C1CCC1 ZINC001319712676 1126981257 /nfs/dbraw/zinc/98/12/57/1126981257.db2.gz RXEPTUNMFDWPSN-UHFFFAOYSA-N 1 1 258.409 3.661 20 10 CHCDMO C[N@H+](CCCC[NH3+])Cc1cc(Cl)c(C(C)(C)C)cc1[O-] ZINC001236142643 1130874544 /nfs/dbraw/zinc/87/45/44/1130874544.db2.gz ZGHJYKVDCBECDJ-UHFFFAOYSA-N 1 1 298.858 3.514 20 10 CHCDMO C[N@@H+](CCCC[NH3+])Cc1cc(Cl)c(C(C)(C)C)cc1[O-] ZINC001236142643 1130874550 /nfs/dbraw/zinc/87/45/50/1130874550.db2.gz ZGHJYKVDCBECDJ-UHFFFAOYSA-N 1 1 298.858 3.514 20 10 CHCDMO COc1cccc(C[N@@H+](Cc2cccs2)C(C)C)c1O ZINC000271051997 1127067461 /nfs/dbraw/zinc/06/74/61/1127067461.db2.gz AVDLMLYNOASWQQ-UHFFFAOYSA-N 1 1 291.416 3.873 20 10 CHCDMO CC[N@@H+](CCc1nccs1)Cc1c(O)cccc1Cl ZINC000271188756 1127072679 /nfs/dbraw/zinc/07/26/79/1127072679.db2.gz OTAONYKOFZWIKP-UHFFFAOYSA-N 1 1 296.823 3.567 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)CCO1 ZINC000912854404 1127114798 /nfs/dbraw/zinc/11/47/98/1127114798.db2.gz ZNGAEUCFVNBMAC-OAHLLOKOSA-N 1 1 291.435 3.609 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nnc(C)s1 ZINC000283159095 1127124081 /nfs/dbraw/zinc/12/40/81/1127124081.db2.gz OXMPFWIMAPXFQY-NSHDSACASA-N 1 1 291.420 3.525 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nnc(C)s1 ZINC000283159095 1127124084 /nfs/dbraw/zinc/12/40/84/1127124084.db2.gz OXMPFWIMAPXFQY-NSHDSACASA-N 1 1 291.420 3.525 20 10 CHCDMO Oc1ccc(C(F)(F)F)cc1C[N@H+]1CCCC12CC2 ZINC001237137921 1131056115 /nfs/dbraw/zinc/05/61/15/1131056115.db2.gz RPODUIGSRAUPKM-UHFFFAOYSA-N 1 1 271.282 3.539 20 10 CHCDMO C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816481113 1131098453 /nfs/dbraw/zinc/09/84/53/1131098453.db2.gz JJZUBJMFHKSPKR-VIFPVBQESA-N 1 1 257.736 3.559 20 10 CHCDMO C[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816481113 1131098458 /nfs/dbraw/zinc/09/84/58/1131098458.db2.gz JJZUBJMFHKSPKR-VIFPVBQESA-N 1 1 257.736 3.559 20 10 CHCDMO Cc1ccc(NCc2cc(Cl)c(F)cc2O)[nH+]c1 ZINC000816536656 1131106010 /nfs/dbraw/zinc/10/60/10/1131106010.db2.gz FYAQSCGYLTTWMR-UHFFFAOYSA-N 1 1 266.703 3.500 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cccc(F)c1 ZINC000816531405 1131105649 /nfs/dbraw/zinc/10/56/49/1131105649.db2.gz QKQPZLMFDIGISR-UHFFFAOYSA-N 1 1 283.705 3.614 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccc(F)cc1O ZINC000285726256 1127241924 /nfs/dbraw/zinc/24/19/24/1127241924.db2.gz QJXXALWMJLBLDL-OAHLLOKOSA-N 1 1 277.314 3.911 20 10 CHCDMO CC[C@@H]([NH2+]CCCC(F)(F)F)c1ccc(F)cc1O ZINC000286003660 1127253037 /nfs/dbraw/zinc/25/30/37/1127253037.db2.gz IVALOATVRGELEH-LLVKDONJSA-N 1 1 279.277 3.915 20 10 CHCDMO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)C)C1)c1ccc(F)cc1O ZINC000286160216 1127260829 /nfs/dbraw/zinc/26/08/29/1127260829.db2.gz PWBHGADTXDQOIC-UKPHBRMFSA-N 1 1 295.398 3.776 20 10 CHCDMO CC[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccc(F)cc1O ZINC000287065883 1127285557 /nfs/dbraw/zinc/28/55/57/1127285557.db2.gz NVLWJXAUCIYTPN-BXUZGUMPSA-N 1 1 283.412 3.715 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)ccc1N(C)C ZINC000293917330 1127533203 /nfs/dbraw/zinc/53/32/03/1127533203.db2.gz XPKNXXCKKRAFDK-HNNXBMFYSA-N 1 1 283.419 3.649 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]3CCC[C@H]3C2)cc1Cl ZINC001231868388 1127544619 /nfs/dbraw/zinc/54/46/19/1127544619.db2.gz UTBHXSWHKGMAAS-OLZOCXBDSA-N 1 1 279.811 3.976 20 10 CHCDMO C[C@@H]1CCC[C@@H]([NH2+]Cc2c(O)cccc2F)CC1 ZINC001308947534 1127597842 /nfs/dbraw/zinc/59/78/42/1127597842.db2.gz GDGPWNYCHZXVBX-VXGBXAGGSA-N 1 1 251.345 3.590 20 10 CHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2O)c2ccccc2O1 ZINC000295099826 1127620479 /nfs/dbraw/zinc/62/04/79/1127620479.db2.gz SPSSFVYTVYDXTP-IAQYHMDHSA-N 1 1 287.334 3.533 20 10 CHCDMO CCCC[N@@H+](CCc1cscn1)Cc1ccccc1O ZINC000295146204 1127623791 /nfs/dbraw/zinc/62/37/91/1127623791.db2.gz FJBRFNKHRUXEJU-UHFFFAOYSA-N 1 1 290.432 3.694 20 10 CHCDMO C[C@H](CCc1ccco1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745135 1127772623 /nfs/dbraw/zinc/77/26/23/1127772623.db2.gz IUSQLUHBZOBLBR-NEPJUHHUSA-N 1 1 277.339 3.796 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc(F)cc1O ZINC000062747637 1127773692 /nfs/dbraw/zinc/77/36/92/1127773692.db2.gz BRBFIYNDTGJHTP-DGCLKSJQSA-N 1 1 271.335 3.522 20 10 CHCDMO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2nccs2)cc1 ZINC000374302212 1127887500 /nfs/dbraw/zinc/88/75/00/1127887500.db2.gz NVLKOEOHHQZYTM-HNNXBMFYSA-N 1 1 287.432 3.546 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2nccs2)cc1 ZINC000374302212 1127887503 /nfs/dbraw/zinc/88/75/03/1127887503.db2.gz NVLKOEOHHQZYTM-HNNXBMFYSA-N 1 1 287.432 3.546 20 10 CHCDMO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1C ZINC000925080682 1128121041 /nfs/dbraw/zinc/12/10/41/1128121041.db2.gz OCXIJGFYZJEMIY-MRXNPFEDSA-N 1 1 299.418 3.525 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252178073 1128129046 /nfs/dbraw/zinc/12/90/46/1128129046.db2.gz PKNQACNRWZBPEN-QWRGUYRKSA-N 1 1 253.773 3.666 20 10 CHCDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccccc1O ZINC000777824834 1128288520 /nfs/dbraw/zinc/28/85/20/1128288520.db2.gz HNARFBUSBHDNGF-MRXNPFEDSA-N 1 1 285.387 3.984 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1snnc1C ZINC000929753965 1128284876 /nfs/dbraw/zinc/28/48/76/1128284876.db2.gz YYISCOIVNGOKDU-GFCCVEGCSA-N 1 1 291.420 3.525 20 10 CHCDMO Cc1c(C[N@H+]2CCC[C@@H](F)CC2)c2ccccc2n1C ZINC001138252887 1128286143 /nfs/dbraw/zinc/28/61/43/1128286143.db2.gz XCXJKHIUHFOYBE-CQSZACIVSA-N 1 1 274.383 3.811 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](C(C)C)C2)cc1C(C)C ZINC000777969207 1128352426 /nfs/dbraw/zinc/35/24/26/1128352426.db2.gz OREVNBALUSUXHE-GOSISDBHSA-N 1 1 291.435 3.681 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCCCO1 ZINC000917074622 1128473898 /nfs/dbraw/zinc/47/38/98/1128473898.db2.gz DCQLMAABACTDNW-GOSISDBHSA-N 1 1 290.451 3.532 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000917482472 1128501199 /nfs/dbraw/zinc/50/11/99/1128501199.db2.gz IDATZPSNADDMPN-UHFFFAOYSA-N 1 1 281.399 3.821 20 10 CHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc(C)c1O ZINC000918067422 1128532548 /nfs/dbraw/zinc/53/25/48/1128532548.db2.gz ILINHJRYJGTLAB-UHFFFAOYSA-N 1 1 298.430 3.707 20 10 CHCDMO CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(F)cc(F)c1O ZINC001202779141 1128560850 /nfs/dbraw/zinc/56/08/50/1128560850.db2.gz RSGYIFIUFQMXNI-OCCSQVGLSA-N 1 1 283.362 3.975 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](CC(C)C)C(C)C)c1O ZINC000042587671 1128578556 /nfs/dbraw/zinc/57/85/56/1128578556.db2.gz PYPOEXJYMQGIQI-UHFFFAOYSA-N 1 1 281.371 3.600 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+](CC(C)C)C(C)C)c1O ZINC000042587671 1128578561 /nfs/dbraw/zinc/57/85/61/1128578561.db2.gz PYPOEXJYMQGIQI-UHFFFAOYSA-N 1 1 281.371 3.600 20 10 CHCDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(F)ccc1O ZINC000778993977 1128674731 /nfs/dbraw/zinc/67/47/31/1128674731.db2.gz ZQXUTSJZCMSORL-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000920257178 1128675061 /nfs/dbraw/zinc/67/50/61/1128675061.db2.gz ICTZFCQICHDXMW-CYBMUJFWSA-N 1 1 286.444 3.933 20 10 CHCDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000779000417 1128675769 /nfs/dbraw/zinc/67/57/69/1128675769.db2.gz VJTRIJDFFQEVOJ-KRWDZBQOSA-N 1 1 297.398 3.608 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000778996983 1128675879 /nfs/dbraw/zinc/67/58/79/1128675879.db2.gz YGFULWCOZSSSEY-AWEZNQCLSA-N 1 1 277.364 3.930 20 10 CHCDMO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000779022843 1128685826 /nfs/dbraw/zinc/68/58/26/1128685826.db2.gz ISVKEBVMOKOIJH-OAHLLOKOSA-N 1 1 275.298 3.617 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000779022843 1128685828 /nfs/dbraw/zinc/68/58/28/1128685828.db2.gz ISVKEBVMOKOIJH-OAHLLOKOSA-N 1 1 275.298 3.617 20 10 CHCDMO CCCC(O)(CCC)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185500717 1117830535 /nfs/dbraw/zinc/83/05/35/1117830535.db2.gz VJHCHFPVTKUKPV-LBPRGKRZSA-N 1 1 283.387 3.513 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@@H+](CCC(C)C)C2CC2)c1O ZINC000109277491 1117997144 /nfs/dbraw/zinc/99/71/44/1117997144.db2.gz UVJHNLASFXNXOU-UHFFFAOYSA-N 1 1 293.382 3.744 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+](CCC(C)C)C2CC2)c1O ZINC000109277491 1117997146 /nfs/dbraw/zinc/99/71/46/1117997146.db2.gz UVJHNLASFXNXOU-UHFFFAOYSA-N 1 1 293.382 3.744 20 10 CHCDMO C[C@H]1CCCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000211433378 1118030024 /nfs/dbraw/zinc/03/00/24/1118030024.db2.gz DVQCITIBAWBIHS-NSHDSACASA-N 1 1 253.773 3.810 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1F ZINC000779151213 1128753417 /nfs/dbraw/zinc/75/34/17/1128753417.db2.gz VSMHNPYEGFYKIQ-YJBOKZPZSA-N 1 1 290.426 3.857 20 10 CHCDMO Oc1ccc2ccncc2c1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000749976356 1118087263 /nfs/dbraw/zinc/08/72/63/1118087263.db2.gz LHCVHXPHDNPJKH-GASCZTMLSA-N 1 1 282.387 3.562 20 10 CHCDMO CC[C@@H](C)[N@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653569 1118187832 /nfs/dbraw/zinc/18/78/32/1118187832.db2.gz BOCUDLJRWPBEGN-HZPDHXFCSA-N 1 1 291.483 3.524 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)CCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653569 1118187835 /nfs/dbraw/zinc/18/78/35/1118187835.db2.gz BOCUDLJRWPBEGN-HZPDHXFCSA-N 1 1 291.483 3.524 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)c1O ZINC000179854431 1128762363 /nfs/dbraw/zinc/76/23/63/1128762363.db2.gz RQYPLEIQMWUURB-QAPCUYQASA-N 1 1 297.398 3.663 20 10 CHCDMO Oc1ccc(C2=CC[N@@H+](Cc3cc(F)ccc3O)CC2)cc1 ZINC000179893878 1128764067 /nfs/dbraw/zinc/76/40/67/1128764067.db2.gz IPHJROYRFOUORD-UHFFFAOYSA-N 1 1 299.345 3.526 20 10 CHCDMO COc1cccc2c1C[N@@H+](Cc1c(C)ccc(C)c1O)CC2 ZINC001140178351 1118242532 /nfs/dbraw/zinc/24/25/32/1118242532.db2.gz JFJQWTNWOHXWMF-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000317254269 1118251765 /nfs/dbraw/zinc/25/17/65/1118251765.db2.gz KXYFYWDJTKZTIS-HNNXBMFYSA-N 1 1 299.414 3.772 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000147937283 1118254574 /nfs/dbraw/zinc/25/45/74/1118254574.db2.gz HIKMRWYGWQHMHI-GASCZTMLSA-N 1 1 267.372 3.777 20 10 CHCDMO Cc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000693216996 1118421277 /nfs/dbraw/zinc/42/12/77/1118421277.db2.gz XGXZSHWRYUUSQV-ZDUSSCGKSA-N 1 1 273.351 3.999 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccccc2C)c1 ZINC000160526305 1118469405 /nfs/dbraw/zinc/46/94/05/1118469405.db2.gz OVGRXAMUBSCPJK-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])CC1(C)C ZINC001659369530 1118479678 /nfs/dbraw/zinc/47/96/78/1118479678.db2.gz JQKCLKOYIUTHIH-NSHDSACASA-N 1 1 267.800 3.914 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H](CC(C)C)C2)c1O ZINC000307782521 1118528380 /nfs/dbraw/zinc/52/83/80/1118528380.db2.gz VRAXMJZOBILRKY-CQSZACIVSA-N 1 1 277.408 3.659 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)C(F)F ZINC000834827073 1118575354 /nfs/dbraw/zinc/57/53/54/1118575354.db2.gz IAOSSEDXGDYHTK-UONOGXRCSA-N 1 1 270.367 3.837 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2ccncc2)cc1 ZINC000177999377 1118594821 /nfs/dbraw/zinc/59/48/21/1118594821.db2.gz CDFBLBYTGDIMMU-UHFFFAOYSA-N 1 1 297.446 3.602 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000754727439 1118646657 /nfs/dbraw/zinc/64/66/57/1118646657.db2.gz VTEOQAGEYZIZLC-INIZCTEOSA-N 1 1 259.393 3.774 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](COC)C(C)C ZINC001167522278 1118987073 /nfs/dbraw/zinc/98/70/73/1118987073.db2.gz XEZFVJMAGHEJDY-INIZCTEOSA-N 1 1 279.424 3.523 20 10 CHCDMO CC[C@]1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000190348359 1128818690 /nfs/dbraw/zinc/81/86/90/1128818690.db2.gz LKAFLFXWPJPDOC-GOSISDBHSA-N 1 1 285.387 3.546 20 10 CHCDMO CC[N@@H+](Cc1cc(F)ccc1O)C1CCCCC1 ZINC000226561425 1119157002 /nfs/dbraw/zinc/15/70/02/1119157002.db2.gz WQNILIBWBGVECM-UHFFFAOYSA-N 1 1 251.345 3.686 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1N1CCCC1 ZINC000120061156 1119229331 /nfs/dbraw/zinc/22/93/31/1119229331.db2.gz ZPYHVIDTNRNFOK-UHFFFAOYSA-N 1 1 296.414 3.624 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCCC3(CC(F)C3)CC2)c1 ZINC001140622925 1119292682 /nfs/dbraw/zinc/29/26/82/1119292682.db2.gz HPNRSMNYCWBYOU-UHFFFAOYSA-N 1 1 277.383 3.805 20 10 CHCDMO CC(C)(CC[NH2+]Cc1cc(F)cc(F)c1O)C1CC1 ZINC000708497836 1119490585 /nfs/dbraw/zinc/49/05/85/1119490585.db2.gz VNAGESKDNRBJQP-UHFFFAOYSA-N 1 1 269.335 3.586 20 10 CHCDMO CCC[N@@H+](CCc1scnc1C)Cc1ccccc1O ZINC000172532252 1120104140 /nfs/dbraw/zinc/10/41/40/1120104140.db2.gz HXWSEDOQTUJPIN-UHFFFAOYSA-N 1 1 290.432 3.612 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)[C@H](C)C(C)C)c1O ZINC000092590300 1120221640 /nfs/dbraw/zinc/22/16/40/1120221640.db2.gz WDQKQEFKBCHAEK-CYBMUJFWSA-N 1 1 265.397 3.657 20 10 CHCDMO Cc1cccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC000180483207 1120276688 /nfs/dbraw/zinc/27/66/88/1120276688.db2.gz CXDJOSOZUFFGEP-GJZGRUSLSA-N 1 1 277.433 3.561 20 10 CHCDMO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccc(F)cc1O ZINC000185440059 1120376730 /nfs/dbraw/zinc/37/67/30/1120376730.db2.gz VGOUTUNTUFIFJH-OQHXTRMZSA-N 1 1 271.335 3.895 20 10 CHCDMO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)c1 ZINC000185471739 1120378109 /nfs/dbraw/zinc/37/81/09/1120378109.db2.gz JKNSBHUHXYNLIS-YOEHRIQHSA-N 1 1 292.467 3.718 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC3(CCCC3)C2)c1O ZINC000312447195 1120426803 /nfs/dbraw/zinc/42/68/03/1120426803.db2.gz CDVPYRFBKAHZDG-UHFFFAOYSA-N 1 1 295.810 3.820 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000191666167 1120525660 /nfs/dbraw/zinc/52/56/60/1120525660.db2.gz NVIOGKCEZQTWRY-CYBMUJFWSA-N 1 1 287.428 3.873 20 10 CHCDMO C[C@@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000922836367 1120607439 /nfs/dbraw/zinc/60/74/39/1120607439.db2.gz JFPBDWLJZQFEIA-RKDXNWHRSA-N 1 1 289.803 3.558 20 10 CHCDMO COc1cccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1O ZINC000093383565 1120797005 /nfs/dbraw/zinc/79/70/05/1120797005.db2.gz GHZOTOPTAGAWBR-NFAWXSAZSA-N 1 1 275.392 3.554 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCc3cccc(C)c3C2)c1O ZINC000763509072 1128941654 /nfs/dbraw/zinc/94/16/54/1128941654.db2.gz XLPHDGRGLKJAEF-UHFFFAOYSA-N 1 1 297.398 3.658 20 10 CHCDMO C[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1O ZINC000756760765 1120808105 /nfs/dbraw/zinc/80/81/05/1120808105.db2.gz QMBQMNLLTPWXDC-XEZPLFJOSA-N 1 1 295.398 3.513 20 10 CHCDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)s1 ZINC000708535700 1121468500 /nfs/dbraw/zinc/46/85/00/1121468500.db2.gz PKISEVKEDCFXNP-VIFPVBQESA-N 1 1 283.343 3.891 20 10 CHCDMO CCc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)s1 ZINC000708548957 1121468681 /nfs/dbraw/zinc/46/86/81/1121468681.db2.gz KRVGZSLACQMCMH-UHFFFAOYSA-N 1 1 283.343 3.584 20 10 CHCDMO CCCC[N@@H+](Cc1ccncc1)Cc1ccccc1O ZINC000282547274 1121589387 /nfs/dbraw/zinc/58/93/87/1121589387.db2.gz WQLLGPOOZXCSMD-UHFFFAOYSA-N 1 1 270.376 3.590 20 10 CHCDMO C[C@@H]1CCC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC001177240678 1121718847 /nfs/dbraw/zinc/71/88/47/1121718847.db2.gz QIUVQUGCTDJPKI-NXEZZACHSA-N 1 1 271.763 3.853 20 10 CHCDMO CCC[N@@H+](CCc1ccccc1)Cc1ccccc1O ZINC000727831338 1121750172 /nfs/dbraw/zinc/75/01/72/1121750172.db2.gz WVAFWTOYZIEUPI-UHFFFAOYSA-N 1 1 269.388 3.847 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc(C)o2)cc1 ZINC000773734901 1121774034 /nfs/dbraw/zinc/77/40/34/1121774034.db2.gz SQZTWWYDCUUXDB-UHFFFAOYSA-N 1 1 272.392 3.676 20 10 CHCDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000773816289 1121883070 /nfs/dbraw/zinc/88/30/70/1121883070.db2.gz FQBJAPUKGIKOSN-OAHLLOKOSA-N 1 1 280.481 3.716 20 10 CHCDMO CC(C)(C)OCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731847683 1121887289 /nfs/dbraw/zinc/88/72/89/1121887289.db2.gz MEPSXXIMSVLHHM-UHFFFAOYSA-N 1 1 291.435 3.952 20 10 CHCDMO CCc1nc([C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)cs1 ZINC000732232268 1121914428 /nfs/dbraw/zinc/91/44/28/1121914428.db2.gz HQSTZQLMMYULNR-LBPRGKRZSA-N 1 1 290.432 3.873 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC001180029869 1121940118 /nfs/dbraw/zinc/94/01/18/1121940118.db2.gz GSAOPCGWERGJPN-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001180029869 1121940121 /nfs/dbraw/zinc/94/01/21/1121940121.db2.gz GSAOPCGWERGJPN-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001180029869 1121940126 /nfs/dbraw/zinc/94/01/26/1121940126.db2.gz GSAOPCGWERGJPN-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO COc1ccc([N@H+](CC(C)C)CC2CCOCC2)cc1 ZINC000732982287 1121949711 /nfs/dbraw/zinc/94/97/11/1121949711.db2.gz PDAKVMXMJGUGFT-UHFFFAOYSA-N 1 1 277.408 3.584 20 10 CHCDMO COc1ccc([N@@H+](CC(C)C)CC2CCOCC2)cc1 ZINC000732982287 1121949717 /nfs/dbraw/zinc/94/97/17/1121949717.db2.gz PDAKVMXMJGUGFT-UHFFFAOYSA-N 1 1 277.408 3.584 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC001180203731 1121961782 /nfs/dbraw/zinc/96/17/82/1121961782.db2.gz YJCBLTKYXIITKB-QAPCUYQASA-N 1 1 289.419 3.517 20 10 CHCDMO CC(C)C[C@H]1COCC[N@H+]1Cc1cc(C(C)C)ccc1O ZINC001180267102 1121968934 /nfs/dbraw/zinc/96/89/34/1121968934.db2.gz OEDSCJNAWRTIML-KRWDZBQOSA-N 1 1 291.435 3.763 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(O)c1 ZINC001204277263 1122008243 /nfs/dbraw/zinc/00/82/43/1122008243.db2.gz XMLXTRAEDYJVPL-INIZCTEOSA-N 1 1 287.334 3.574 20 10 CHCDMO C[C@@H]1CCC[C@@H](C[NH2+]Cc2cc(F)c(F)cc2O)[C@@H]1C ZINC001181233356 1122044771 /nfs/dbraw/zinc/04/47/71/1122044771.db2.gz AMZCUEKTLDGMSZ-UTUOFQBUSA-N 1 1 283.362 3.832 20 10 CHCDMO C[C@@H]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC001181399435 1122053173 /nfs/dbraw/zinc/05/31/73/1122053173.db2.gz IPYVNCWOWUEHSM-NXEZZACHSA-N 1 1 271.763 3.711 20 10 CHCDMO CCOCC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000779598371 1129030912 /nfs/dbraw/zinc/03/09/12/1129030912.db2.gz HBQIIKKMVIOCCL-UHFFFAOYSA-N 1 1 285.387 3.528 20 10 CHCDMO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204321930 1122116026 /nfs/dbraw/zinc/11/60/26/1122116026.db2.gz MAWYZDLJXZWWMO-CQSZACIVSA-N 1 1 298.352 3.671 20 10 CHCDMO Cc1cccc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC000779604333 1129032114 /nfs/dbraw/zinc/03/21/14/1129032114.db2.gz JNPOXNKZISSTHR-AWEZNQCLSA-N 1 1 259.393 3.713 20 10 CHCDMO CO[C@@H](C)CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774168044 1122136615 /nfs/dbraw/zinc/13/66/15/1122136615.db2.gz FMQJEXFKHCKZNR-DTWKUNHWSA-N 1 1 292.206 3.775 20 10 CHCDMO C[C@@H]([NH2+][C@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1O ZINC000774284334 1122153291 /nfs/dbraw/zinc/15/32/91/1122153291.db2.gz FDUOHGNAMGTGBI-HTQZYQBOSA-N 1 1 292.206 3.509 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c1 ZINC001182450839 1122160137 /nfs/dbraw/zinc/16/01/37/1122160137.db2.gz AFRZTEZZALITFH-IHRRRGAJSA-N 1 1 261.409 3.992 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH2+]C[C@H]1CC2CCC1CC2 ZINC001182532920 1122173906 /nfs/dbraw/zinc/17/39/06/1122173906.db2.gz HUBAEQJQVSFJLP-HTAVTVPLSA-N 1 1 281.346 3.586 20 10 CHCDMO Oc1ccccc1CNc1cc[nH+]c2ccc(Cl)cc12 ZINC000774522840 1122178493 /nfs/dbraw/zinc/17/84/93/1122178493.db2.gz AHYRUUDRNLKASA-UHFFFAOYSA-N 1 1 284.746 3.628 20 10 CHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC(C2CCC2)CC1 ZINC001182795468 1122187040 /nfs/dbraw/zinc/18/70/40/1122187040.db2.gz CGVANGWWMFNILX-UHFFFAOYSA-N 1 1 281.346 3.683 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001182969778 1122198490 /nfs/dbraw/zinc/19/84/90/1122198490.db2.gz JVEBMEVLFDACBV-CYBMUJFWSA-N 1 1 263.356 3.543 20 10 CHCDMO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC001183454572 1122224138 /nfs/dbraw/zinc/22/41/38/1122224138.db2.gz MHLFGBRQEDGYBA-DZGCQCFKSA-N 1 1 257.377 3.700 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](CF)C2)c(Cl)c1 ZINC001183521188 1122226332 /nfs/dbraw/zinc/22/63/32/1122226332.db2.gz VYQBLYKVADYGCZ-NSHDSACASA-N 1 1 271.763 3.536 20 10 CHCDMO C[C@@H](CCc1ccsc1)[NH2+]Cc1c(O)cccc1F ZINC001183920447 1122248219 /nfs/dbraw/zinc/24/82/19/1122248219.db2.gz YVZOJZKZWZFHGJ-NSHDSACASA-N 1 1 279.380 3.704 20 10 CHCDMO Cc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1Cl ZINC001183919448 1122248558 /nfs/dbraw/zinc/24/85/58/1122248558.db2.gz KSCSRCBPSOJIGM-UHFFFAOYSA-N 1 1 279.742 3.783 20 10 CHCDMO CCc1nc(NCc2ccc(N(CC)CC)cc2)cc(C)[nH+]1 ZINC001184925645 1122303190 /nfs/dbraw/zinc/30/31/90/1122303190.db2.gz ANRFNQGOJFHIGS-UHFFFAOYSA-N 1 1 298.434 3.806 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cc(C)cc(C)c2)c1O ZINC000775147384 1122444691 /nfs/dbraw/zinc/44/46/91/1122444691.db2.gz BNFSKLZNFXKTNL-UHFFFAOYSA-N 1 1 285.387 3.650 20 10 CHCDMO Cc1cccc(O)c1C[N@H+]1CCSc2ccccc2C1 ZINC001237489706 1129058165 /nfs/dbraw/zinc/05/81/65/1129058165.db2.gz DEBREOJSXGIKBR-UHFFFAOYSA-N 1 1 285.412 3.809 20 10 CHCDMO Cc1cc(C)c([C@H](C)[NH2+]C2CCN(C(C)C)CC2)c(O)c1 ZINC000284931537 1122495861 /nfs/dbraw/zinc/49/58/61/1122495861.db2.gz DNFZGRCQZVVOSP-HNNXBMFYSA-N 1 1 290.451 3.532 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001191276905 1122588739 /nfs/dbraw/zinc/58/87/39/1122588739.db2.gz GNPITAZISPHBCC-YOWGUQMCSA-N 1 1 295.373 3.896 20 10 CHCDMO C[N@@H+](CCCSC(C)(C)C)Cc1ccccc1O ZINC001191681853 1122608435 /nfs/dbraw/zinc/60/84/35/1122608435.db2.gz JGXSPLZDVUVWDK-UHFFFAOYSA-N 1 1 267.438 3.746 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645540 1122655069 /nfs/dbraw/zinc/65/50/69/1122655069.db2.gz OJSPZLDCYYXLOD-GOEBONIOSA-N 1 1 260.425 3.906 20 10 CHCDMO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)CC1CCC1 ZINC001193761701 1122717959 /nfs/dbraw/zinc/71/79/59/1122717959.db2.gz JHRXZMZEIFJTKH-UHFFFAOYSA-N 1 1 260.425 3.683 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCc3sccc3C2)c1O ZINC000775648047 1122856340 /nfs/dbraw/zinc/85/63/40/1122856340.db2.gz NWMCRXNZWMILIJ-UHFFFAOYSA-N 1 1 293.819 3.974 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000775648402 1122857100 /nfs/dbraw/zinc/85/71/00/1122857100.db2.gz HKXMMHBIFKJVMA-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO CC[N@@H+](CCc1ccccc1)Cc1cccc(C)c1O ZINC000775652825 1122867889 /nfs/dbraw/zinc/86/78/89/1122867889.db2.gz VQLAKHGOMVQDDK-UHFFFAOYSA-N 1 1 269.388 3.765 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC000228173454 1122900921 /nfs/dbraw/zinc/90/09/21/1122900921.db2.gz MJZIKPXPQRHHSQ-GOEBONIOSA-N 1 1 259.393 3.855 20 10 CHCDMO Cc1cccc(C[N@H+]2CCc3c(C)cccc3C2)c1O ZINC000775681777 1122902093 /nfs/dbraw/zinc/90/20/93/1122902093.db2.gz TWBDIOGGUGSOIC-UHFFFAOYSA-N 1 1 267.372 3.567 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](c3ccco3)C2)c1O ZINC000775692927 1122911303 /nfs/dbraw/zinc/91/13/03/1122911303.db2.gz QPGGGFXDRIJAPZ-LBPRGKRZSA-N 1 1 291.778 3.937 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000775723015 1122925169 /nfs/dbraw/zinc/92/51/69/1122925169.db2.gz BNKFRYHACYFYLN-KBXCAEBGSA-N 1 1 297.398 3.779 20 10 CHCDMO Cc1cccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1O ZINC000775726650 1122927747 /nfs/dbraw/zinc/92/77/47/1122927747.db2.gz YTQAHJWSAGHSCM-MRXNPFEDSA-N 1 1 271.335 3.787 20 10 CHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000775736966 1122928393 /nfs/dbraw/zinc/92/83/93/1122928393.db2.gz ILUUJUATUVMVHB-LLVKDONJSA-N 1 1 253.773 3.586 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H]2C)c1O ZINC000775737053 1122928856 /nfs/dbraw/zinc/92/88/56/1122928856.db2.gz NXWGJKWGEHFONA-GXSJLCMTSA-N 1 1 253.773 3.584 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000775741594 1122933160 /nfs/dbraw/zinc/93/31/60/1122933160.db2.gz TVWKODAQLJFZRM-KBXCAEBGSA-N 1 1 297.398 3.525 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc21 ZINC001197552638 1122960363 /nfs/dbraw/zinc/96/03/63/1122960363.db2.gz LPVJAHPLSPWLPM-HNNXBMFYSA-N 1 1 280.415 3.872 20 10 CHCDMO C[N@@H+](CCC(F)(F)F)Cc1ccc(N2CCCC2)cc1 ZINC001202347913 1123196884 /nfs/dbraw/zinc/19/68/84/1123196884.db2.gz MJCCBPBGGJFWMN-UHFFFAOYSA-N 1 1 286.341 3.671 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CCCC(F)(F)F)cc1 ZINC001202443917 1123209369 /nfs/dbraw/zinc/20/93/69/1123209369.db2.gz ZLFYHJPJLFCIDP-UHFFFAOYSA-N 1 1 274.330 3.527 20 10 CHCDMO C[N@H+]1CCCC[C@@H]1CCSc1ncc(Cl)s1 ZINC000849998588 1123236169 /nfs/dbraw/zinc/23/61/69/1123236169.db2.gz PJNDELGLDINKFB-SECBINFHSA-N 1 1 276.858 3.763 20 10 CHCDMO CCOc1ccc(O)c(C[NH2+]CC(F)(F)C(C)(C)C)c1 ZINC000850410236 1123264744 /nfs/dbraw/zinc/26/47/44/1123264744.db2.gz QIWIVWQHFCUFPV-UHFFFAOYSA-N 1 1 287.350 3.562 20 10 CHCDMO CCSC1(C[NH2+][C@@H](CC)c2ccc(F)cc2O)CC1 ZINC000850553546 1123289985 /nfs/dbraw/zinc/28/99/85/1123289985.db2.gz YOKHMEHEOJTEQN-ZDUSSCGKSA-N 1 1 283.412 3.858 20 10 CHCDMO Fc1cccc(Cl)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001648959682 1123434414 /nfs/dbraw/zinc/43/44/14/1123434414.db2.gz CTDLTAUBOZTVHS-UHFFFAOYSA-N 1 1 291.753 3.704 20 10 CHCDMO CC1(C)CCC[C@H]1C[NH2+]Cc1cc(F)c(F)cc1O ZINC001205951107 1123443883 /nfs/dbraw/zinc/44/38/83/1123443883.db2.gz HRPCXRVLGRAWHF-NSHDSACASA-N 1 1 269.335 3.586 20 10 CHCDMO CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000854230378 1123478856 /nfs/dbraw/zinc/47/88/56/1123478856.db2.gz OAJOXTNDMQBJMX-SUMWQHHRSA-N 1 1 286.419 3.569 20 10 CHCDMO CC(C)Cc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)cn1 ZINC000895785777 1123514001 /nfs/dbraw/zinc/51/40/01/1123514001.db2.gz SVTXSKPPKMWBRT-UHFFFAOYSA-N 1 1 282.387 3.502 20 10 CHCDMO CC(C)Cc1ccc(C[N@H+]2Cc3cccc(O)c3C2)cn1 ZINC000895785777 1123514002 /nfs/dbraw/zinc/51/40/02/1123514002.db2.gz SVTXSKPPKMWBRT-UHFFFAOYSA-N 1 1 282.387 3.502 20 10 CHCDMO Cc1cc(C[N@H+](C)CC2(C)COC2)c(C)n1-c1ccccc1 ZINC001137858152 1123717688 /nfs/dbraw/zinc/71/76/88/1123717688.db2.gz YLLSJDYUYOSZMR-UHFFFAOYSA-N 1 1 298.430 3.562 20 10 CHCDMO C[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)C[C@H](C)C1(F)F ZINC000862444307 1123812137 /nfs/dbraw/zinc/81/21/37/1123812137.db2.gz VEGBPWOMORMMNN-AOOOYVTPSA-N 1 1 289.753 3.769 20 10 CHCDMO Cc1cc(C[N@H+]2CCOC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000195566073 1129146931 /nfs/dbraw/zinc/14/69/31/1129146931.db2.gz ABEPVXFQNFMUHY-UHFFFAOYSA-N 1 1 291.435 3.609 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC000862467310 1123813508 /nfs/dbraw/zinc/81/35/08/1123813508.db2.gz RVDDUJVRDDMIEL-UHFFFAOYSA-N 1 1 289.753 3.975 20 10 CHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c(O)cc1C ZINC000794686856 1123927730 /nfs/dbraw/zinc/92/77/30/1123927730.db2.gz SIMYNTATZWPMAR-CQSZACIVSA-N 1 1 277.408 3.720 20 10 CHCDMO COc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1C ZINC000865822498 1124017662 /nfs/dbraw/zinc/01/76/62/1124017662.db2.gz IGPUXHTXBPHWOF-MRXNPFEDSA-N 1 1 291.341 3.943 20 10 CHCDMO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2cc(F)cc(F)c2O)s1 ZINC000866455487 1124068229 /nfs/dbraw/zinc/06/82/29/1124068229.db2.gz MEGZFQVWVJUKTN-HTQZYQBOSA-N 1 1 298.358 3.847 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1c(O)cccc1F ZINC001119438113 1131254354 /nfs/dbraw/zinc/25/43/54/1131254354.db2.gz IDHXFZLHOWTOHD-ZDCRXTMVSA-N 1 1 285.309 3.616 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000872721385 1124728138 /nfs/dbraw/zinc/72/81/38/1124728138.db2.gz FOYCPQFUFMWBLJ-CABCVRRESA-N 1 1 299.439 3.730 20 10 CHCDMO C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccccc1O ZINC000020827438 1124878753 /nfs/dbraw/zinc/87/87/53/1124878753.db2.gz MVAPOAAEKPPJKF-MRXNPFEDSA-N 1 1 298.430 3.565 20 10 CHCDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(O)c1 ZINC000877548698 1125042263 /nfs/dbraw/zinc/04/22/63/1125042263.db2.gz RRAOFKJHKCJCTB-KRWDZBQOSA-N 1 1 282.387 3.679 20 10 CHCDMO Cc1scc(C[N@H+]2Cc3cccc(O)c3C2)c1C ZINC000877702761 1125066339 /nfs/dbraw/zinc/06/63/39/1125066339.db2.gz GTORPPLFNGEONC-UHFFFAOYSA-N 1 1 259.374 3.586 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000878753347 1125177114 /nfs/dbraw/zinc/17/71/14/1125177114.db2.gz JBYZWXGYUKGUPF-GOSISDBHSA-N 1 1 295.430 3.527 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCc2occc21 ZINC000190753746 1125319296 /nfs/dbraw/zinc/31/92/96/1125319296.db2.gz OVNKXFSERYXSFT-GFCCVEGCSA-N 1 1 295.741 3.945 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1nc(C)cs1 ZINC000882986705 1125365254 /nfs/dbraw/zinc/36/52/54/1125365254.db2.gz HGMSRMUFNYGRJJ-GFCCVEGCSA-N 1 1 298.358 3.676 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCCC[C@@H]2CC)c1O ZINC000131545785 1125397656 /nfs/dbraw/zinc/39/76/56/1125397656.db2.gz YBBMYPOKXGZUGR-AWEZNQCLSA-N 1 1 263.381 3.555 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(F)cc1O ZINC000883357719 1125401209 /nfs/dbraw/zinc/40/12/09/1125401209.db2.gz RMTPIHADGOXFRL-ZFWWWQNUSA-N 1 1 293.382 3.674 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](CC)Cc2ccncc2)cc1 ZINC000027907755 1125412812 /nfs/dbraw/zinc/41/28/12/1125412812.db2.gz FGIJKZJJXRZACL-UHFFFAOYSA-N 1 1 297.446 3.950 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)ccc1N(C)C ZINC001139669861 1131356551 /nfs/dbraw/zinc/35/65/51/1131356551.db2.gz QKLXFEOAUOYKOV-AWEZNQCLSA-N 1 1 296.405 3.928 20 10 CHCDMO Cc1cc(C[N@@H+](C)C2CCCCC2)ccc1N(C)C ZINC001139669805 1131357089 /nfs/dbraw/zinc/35/70/89/1131357089.db2.gz OTTQGWGEQPLJBY-UHFFFAOYSA-N 1 1 260.425 3.826 20 10 CHCDMO C[C@H](c1ccco1)[N@H+](C)Cc1c(O)cccc1Cl ZINC000131097400 1129243642 /nfs/dbraw/zinc/24/36/42/1129243642.db2.gz NWNVIGNSNYHPHZ-SNVBAGLBSA-N 1 1 265.740 3.832 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000131097400 1129243646 /nfs/dbraw/zinc/24/36/46/1129243646.db2.gz NWNVIGNSNYHPHZ-SNVBAGLBSA-N 1 1 265.740 3.832 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCCC2(CC2)C1 ZINC000184867467 1129260380 /nfs/dbraw/zinc/26/03/80/1129260380.db2.gz ATLZALWYJWFTAU-UHFFFAOYSA-N 1 1 267.372 3.921 20 10 CHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000091024762 1129341746 /nfs/dbraw/zinc/34/17/46/1129341746.db2.gz CNJPWWXIWILKIW-AWEZNQCLSA-N 1 1 267.438 3.582 20 10 CHCDMO C[N@@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1O ZINC000091974694 1129376475 /nfs/dbraw/zinc/37/64/75/1129376475.db2.gz SMNBVPNGKRHARY-UHFFFAOYSA-N 1 1 266.344 3.506 20 10 CHCDMO CC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CCC1 ZINC000738051529 1129390146 /nfs/dbraw/zinc/39/01/46/1129390146.db2.gz ADAKQIJQOASNEC-UHFFFAOYSA-N 1 1 277.408 3.770 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738257259 1129392364 /nfs/dbraw/zinc/39/23/64/1129392364.db2.gz VQYOTGVQTMKCEY-CQSZACIVSA-N 1 1 284.403 3.953 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)c1 ZINC000092486525 1129395655 /nfs/dbraw/zinc/39/56/55/1129395655.db2.gz HVCFHJHLHWILHV-BEFAXECRSA-N 1 1 297.398 3.663 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)C[C@H]3C)c2c1 ZINC000740860579 1129420813 /nfs/dbraw/zinc/42/08/13/1129420813.db2.gz QWHCKEBXBPBETR-QWHCGFSZSA-N 1 1 285.387 3.784 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)c1 ZINC000093758980 1129427988 /nfs/dbraw/zinc/42/79/88/1129427988.db2.gz KTJMDAZFKWRKHU-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3c4ccccc4[nH]c3C2)c1 ZINC000093758980 1129427990 /nfs/dbraw/zinc/42/79/90/1129427990.db2.gz KTJMDAZFKWRKHU-UHFFFAOYSA-N 1 1 292.382 3.740 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2cccn2C)c1 ZINC000093845513 1129428450 /nfs/dbraw/zinc/42/84/50/1129428450.db2.gz VGHDGPYBMCKZMK-KRWDZBQOSA-N 1 1 284.403 3.766 20 10 CHCDMO CCCC[C@H](COC)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796772449 1129441566 /nfs/dbraw/zinc/44/15/66/1129441566.db2.gz RXVJRUFVUJUMIT-HIFRSBDPSA-N 1 1 283.387 3.777 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCn3cccc3[C@H]2C)cc1 ZINC000741752655 1129451120 /nfs/dbraw/zinc/45/11/20/1129451120.db2.gz DFIVDBGYZFHZFX-OAHLLOKOSA-N 1 1 283.419 3.521 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2CCC(C)=C(C)C2)c1O ZINC000796017643 1129463947 /nfs/dbraw/zinc/46/39/47/1129463947.db2.gz JBSCGRMFRISYHZ-UHFFFAOYSA-N 1 1 281.783 3.596 20 10 CHCDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154175 1129468940 /nfs/dbraw/zinc/46/89/40/1129468940.db2.gz FBUNGRJJXAUDBA-KBPBESRZSA-N 1 1 284.403 3.951 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC3(CCCC3)C2)cc1C ZINC000743391190 1129521567 /nfs/dbraw/zinc/52/15/67/1129521567.db2.gz ZHEVBEHOOOSFCV-UHFFFAOYSA-N 1 1 259.393 3.775 20 10 CHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]1c1cccc(F)c1)CCC2 ZINC000743391699 1129522264 /nfs/dbraw/zinc/52/22/64/1129522264.db2.gz WSXIVBUIFPWIGV-GOSISDBHSA-N 1 1 297.373 3.967 20 10 CHCDMO CCC[N@@H+](Cc1cccc(C)n1)Cc1ccccc1O ZINC000743870676 1129542670 /nfs/dbraw/zinc/54/26/70/1129542670.db2.gz ZODXQPSDIVKUGG-UHFFFAOYSA-N 1 1 270.376 3.508 20 10 CHCDMO CC(C)C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000744437582 1129577698 /nfs/dbraw/zinc/57/76/98/1129577698.db2.gz WRGGANFVWCUDFI-AWEZNQCLSA-N 1 1 273.420 3.749 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](CC(C)C)C2)cc1C ZINC000744437384 1129578213 /nfs/dbraw/zinc/57/82/13/1129578213.db2.gz RBQDRRULHBSSKV-HNNXBMFYSA-N 1 1 261.409 3.877 20 10 CHCDMO COc1cc(Cl)cc(C[N@H+]2C[C@H](C)CC[C@H]2C)c1O ZINC000252841180 1129598686 /nfs/dbraw/zinc/59/86/86/1129598686.db2.gz DBHQOHCKZFQTJF-GHMZBOCLSA-N 1 1 283.799 3.675 20 10 CHCDMO CC(C)O[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C1(C)C ZINC000766331515 1129605433 /nfs/dbraw/zinc/60/54/33/1129605433.db2.gz SFRGKVSDGBQWGJ-IUIKQTSFSA-N 1 1 295.398 3.774 20 10 CHCDMO CCC[N@H+](CC)CCN[C@H](CC)c1ccc(N(C)C)cc1 ZINC000766397804 1129662224 /nfs/dbraw/zinc/66/22/24/1129662224.db2.gz BZFYRLBDTBADQI-GOSISDBHSA-N 1 1 291.483 3.525 20 10 CHCDMO CCC[N@@H+](CC)CCN[C@H](CC)c1ccc(N(C)C)cc1 ZINC000766397804 1129662226 /nfs/dbraw/zinc/66/22/26/1129662226.db2.gz BZFYRLBDTBADQI-GOSISDBHSA-N 1 1 291.483 3.525 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@H+]2CC1CCC(=O)CC1 ZINC000828568552 1131391723 /nfs/dbraw/zinc/39/17/23/1131391723.db2.gz FFGAKFQVFXUVOU-UHFFFAOYSA-N 1 1 287.403 3.597 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@@H+]2CC1CCC(=O)CC1 ZINC000828568552 1131391727 /nfs/dbraw/zinc/39/17/27/1131391727.db2.gz FFGAKFQVFXUVOU-UHFFFAOYSA-N 1 1 287.403 3.597 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H](OCC)C1CC1 ZINC001169754849 1129754131 /nfs/dbraw/zinc/75/41/31/1129754131.db2.gz QFFZOVFYBNKIQD-SFHVURJKSA-N 1 1 291.435 3.809 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000768175862 1129838851 /nfs/dbraw/zinc/83/88/51/1129838851.db2.gz XKHUNSHXASLRCD-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000016076977 1129839989 /nfs/dbraw/zinc/83/99/89/1129839989.db2.gz REFQRGQCDUHFQB-ZDUSSCGKSA-N 1 1 255.361 3.777 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCc3sccc3[C@@H]2C)c1 ZINC000768206767 1129840790 /nfs/dbraw/zinc/84/07/90/1129840790.db2.gz GJHHDJJTGSDMBH-LBPRGKRZSA-N 1 1 273.401 3.881 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)C2CCC(C)CC2)c1 ZINC000768196579 1129842431 /nfs/dbraw/zinc/84/24/31/1129842431.db2.gz FCVVWZUSWGNKEX-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(O)c1 ZINC000768195636 1129842837 /nfs/dbraw/zinc/84/28/37/1129842837.db2.gz PESKWVSBQFCKGE-CQSZACIVSA-N 1 1 297.398 3.910 20 10 CHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000768226766 1129843515 /nfs/dbraw/zinc/84/35/15/1129843515.db2.gz CEVHSVFSBRIYCY-MRXNPFEDSA-N 1 1 297.398 3.608 20 10 CHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000768236042 1129845595 /nfs/dbraw/zinc/84/55/95/1129845595.db2.gz CJUZPYLMLPYGGH-OAHLLOKOSA-N 1 1 298.430 3.954 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](CCC(C)C)C2CC2)c1 ZINC000768257541 1129846761 /nfs/dbraw/zinc/84/67/61/1129846761.db2.gz LNVXEJBXFKDFSM-UHFFFAOYSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)Cc2cccc(C)c2)c(O)c1 ZINC000768252733 1129847056 /nfs/dbraw/zinc/84/70/56/1129847056.db2.gz NQXGITOJZVBLJF-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CCOc1ccc(C[N@@H+](C)CCCc2ccccc2)c(O)c1 ZINC000768337499 1129851793 /nfs/dbraw/zinc/85/17/93/1129851793.db2.gz QSKDGKIVKXNDKT-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cccc(OC)c1O ZINC000768530569 1129859845 /nfs/dbraw/zinc/85/98/45/1129859845.db2.gz LHQUERYHADUKHF-KRWDZBQOSA-N 1 1 297.398 3.738 20 10 CHCDMO CCC1(CC)C[N@@H+](Cc2cc(OC)ccc2O)CCS1 ZINC000768529231 1129860183 /nfs/dbraw/zinc/86/01/83/1129860183.db2.gz QARKEPWLFUEZIV-UHFFFAOYSA-N 1 1 295.448 3.508 20 10 CHCDMO COCC[N@@H+](Cc1cc(C)ccc1O)[C@H](C)c1ccccc1 ZINC000768598279 1129864781 /nfs/dbraw/zinc/86/47/81/1129864781.db2.gz XCPRULGZXFQCOE-MRXNPFEDSA-N 1 1 299.414 3.910 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000769101754 1129890382 /nfs/dbraw/zinc/89/03/82/1129890382.db2.gz GDGFQFJFZKAEAN-WBVHZDCISA-N 1 1 258.409 3.517 20 10 CHCDMO COc1cccc(C[N@H+]2CCC[C@H]2CC(C)(C)C)c1O ZINC000769164680 1129893056 /nfs/dbraw/zinc/89/30/56/1129893056.db2.gz KDKJBTWMFLMHOE-AWEZNQCLSA-N 1 1 277.408 3.801 20 10 CHCDMO CCC[N@@H+](Cc1ccc2c(c1)COC2)Cc1ccccc1O ZINC000769200675 1129895146 /nfs/dbraw/zinc/89/51/46/1129895146.db2.gz INOLUCPQCOFPEA-UHFFFAOYSA-N 1 1 297.398 3.835 20 10 CHCDMO COc1cccc(O)c1C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000769317926 1129901623 /nfs/dbraw/zinc/90/16/23/1129901623.db2.gz ATMRIYFECMRIJX-CQSZACIVSA-N 1 1 285.387 3.636 20 10 CHCDMO COc1ccc2c(c1)CCC[N@H+](Cc1cc(C)ccc1O)C2 ZINC000769329255 1129903092 /nfs/dbraw/zinc/90/30/92/1129903092.db2.gz 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C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccncc32)CC12CCC2 ZINC000770670514 1129954766 /nfs/dbraw/zinc/95/47/66/1129954766.db2.gz LGMOXJDIOBBLGI-CQSZACIVSA-N 1 1 296.414 3.953 20 10 CHCDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000771934515 1129996432 /nfs/dbraw/zinc/99/64/32/1129996432.db2.gz ARMXMGWRFAFCLJ-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1CCC=CO1 ZINC000802657751 1130028088 /nfs/dbraw/zinc/02/80/88/1130028088.db2.gz QIBWHBDXOIRUCJ-MRXNPFEDSA-N 1 1 275.392 3.687 20 10 CHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(C)cc2O)C1 ZINC001461933522 1130116212 /nfs/dbraw/zinc/11/62/12/1130116212.db2.gz FLXJLURMWDQBRB-LSDHHAIUSA-N 1 1 279.449 3.807 20 10 CHCDMO CC(C)[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(N(C)C)cc1 ZINC000787185183 1130138392 /nfs/dbraw/zinc/13/83/92/1130138392.db2.gz XTFWRUGNRXYDHY-SFHVURJKSA-N 1 1 290.451 3.532 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCOC(C)(C)[C@H]2C)c1 ZINC001461960105 1130139808 /nfs/dbraw/zinc/13/98/08/1130139808.db2.gz 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Cc1cc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000793231269 1130532568 /nfs/dbraw/zinc/53/25/68/1130532568.db2.gz LXVWIFMHYQCPIC-AAEUAGOBSA-N 1 1 287.325 3.782 20 10 CHCDMO COc1cccc([C@]2(C)CC[N@@H+](Cc3ccccc3O)C2)c1 ZINC000827283955 1130544913 /nfs/dbraw/zinc/54/49/13/1130544913.db2.gz RLNMMUAAYQFABX-LJQANCHMSA-N 1 1 297.398 3.564 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC2CC2)CC2CCC2)c1O ZINC000793388693 1130551333 /nfs/dbraw/zinc/55/13/33/1130551333.db2.gz IBGYITKGHIJHQR-UHFFFAOYSA-N 1 1 289.419 3.803 20 10 CHCDMO Cc1cccc(NCc2c(O)ccc3c2CCCC3)[nH+]1 ZINC000811808415 1130645403 /nfs/dbraw/zinc/64/54/03/1130645403.db2.gz IQLITCFUWNVLPO-UHFFFAOYSA-N 1 1 268.360 3.587 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2CC[C@H](C)C2)c1 ZINC000780578605 1130684460 /nfs/dbraw/zinc/68/44/60/1130684460.db2.gz XMAHNZKDSDIZRA-CABZTGNLSA-N 1 1 298.224 3.741 20 10 CHCDMO Cc1cccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780793147 1130692986 /nfs/dbraw/zinc/69/29/86/1130692986.db2.gz KNCXXURSBXRSDP-DGCLKSJQSA-N 1 1 287.325 3.863 20 10 CHCDMO C[N@H+](Cc1ccon1)Cc1cccc(-c2ccccc2)c1O ZINC001234997144 1130701764 /nfs/dbraw/zinc/70/17/64/1130701764.db2.gz UOPJMUCEPOYVAC-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO C[N@@H+](Cc1ccon1)Cc1cccc(-c2ccccc2)c1O ZINC001234997144 1130701768 /nfs/dbraw/zinc/70/17/68/1130701768.db2.gz UOPJMUCEPOYVAC-UHFFFAOYSA-N 1 1 294.354 3.679 20 10 CHCDMO CSc1ccccc1C[N@@H+](C)Cc1ccccc1O ZINC000781337035 1130715673 /nfs/dbraw/zinc/71/56/73/1130715673.db2.gz TXCQDEPVHMSPBD-UHFFFAOYSA-N 1 1 273.401 3.746 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCC[C@H]2C)c1 ZINC000781895503 1130745780 /nfs/dbraw/zinc/74/57/80/1130745780.db2.gz UHGJYEFPENYHIO-LLVKDONJSA-N 1 1 298.224 3.838 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC[C@H]2C)c1 ZINC000781895503 1130745783 /nfs/dbraw/zinc/74/57/83/1130745783.db2.gz UHGJYEFPENYHIO-LLVKDONJSA-N 1 1 298.224 3.838 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC000781910017 1130747016 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CC(C)(C)c1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(O)c1 ZINC001235685568 1130768074 /nfs/dbraw/zinc/76/80/74/1130768074.db2.gz QUDXQQSDTVPNNR-MRXNPFEDSA-N 1 1 295.373 3.921 20 10 CHCDMO CC(C)(C)c1ccc(C[N@H+]2CCc3ccncc3C2)c(O)c1 ZINC001235686200 1130768280 /nfs/dbraw/zinc/76/82/80/1130768280.db2.gz YHGJEBXMWIMHTR-UHFFFAOYSA-N 1 1 296.414 3.643 20 10 CHCDMO CCCO[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235683500 1130768693 /nfs/dbraw/zinc/76/86/93/1130768693.db2.gz GRKVDLPYXGTMHC-INIZCTEOSA-N 1 1 291.435 3.691 20 10 CHCDMO Cc1ccc(O[C@@H]2CCC[N@@H+](Cc3ccc(N)cc3)C2)cc1 ZINC001235687988 1130769493 /nfs/dbraw/zinc/76/94/93/1130769493.db2.gz LHYVSQIGNDBXGD-LJQANCHMSA-N 1 1 296.414 3.621 20 10 CHCDMO Cn1c[nH+]c2cc(NCc3ccc(Cl)cc3F)ccc21 ZINC000782531635 1130781364 /nfs/dbraw/zinc/78/13/64/1130781364.db2.gz CBPFNUSRKGADDM-UHFFFAOYSA-N 1 1 289.741 3.978 20 10 CHCDMO CCc1ccccc1C[N@@H+](C)Cc1ccccc1O ZINC000782512324 1130782092 /nfs/dbraw/zinc/78/20/92/1130782092.db2.gz FMKGLAANZUFIFP-UHFFFAOYSA-N 1 1 255.361 3.587 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@@H]21 ZINC000783592153 1130842224 /nfs/dbraw/zinc/84/22/24/1130842224.db2.gz DGEMNQLAZUNGGF-KCPJHIHWSA-N 1 1 263.356 3.542 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1 ZINC000783593531 1130842474 /nfs/dbraw/zinc/84/24/74/1130842474.db2.gz VPXYHHVXVDHGJR-CWRNSKLLSA-N 1 1 259.393 3.711 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1C ZINC000814229993 1130849921 /nfs/dbraw/zinc/84/99/21/1130849921.db2.gz IRYWBAYEDZKMJD-SFHVURJKSA-N 1 1 296.414 3.987 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CC=CCC2)cc1C ZINC000784012783 1130867443 /nfs/dbraw/zinc/86/74/43/1130867443.db2.gz FYIONJCZCQZSIQ-HNNXBMFYSA-N 1 1 259.393 3.797 20 10 CHCDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c(O)cc1C ZINC000784030732 1130870137 /nfs/dbraw/zinc/87/01/37/1130870137.db2.gz HWLDZPARZMFYKY-AWEZNQCLSA-N 1 1 277.408 3.577 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1 ZINC001236128242 1130871504 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CCN(C)c1ccc(C[N@H+]2CC[C@H](c3ccccn3)C2)cc1 ZINC000815107996 1130961932 /nfs/dbraw/zinc/96/19/32/1130961932.db2.gz RHQZJBULAFTNDR-KRWDZBQOSA-N 1 1 295.430 3.527 20 10 CHCDMO CCc1ccc(C[N@@H+](C)CCc2cccc(C)c2)c(O)c1 ZINC001236787178 1131005845 /nfs/dbraw/zinc/00/58/45/1131005845.db2.gz AJVARVSNBSMJLE-UHFFFAOYSA-N 1 1 283.415 3.938 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2ccccc2)c(O)c1 ZINC001236784256 1131007620 /nfs/dbraw/zinc/00/76/20/1131007620.db2.gz SOYJWKWEMPDWSA-UHFFFAOYSA-N 1 1 255.361 3.587 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@@H](C)C2)c(Cl)c1 ZINC001236799701 1131010038 /nfs/dbraw/zinc/01/00/38/1131010038.db2.gz WMQAVALRRYOZHM-LLVKDONJSA-N 1 1 283.799 3.676 20 10 CHCDMO CCOC1(C[NH2+][C@H](CC)c2ccc(F)cc2O)CCCC1 ZINC000815645046 1131015649 /nfs/dbraw/zinc/01/56/49/1131015649.db2.gz SWKVZIMUGXHMNM-OAHLLOKOSA-N 1 1 295.398 3.921 20 10 CHCDMO Oc1cc2ccccc2cc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001236838129 1131017963 /nfs/dbraw/zinc/01/79/63/1131017963.db2.gz VJHNYIAOLWPGKX-GOEBONIOSA-N 1 1 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ZINC000816554752 1131110215 /nfs/dbraw/zinc/11/02/15/1131110215.db2.gz IEAJMTVFJHHPJD-UHFFFAOYSA-N 1 1 271.763 3.711 20 10 CHCDMO CC[C@H]1C[N@@H+](Cc2ccc3ccccc3c2O)CCCO1 ZINC000816599232 1131114105 /nfs/dbraw/zinc/11/41/05/1131114105.db2.gz GUXLHACVYUOXPE-INIZCTEOSA-N 1 1 285.387 3.546 20 10 CHCDMO CCCC[N@@H+](Cc1conc1CC)Cc1ccccc1O ZINC000816601106 1131114970 /nfs/dbraw/zinc/11/49/70/1131114970.db2.gz RLRBAUMVPLRZCM-UHFFFAOYSA-N 1 1 288.391 3.745 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000816619356 1131115897 /nfs/dbraw/zinc/11/58/97/1131115897.db2.gz CDDGMSZZGDWBBH-INIZCTEOSA-N 1 1 267.372 3.772 20 10 CHCDMO Oc1c(C[NH2+][C@@H]2CCCC2(F)F)ccc2ccccc21 ZINC000816612224 1131116234 /nfs/dbraw/zinc/11/62/34/1131116234.db2.gz JPNUNHGTWHMNIY-CQSZACIVSA-N 1 1 277.314 3.823 20 10 CHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H]2COC)cc1 ZINC000816636694 1131117579 /nfs/dbraw/zinc/11/75/79/1131117579.db2.gz FIWNGEHOMYDRRB-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H]1C ZINC000816648341 1131119085 /nfs/dbraw/zinc/11/90/85/1131119085.db2.gz IZCHZJKZDGFWOI-HUUCEWRRSA-N 1 1 258.409 3.517 20 10 CHCDMO C[N@@H+](CCF)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237648482 1131124044 /nfs/dbraw/zinc/12/40/44/1131124044.db2.gz CEOKANTZBUPJDA-UHFFFAOYSA-N 1 1 277.314 3.600 20 10 CHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237808050 1131142567 /nfs/dbraw/zinc/14/25/67/1131142567.db2.gz PICZUMWGKWTRRO-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2[O-])CCC1(F)F ZINC001237808583 1131143310 /nfs/dbraw/zinc/14/33/10/1131143310.db2.gz UJONMWLTXJNADC-QMMMGPOBSA-N 1 1 293.716 3.662 20 10 CHCDMO C[C@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CCC1(F)F ZINC001237808583 1131143314 /nfs/dbraw/zinc/14/33/14/1131143314.db2.gz UJONMWLTXJNADC-QMMMGPOBSA-N 1 1 293.716 3.662 20 10 CHCDMO CC[C@]1(C)CC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001116444990 1131146880 /nfs/dbraw/zinc/14/68/80/1131146880.db2.gz KQPFNUKPTNVNRO-GOSISDBHSA-N 1 1 272.436 3.909 20 10 CHCDMO Cc1cccc(CC[N@H+](C)Cc2cc(F)cc(C)c2O)c1 ZINC001238060413 1131166625 /nfs/dbraw/zinc/16/66/25/1131166625.db2.gz AOOKYTWBYFLYQP-UHFFFAOYSA-N 1 1 287.378 3.823 20 10 CHCDMO Cc1ccc(C[N@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238062073 1131166729 /nfs/dbraw/zinc/16/67/29/1131166729.db2.gz UAUGFMPSHUAPNL-UHFFFAOYSA-N 1 1 273.351 3.780 20 10 CHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(C)c1O ZINC001238071111 1131168648 /nfs/dbraw/zinc/16/86/48/1131168648.db2.gz RSRCDWSNGHOAQX-CQSZACIVSA-N 1 1 251.345 3.604 20 10 CHCDMO Cc1cc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)cc(C)n1 ZINC000817588993 1131174152 /nfs/dbraw/zinc/17/41/52/1131174152.db2.gz KPNRLTVNIUDGPS-NSHDSACASA-N 1 1 292.329 3.533 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccc2ccccc2c1[O-] ZINC000817959526 1131191362 /nfs/dbraw/zinc/19/13/62/1131191362.db2.gz GWOAORHKKNAPMV-JCKWVBRZSA-N 1 1 298.430 3.714 20 10 CHCDMO C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817966263 1131193791 /nfs/dbraw/zinc/19/37/91/1131193791.db2.gz JWJQNTROTYSNNT-LIRRHRJNSA-N 1 1 298.430 3.586 20 10 CHCDMO CC[C@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1cccc(Cl)c1[O-] ZINC000817982220 1131194920 /nfs/dbraw/zinc/19/49/20/1131194920.db2.gz POQCJPWVQCGJFI-LSDHHAIUSA-N 1 1 296.842 3.604 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC(c2ccccc2)CC1 ZINC001137833183 1131420210 /nfs/dbraw/zinc/42/02/10/1131420210.db2.gz WIKZWTNWKDATES-UHFFFAOYSA-N 1 1 285.362 3.911 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001137837850 1131421256 /nfs/dbraw/zinc/42/12/56/1131421256.db2.gz XEBVEEWETNCGSD-INIZCTEOSA-N 1 1 286.350 3.654 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001137837850 1131421258 /nfs/dbraw/zinc/42/12/58/1131421258.db2.gz XEBVEEWETNCGSD-INIZCTEOSA-N 1 1 286.350 3.654 20 10 CHCDMO CCCC[NH+](CCCC)Cc1c(O)cccc1F ZINC001137837497 1131421573 /nfs/dbraw/zinc/42/15/73/1131421573.db2.gz JIZBWLPBALIQLU-UHFFFAOYSA-N 1 1 253.361 3.934 20 10 CHCDMO CC1(C)C[N@H+](Cc2c(O)cccc2F)Cc2ccccc21 ZINC001137840204 1131421587 /nfs/dbraw/zinc/42/15/87/1131421587.db2.gz SQXRELXKGIGRIZ-UHFFFAOYSA-N 1 1 285.362 3.825 20 10 CHCDMO CC1(C)C[N@@H+](Cc2c(O)cccc2F)Cc2ccccc21 ZINC001137840204 1131421590 /nfs/dbraw/zinc/42/15/90/1131421590.db2.gz SQXRELXKGIGRIZ-UHFFFAOYSA-N 1 1 285.362 3.825 20 10 CHCDMO COC[C@H]1CCC[N@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137853921 1131423867 /nfs/dbraw/zinc/42/38/67/1131423867.db2.gz ATOYNIPEQCDEFI-LJQANCHMSA-N 1 1 298.430 3.705 20 10 CHCDMO Cc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c(C)n1-c1ccccc1 ZINC001137856213 1131424487 /nfs/dbraw/zinc/42/44/87/1131424487.db2.gz URCMJZQYAAXHCE-YTQUADARSA-N 1 1 298.405 3.884 20 10 CHCDMO Oc1c(F)cccc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001138127705 1131470423 /nfs/dbraw/zinc/47/04/23/1131470423.db2.gz NFWRUEQSZQCCNV-INIZCTEOSA-N 1 1 286.350 3.654 20 10 CHCDMO Oc1c(F)cccc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001138127705 1131470426 /nfs/dbraw/zinc/47/04/26/1131470426.db2.gz NFWRUEQSZQCCNV-INIZCTEOSA-N 1 1 286.350 3.654 20 10 CHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001138213855 1131477973 /nfs/dbraw/zinc/47/79/73/1131477973.db2.gz CDTDXXKKCICNCO-HDICACEKSA-N 1 1 284.447 3.909 20 10 CHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC001138218918 1131479061 /nfs/dbraw/zinc/47/90/61/1131479061.db2.gz YFEIIFQMDDERFO-UHFFFAOYSA-N 1 1 260.425 3.907 20 10 CHCDMO Cc1c(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)c2ccccc2n1C ZINC001138252514 1131482426 /nfs/dbraw/zinc/48/24/26/1131482426.db2.gz JOOODJRMUHIUGG-DLBZAZTESA-N 1 1 292.373 3.759 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCc4ccsc4C3)ccc21 ZINC001138358377 1131494280 /nfs/dbraw/zinc/49/42/80/1131494280.db2.gz QBUIFJVVYZYQNQ-UHFFFAOYSA-N 1 1 298.455 3.689 20 10 CHCDMO C[N@@H+](Cc1c[nH]c2cccc(F)c12)Cc1ccccc1O ZINC001136985615 1131498258 /nfs/dbraw/zinc/49/82/58/1131498258.db2.gz NVSJYVAMXUAOAK-UHFFFAOYSA-N 1 1 284.334 3.645 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825134452 1131500259 /nfs/dbraw/zinc/50/02/59/1131500259.db2.gz 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297.826 3.903 20 10 CHCDMO C[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)CCC[C@@H]1C ZINC001142508943 1132402786 /nfs/dbraw/zinc/40/27/86/1132402786.db2.gz QMRLKQCXAANDQX-QWRGUYRKSA-N 1 1 269.335 3.538 20 10 CHCDMO C[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)CCC[C@@H]1C ZINC001142508943 1132402790 /nfs/dbraw/zinc/40/27/90/1132402790.db2.gz QMRLKQCXAANDQX-QWRGUYRKSA-N 1 1 269.335 3.538 20 10 CHCDMO CC[C@@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC000842147766 1132410958 /nfs/dbraw/zinc/41/09/58/1132410958.db2.gz NARFILLVBRYHMQ-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO C[N@H+](Cc1cc(Cl)c(O)cc1O)CC1CCCCC1 ZINC001232262223 1132445426 /nfs/dbraw/zinc/44/54/26/1132445426.db2.gz CAPNPOUHVVVWBO-UHFFFAOYSA-N 1 1 283.799 3.763 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC23CCCC3)cc1Cl ZINC001232266368 1132447671 /nfs/dbraw/zinc/44/76/71/1132447671.db2.gz MDSGAQOYHVOXPH-UHFFFAOYSA-N 1 1 281.783 3.573 20 10 CHCDMO CC[N@@H+](CCSC)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000842644649 1132448045 /nfs/dbraw/zinc/44/80/45/1132448045.db2.gz QGAPBEFBIMSHGI-UHFFFAOYSA-N 1 1 297.464 3.580 20 10 CHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC[C@@H]2CF)c1O ZINC001143116488 1132503881 /nfs/dbraw/zinc/50/38/81/1132503881.db2.gz DUQXBYAHUIKOJR-CYBMUJFWSA-N 1 1 265.372 3.624 20 10 CHCDMO C[N@H+](Cc1cccc(C(C)(C)C)c1O)C[C@H]1CCCCO1 ZINC001143110512 1132504344 /nfs/dbraw/zinc/50/43/44/1132504344.db2.gz HNJKQACTDZLQHA-OAHLLOKOSA-N 1 1 291.435 3.691 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc3ncoc3c2)cc1 ZINC001232944488 1132548349 /nfs/dbraw/zinc/54/83/49/1132548349.db2.gz TZPLJOYCXFYSSJ-UHFFFAOYSA-N 1 1 295.386 3.526 20 10 CHCDMO Oc1ccc(F)c(F)c1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001233335221 1132603641 /nfs/dbraw/zinc/60/36/41/1132603641.db2.gz MOHMXUUUICUKNZ-NSHDSACASA-N 1 1 299.336 3.775 20 10 CHCDMO CCCC[N@H+](CCC)Cc1c(O)ccc(F)c1F ZINC001233334341 1132604780 /nfs/dbraw/zinc/60/47/80/1132604780.db2.gz CCVWILNGHRMPEP-UHFFFAOYSA-N 1 1 257.324 3.683 20 10 CHCDMO CCCC[N@@H+](CCC)Cc1c(O)ccc(F)c1F ZINC001233334341 1132604787 /nfs/dbraw/zinc/60/47/87/1132604787.db2.gz CCVWILNGHRMPEP-UHFFFAOYSA-N 1 1 257.324 3.683 20 10 CHCDMO Oc1c(C[N@@H+]2CCC3(CCC3)C2)cccc1C(F)(F)F ZINC001233418439 1132618291 /nfs/dbraw/zinc/61/82/91/1132618291.db2.gz HBVHRBICWVSDOP-UHFFFAOYSA-N 1 1 285.309 3.787 20 10 CHCDMO Oc1c(C[N@H+]2CCC3(CCC3)C2)cccc1C(F)(F)F ZINC001233418439 1132618295 /nfs/dbraw/zinc/61/82/95/1132618295.db2.gz HBVHRBICWVSDOP-UHFFFAOYSA-N 1 1 285.309 3.787 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452450 1132624914 /nfs/dbraw/zinc/62/49/14/1132624914.db2.gz XFJGMCUCDHGRAR-CABZTGNLSA-N 1 1 291.288 3.591 20 10 CHCDMO C[N@@H+](CCC1CC1)Cc1cccc(OC(F)(F)F)c1O ZINC001233767472 1132677686 /nfs/dbraw/zinc/67/76/86/1132677686.db2.gz CSHKKEAUHDAXNL-UHFFFAOYSA-N 1 1 289.297 3.523 20 10 CHCDMO CCC(C)(C)[C@@H](C)[NH2+]Cc1cc(F)c(F)cc1O ZINC001206660392 1132685932 /nfs/dbraw/zinc/68/59/32/1132685932.db2.gz CHDLHEIBSVZQAI-SECBINFHSA-N 1 1 257.324 3.585 20 10 CHCDMO Cc1ccc2cc[nH+]c(NCc3ccc(O)c(O)c3)c2c1 ZINC001158996135 1132801872 /nfs/dbraw/zinc/80/18/72/1132801872.db2.gz XCAWICDOMOASHI-UHFFFAOYSA-N 1 1 280.327 3.567 20 10 CHCDMO CCc1ccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)o1 ZINC001204394828 1133228109 /nfs/dbraw/zinc/22/81/09/1133228109.db2.gz TXIRWHHLYIHAAI-UHFFFAOYSA-N 1 1 286.419 3.930 20 10 CHCDMO COc1ccc(C[N@H+]2CCC[C@H]2C2CCCCC2)c(O)c1 ZINC001203629253 1133345945 /nfs/dbraw/zinc/34/59/45/1133345945.db2.gz UMJUGSUOBZYNAQ-KRWDZBQOSA-N 1 1 289.419 3.946 20 10 CHCDMO COc1cc(C)c(C[N@H+]2CCc3cccc(O)c3C2)cc1C ZINC001203759136 1133366891 /nfs/dbraw/zinc/36/68/91/1133366891.db2.gz XUWNNEYQTPJKER-UHFFFAOYSA-N 1 1 297.398 3.576 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)cc2)C[C@@H]1C ZINC001203929408 1133386227 /nfs/dbraw/zinc/38/62/27/1133386227.db2.gz CGZAIGICKOIPPL-CABCVRRESA-N 1 1 260.425 3.621 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)cc1 ZINC001203939953 1133386276 /nfs/dbraw/zinc/38/62/76/1133386276.db2.gz GUSXOEQCQBWSMQ-IRXDYDNUSA-N 1 1 296.405 3.805 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)cc1 ZINC001203939953 1133386280 /nfs/dbraw/zinc/38/62/80/1133386280.db2.gz GUSXOEQCQBWSMQ-IRXDYDNUSA-N 1 1 296.405 3.805 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](CF)C2)cc1 ZINC001203939843 1133386484 /nfs/dbraw/zinc/38/64/84/1133386484.db2.gz WSJUEKWYRJGLLP-MRXNPFEDSA-N 1 1 278.415 3.714 20 10 CHCDMO Cc1ccc2c(c1)CC[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203937101 1133386800 /nfs/dbraw/zinc/38/68/00/1133386800.db2.gz KQEKMOAOTQMTSC-UHFFFAOYSA-N 1 1 280.415 3.619 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC2(C)C)cc1 ZINC001203936763 1133387024 /nfs/dbraw/zinc/38/70/24/1133387024.db2.gz MXXZONPCVWFDGT-UHFFFAOYSA-N 1 1 260.425 3.907 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)cc1 ZINC001203943920 1133388734 /nfs/dbraw/zinc/38/87/34/1133388734.db2.gz INLQUTHQQSLJNO-WBVHZDCISA-N 1 1 258.409 3.517 20 10 CHCDMO CCN(CC)c1ccc(C[N@H+]2CC3CCC2CC3)cc1 ZINC001203942848 1133388866 /nfs/dbraw/zinc/38/88/66/1133388866.db2.gz UTLDXGRITPKGTA-UHFFFAOYSA-N 1 1 272.436 3.907 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCOC(C)(C)C)cc1Cl ZINC001204211530 1133419530 /nfs/dbraw/zinc/41/95/30/1133419530.db2.gz BVXJOADMEUSNLM-UHFFFAOYSA-N 1 1 285.815 3.601 20 10 CHCDMO CCC[N@@H+](Cc1ccccc1)Cc1ccc(O)cc1O ZINC001204275295 1133427486 /nfs/dbraw/zinc/42/74/86/1133427486.db2.gz NXPWSOVLCNNPGI-UHFFFAOYSA-N 1 1 271.360 3.510 20 10 CHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328619 1133438297 /nfs/dbraw/zinc/43/82/97/1133438297.db2.gz KSTFGVRKGSDIAX-GOSISDBHSA-N 1 1 272.436 3.907 20 10 CHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328620 1133438767 /nfs/dbraw/zinc/43/87/67/1133438767.db2.gz KSTFGVRKGSDIAX-SFHVURJKSA-N 1 1 272.436 3.907 20 10 CHCDMO CCc1cccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1O ZINC001204721430 1133478778 /nfs/dbraw/zinc/47/87/78/1133478778.db2.gz MBKYQZJVUFOBFI-AWEZNQCLSA-N 1 1 297.398 3.910 20 10 CHCDMO CCc1cccc(C[N@@H+](C)CCCOc2ccccc2)c1O ZINC001204881744 1133495072 /nfs/dbraw/zinc/49/50/72/1133495072.db2.gz SVJBQIJWLYGUBD-UHFFFAOYSA-N 1 1 299.414 3.856 20 10 CHCDMO CCC1(C)C[NH+](Cc2cc(C)cc(Br)c2O)C1 ZINC001206195675 1133670374 /nfs/dbraw/zinc/67/03/74/1133670374.db2.gz ZMTPRHHQHVDVHQ-UHFFFAOYSA-N 1 1 298.224 3.695 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3ccccc3C2(C)C)c1 ZINC001206385527 1133697131 /nfs/dbraw/zinc/69/71/31/1133697131.db2.gz WEGOWEICNLZYHC-UHFFFAOYSA-N 1 1 297.398 3.694 20 10 CHCDMO CC[N@@H+](CCc1cccc(C)c1)Cc1ccccc1O ZINC001207537268 1133818449 /nfs/dbraw/zinc/81/84/49/1133818449.db2.gz ZPMATOUYPNXKBZ-UHFFFAOYSA-N 1 1 269.388 3.765 20 10 CHCDMO CS[C@H](C)CC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001208141355 1133884261 /nfs/dbraw/zinc/88/42/61/1133884261.db2.gz KCVSXUPLJFUUQO-OAHLLOKOSA-N 1 1 292.492 3.860 20 10 CHCDMO CC[N@H+](Cc1ccccc1O)C[C@H](C)OCc1ccccc1 ZINC001208703148 1133930242 /nfs/dbraw/zinc/93/02/42/1133930242.db2.gz WERCTZPFBOKQOL-INIZCTEOSA-N 1 1 299.414 3.819 20 10 CHCDMO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCOC[C@H](C)C2)cc1 ZINC001209518978 1134034882 /nfs/dbraw/zinc/03/48/82/1134034882.db2.gz OTZKYTUCSATTKK-OAHLLOKOSA-N 1 1 298.430 3.562 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc(Br)c1O ZINC000136818895 1134413656 /nfs/dbraw/zinc/41/36/56/1134413656.db2.gz UTPMLUXQIYZMQH-CMPLNLGQSA-N 1 1 298.224 3.918 20 10 CHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc(Br)c1O ZINC000136818895 1134413660 /nfs/dbraw/zinc/41/36/60/1134413660.db2.gz UTPMLUXQIYZMQH-CMPLNLGQSA-N 1 1 298.224 3.918 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)[C@@H](C)CO1 ZINC000403825813 1134877790 /nfs/dbraw/zinc/87/77/90/1134877790.db2.gz MLRPVNSDAAPNMU-DZGCQCFKSA-N 1 1 285.387 3.545 20 10 CHCDMO Cc1cc(C[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)on1 ZINC000315140352 1135152380 /nfs/dbraw/zinc/15/23/80/1135152380.db2.gz QSIWQIKDSFBONC-UHFFFAOYSA-N 1 1 295.386 3.680 20 10 CHCDMO CC(=O)c1cc(F)cc(C[NH+]2CCCCCCCC2)c1O ZINC000321795569 1135507897 /nfs/dbraw/zinc/50/78/97/1135507897.db2.gz WHNUDTJCGNMOOK-UHFFFAOYSA-N 1 1 293.382 3.890 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1c(F)cccc1F ZINC000037771883 260116385 /nfs/dbraw/zinc/11/63/85/260116385.db2.gz HRNPFIKKDYEKPB-LLVKDONJSA-N 1 1 289.325 3.751 20 10 CHCDMO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(F)cc1O ZINC000183981915 262003868 /nfs/dbraw/zinc/00/38/68/262003868.db2.gz HXOQJUXIYSAZJP-TZMCWYRMSA-N 1 1 281.371 3.531 20 10 CHCDMO CC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccccc1O ZINC000186100822 262080232 /nfs/dbraw/zinc/08/02/32/262080232.db2.gz OOUXEBMOQBYVMV-QGZVFWFLSA-N 1 1 290.451 3.553 20 10 CHCDMO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1O ZINC000186129139 262081097 /nfs/dbraw/zinc/08/10/97/262081097.db2.gz UUHSBRYFKFDLMN-GXTWGEPZSA-N 1 1 293.382 3.674 20 10 CHCDMO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000186156189 262081963 /nfs/dbraw/zinc/08/19/63/262081963.db2.gz VPGRKLAADQVIIB-GFCCVEGCSA-N 1 1 289.350 3.699 20 10 CHCDMO Oc1ccccc1C[N@@H+](CCCCCF)C[C@@H]1CCCO1 ZINC000284050825 263085591 /nfs/dbraw/zinc/08/55/91/263085591.db2.gz JPNZILVBUKICCR-INIZCTEOSA-N 1 1 295.398 3.513 20 10 CHCDMO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185351627 327838267 /nfs/dbraw/zinc/83/82/67/327838267.db2.gz USSFMZHWPPYQME-NEPJUHHUSA-N 1 1 289.350 3.519 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000289694706 521142357 /nfs/dbraw/zinc/14/23/57/521142357.db2.gz FTOKPHXVXONZEV-QGZVFWFLSA-N 1 1 298.386 3.523 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000289694704 521144907 /nfs/dbraw/zinc/14/49/07/521144907.db2.gz FTOKPHXVXONZEV-KRWDZBQOSA-N 1 1 298.386 3.523 20 10 CHCDMO CC[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1O ZINC000037786258 522559831 /nfs/dbraw/zinc/55/98/31/522559831.db2.gz YFCJBFVHCCLLKQ-INIZCTEOSA-N 1 1 290.451 3.696 20 10 CHCDMO CC[C@](C)([NH2+]Cc1ccc(OC)c(C)c1)c1nccs1 ZINC000265821830 523488210 /nfs/dbraw/zinc/48/82/10/523488210.db2.gz YDEQWUAAXDDHDH-INIZCTEOSA-N 1 1 290.432 3.875 20 10 CHCDMO CC[C@@](C)([NH2+]Cc1ccc(OC)c(C)c1)c1nccs1 ZINC000265821831 523658227 /nfs/dbraw/zinc/65/82/27/523658227.db2.gz YDEQWUAAXDDHDH-MRXNPFEDSA-N 1 1 290.432 3.875 20 10 CHCDMO Cc1ccsc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000094875172 525863077 /nfs/dbraw/zinc/86/30/77/525863077.db2.gz FMKDOGQLEVXKDV-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccccc1O ZINC000111235037 1125481109 /nfs/dbraw/zinc/48/11/09/1125481109.db2.gz FJQLSAFJVPGHCR-GFCCVEGCSA-N 1 1 259.324 3.724 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000133692311 1125484822 /nfs/dbraw/zinc/48/48/22/1125484822.db2.gz VDACMDCKHBIRGO-MRXNPFEDSA-N 1 1 267.372 3.690 20 10 CHCDMO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc(F)cc1O ZINC000186499788 1120241734 /nfs/dbraw/zinc/24/17/34/1120241734.db2.gz NSSAOMDIZMQTOJ-HZMBPMFUSA-N 1 1 281.371 3.528 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](CCF)C1 ZINC000689880404 1120352090 /nfs/dbraw/zinc/35/20/90/1120352090.db2.gz GNYACUJBCDKFAZ-LLVKDONJSA-N 1 1 271.763 3.617 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)CCSCC)c1 ZINC000093871049 1120892785 /nfs/dbraw/zinc/89/27/85/1120892785.db2.gz LSAOYPWQOBUHIX-CYBMUJFWSA-N 1 1 297.464 3.754 20 10 CHCDMO Oc1cccc(Br)c1C[N@H+]1CCC2(CCC2)C1 ZINC000862245929 1123793933 /nfs/dbraw/zinc/79/39/33/1123793933.db2.gz BUNLUSWSJKGYKY-UHFFFAOYSA-N 1 1 296.208 3.531 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@](C)(CF)C2)c(Cl)c1 ZINC001140922549 1131963004 /nfs/dbraw/zinc/96/30/04/1131963004.db2.gz UJIAKWBYNDTIRJ-HNNXBMFYSA-N 1 1 284.806 3.588 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@](C)(F)CC2)c(O)c1 ZINC001231842435 1132377495 /nfs/dbraw/zinc/37/74/95/1132377495.db2.gz LXMJKHPRTGZYBT-INIZCTEOSA-N 1 1 265.372 3.723 20 10 CHCDMO COC1(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841753363 1132392595 /nfs/dbraw/zinc/39/25/95/1132392595.db2.gz HGSBVAZASMRWQN-NSHDSACASA-N 1 1 283.799 3.655 20 10 CHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232268838 1132447129 /nfs/dbraw/zinc/44/71/29/1132447129.db2.gz TXBNHWANTZDGIE-GFCCVEGCSA-N 1 1 283.799 3.906 20 10 CHCDMO CC1(F)CC[NH+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001233415678 1132618770 /nfs/dbraw/zinc/61/87/70/1132618770.db2.gz FMVQTTYEQIGAOB-UHFFFAOYSA-N 1 1 291.288 3.735 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(Cl)cc1O ZINC000841755025 1125592979 /nfs/dbraw/zinc/59/29/79/1125592979.db2.gz FUUAJEIRJDTLRK-KKZNHRDASA-N 1 1 271.813 3.590 20 10 CHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)s1 ZINC000886505216 1125681197 /nfs/dbraw/zinc/68/11/97/1125681197.db2.gz QJECUMQPOQRSBG-JTQLQIEISA-N 1 1 265.353 3.752 20 10 CHCDMO COCc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886497059 1125681421 /nfs/dbraw/zinc/68/14/21/1125681421.db2.gz QFUWZLIJTHWMRL-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO COCc1ccccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886497135 1125681903 /nfs/dbraw/zinc/68/19/03/1125681903.db2.gz UGIDUIRADAGKOA-GFCCVEGCSA-N 1 1 289.350 3.529 20 10 CHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886512869 1125683082 /nfs/dbraw/zinc/68/30/82/1125683082.db2.gz ORXXLIBUAJSGJP-LBPRGKRZSA-N 1 1 289.350 3.781 20 10 CHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(C)c1 ZINC000886551777 1125689869 /nfs/dbraw/zinc/68/98/69/1125689869.db2.gz OHAQPDBMDCAUDB-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO Cc1csc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886618909 1125699673 /nfs/dbraw/zinc/69/96/73/1125699673.db2.gz OAYCOKISZHUOEN-SNVBAGLBSA-N 1 1 265.353 3.752 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1c(O)cccc1F ZINC000886634538 1125701386 /nfs/dbraw/zinc/70/13/86/1125701386.db2.gz GRSMLNJPAWNUGN-QWHCGFSZSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886648127 1125702407 /nfs/dbraw/zinc/70/24/07/1125702407.db2.gz MEKYAXZOPHSDTD-SWLSCSKDSA-N 1 1 293.382 3.674 20 10 CHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCCO1)c1c(O)cccc1F ZINC000886646592 1125702617 /nfs/dbraw/zinc/70/26/17/1125702617.db2.gz NHUOMJUOWFNWKR-UXEPBGEESA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(Cl)n1 ZINC000886651979 1125704500 /nfs/dbraw/zinc/70/45/00/1125704500.db2.gz WKACAHQKBZJOKI-SNVBAGLBSA-N 1 1 294.757 3.739 20 10 CHCDMO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1ccc(F)cc1O ZINC000886731125 1125713961 /nfs/dbraw/zinc/71/39/61/1125713961.db2.gz VSJFDMYTVHZVPX-TZMCWYRMSA-N 1 1 293.382 3.531 20 10 CHCDMO CC(C)Cc1ncc(C[N@@H+](C)Cc2ccccc2O)s1 ZINC000091974758 1125756368 /nfs/dbraw/zinc/75/63/68/1125756368.db2.gz YFZBAQIDCSZJBS-UHFFFAOYSA-N 1 1 290.432 3.679 20 10 CHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)CC1CCC1 ZINC001202740127 1125781655 /nfs/dbraw/zinc/78/16/55/1125781655.db2.gz SPHMPBVCAJJFQJ-UHFFFAOYSA-N 1 1 258.409 3.519 20 10 CHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000179553503 1126829321 /nfs/dbraw/zinc/82/93/21/1126829321.db2.gz ZDPAQWOQQCQYLZ-CYBMUJFWSA-N 1 1 259.374 3.791 20 10 CHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccccc2O)cc1 ZINC000179555690 1126829804 /nfs/dbraw/zinc/82/98/04/1126829804.db2.gz JLJUHTMMBGRRIW-ZDUSSCGKSA-N 1 1 271.360 3.594 20 10 CHCDMO Cc1cccc(C[N@H+](C)[C@H](C)c2cccs2)c1O ZINC000179713899 1126832835 /nfs/dbraw/zinc/83/28/35/1126832835.db2.gz LQIBHOVVIBBJKQ-GFCCVEGCSA-N 1 1 261.390 3.955 20 10 CHCDMO Cc1cccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000180703249 1126847462 /nfs/dbraw/zinc/84/74/62/1126847462.db2.gz VGCNRLDZEHAEKY-UHFFFAOYSA-N 1 1 287.325 3.865 20 10 CHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000814178882 1130834894 /nfs/dbraw/zinc/83/48/94/1130834894.db2.gz HJSVNAUOPBITJK-LLVKDONJSA-N 1 1 285.840 3.621 20 10 CHCDMO CCC(CC)n1ccc(C[N@H+](C)Cc2ccccc2O)n1 ZINC000269637263 1127043671 /nfs/dbraw/zinc/04/36/71/1127043671.db2.gz NEEQGWKJDQYMNY-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccccc2O)n1 ZINC000269637263 1127043673 /nfs/dbraw/zinc/04/36/73/1127043673.db2.gz NEEQGWKJDQYMNY-UHFFFAOYSA-N 1 1 287.407 3.582 20 10 CHCDMO C[C@]1(F)CCC[N@@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121161 1131056092 /nfs/dbraw/zinc/05/60/92/1131056092.db2.gz KLIURFUTRFTBBC-AWEZNQCLSA-N 1 1 289.753 3.899 20 10 CHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000163860846 1127145369 /nfs/dbraw/zinc/14/53/69/1127145369.db2.gz DHPONHLPQVYZJZ-AWEZNQCLSA-N 1 1 277.408 3.659 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCCCCC1 ZINC000816480799 1131099108 /nfs/dbraw/zinc/09/91/08/1131099108.db2.gz XMOILIMWBDNLIY-UHFFFAOYSA-N 1 1 257.736 3.561 20 10 CHCDMO C[C@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808951 1131142738 /nfs/dbraw/zinc/14/27/38/1131142738.db2.gz WUAWRJIYWFDTDH-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO CC[C@@H]([NH2+]Cc1cccc(OC)c1)c1ccc(F)cc1O ZINC000285532788 1127236042 /nfs/dbraw/zinc/23/60/42/1127236042.db2.gz FOZOLTYJTVIHKK-MRXNPFEDSA-N 1 1 289.350 3.781 20 10 CHCDMO CC[C@@H]([NH2+]Cc1sc(C)nc1C)c1ccc(F)cc1O ZINC000285975242 1127250272 /nfs/dbraw/zinc/25/02/72/1127250272.db2.gz HJMLHFNHPTZAMK-CYBMUJFWSA-N 1 1 294.395 3.846 20 10 CHCDMO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1ccc(F)cc1O ZINC000286161806 1127261334 /nfs/dbraw/zinc/26/13/34/1127261334.db2.gz PWJFRMSKBGUMBG-OAHLLOKOSA-N 1 1 295.398 3.779 20 10 CHCDMO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCCO1)c1ccc(F)cc1O ZINC000286202302 1127262532 /nfs/dbraw/zinc/26/25/32/1127262532.db2.gz RKKXCYLQEOIEMH-PJODQICGSA-N 1 1 281.371 3.530 20 10 CHCDMO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)cc2O)CCO1 ZINC000817586306 1131174512 /nfs/dbraw/zinc/17/45/12/1131174512.db2.gz NYRBNQRRXMZZQU-KGYLQXTDSA-N 1 1 283.799 3.654 20 10 CHCDMO C[N@@H+](CCCCC(F)(F)F)Cc1ccccc1O ZINC000157252322 1127293567 /nfs/dbraw/zinc/29/35/67/1127293567.db2.gz VKHKWDSTTJFWRY-UHFFFAOYSA-N 1 1 261.287 3.557 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@@H]2CC=CCC2)cc1 ZINC001168405349 1127427860 /nfs/dbraw/zinc/42/78/60/1127427860.db2.gz XJTRPQLFRSDJBL-MRXNPFEDSA-N 1 1 272.436 3.931 20 10 CHCDMO COc1cc(C[N@H+]2C[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308790387 1127477659 /nfs/dbraw/zinc/47/76/59/1127477659.db2.gz RRDXICHIXGHUPY-VXGBXAGGSA-N 1 1 277.408 3.539 20 10 CHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)C1CCCCC1 ZINC000060201713 1127508032 /nfs/dbraw/zinc/50/80/32/1127508032.db2.gz MMDFOWQVGSYRTD-UHFFFAOYSA-N 1 1 253.773 3.810 20 10 CHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000295210666 1127627839 /nfs/dbraw/zinc/62/78/39/1127627839.db2.gz LMLPEQCBPQHOIZ-RHSMWYFYSA-N 1 1 298.434 3.525 20 10 CHCDMO C[N@@H+](Cc1cc2c(cc1O)CCC2)C(C1CC1)C1CC1 ZINC000170727853 1127641518 /nfs/dbraw/zinc/64/15/18/1127641518.db2.gz XTBKXELBLJCSOJ-UHFFFAOYSA-N 1 1 271.404 3.501 20 10 CHCDMO Oc1c(F)cccc1C[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001138128687 1127771939 /nfs/dbraw/zinc/77/19/39/1127771939.db2.gz UXJOQXUEOOMVTH-CYBMUJFWSA-N 1 1 281.346 3.636 20 10 CHCDMO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000062745073 1127772508 /nfs/dbraw/zinc/77/25/08/1127772508.db2.gz LMEBTNSMXXWCGZ-CHWSQXEVSA-N 1 1 273.351 3.986 20 10 CHCDMO C[C@@H]([NH2+]CCc1ccccc1F)c1ccc(F)cc1O ZINC000062744821 1127772539 /nfs/dbraw/zinc/77/25/39/1127772539.db2.gz ZWSISWKARCTUSZ-LLVKDONJSA-N 1 1 277.314 3.564 20 10 CHCDMO C[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062746780 1127773791 /nfs/dbraw/zinc/77/37/91/1127773791.db2.gz FLSSAROSITXHSS-QWRGUYRKSA-N 1 1 279.380 3.875 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000373223214 1127828902 /nfs/dbraw/zinc/82/89/02/1127828902.db2.gz HFDOXKRDGIHTHR-HNNXBMFYSA-N 1 1 289.400 3.799 20 10 CHCDMO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233415846 1127959876 /nfs/dbraw/zinc/95/98/76/1127959876.db2.gz KIHUQGGIRSISCP-ONGXEEELSA-N 1 1 291.288 3.591 20 10 CHCDMO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc(F)cc1O ZINC000927064480 1128214424 /nfs/dbraw/zinc/21/44/24/1128214424.db2.gz VMZZNKTWAQRLAV-NHYWBVRUSA-N 1 1 286.350 3.655 20 10 CHCDMO C[C@H]([NH2+]CC[C@@H]1CCC2(CCC2)O1)c1c(O)cccc1F ZINC000927124005 1128219984 /nfs/dbraw/zinc/21/99/84/1128219984.db2.gz GOBNLSQAUMPQKU-STQMWFEESA-N 1 1 293.382 3.674 20 10 CHCDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccccc1O ZINC000777824987 1128288497 /nfs/dbraw/zinc/28/84/97/1128288497.db2.gz MPCLTEFAULIFBH-QGZVFWFLSA-N 1 1 285.387 3.984 20 10 CHCDMO CCOc1ccc(N(CC)CCCn2cc[nH+]c2C)cc1 ZINC000762927160 1128328008 /nfs/dbraw/zinc/32/80/08/1128328008.db2.gz ZZGKCMVHXKJIBU-UHFFFAOYSA-N 1 1 287.407 3.507 20 10 CHCDMO C[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccccc1O ZINC000931553506 1128368470 /nfs/dbraw/zinc/36/84/70/1128368470.db2.gz DQPBSBGJIYWLNR-LLVKDONJSA-N 1 1 274.364 3.529 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1 ZINC000780793938 1128476442 /nfs/dbraw/zinc/47/64/42/1128476442.db2.gz YXIMDSQOQOJZMW-YPMHNXCESA-N 1 1 287.325 3.863 20 10 CHCDMO C[N@@H+](Cc1cccc(Cl)c1)Cc1cc(F)ccc1O ZINC000778995839 1128675265 /nfs/dbraw/zinc/67/52/65/1128675265.db2.gz TTZUTNKYYNAJIH-UHFFFAOYSA-N 1 1 279.742 3.817 20 10 CHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccccc1C ZINC000160160437 1117747115 /nfs/dbraw/zinc/74/71/15/1117747115.db2.gz OZZQUVVRVFTPPS-LJQANCHMSA-N 1 1 299.414 3.646 20 10 CHCDMO COc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)ccc1C ZINC000185193218 1117781064 /nfs/dbraw/zinc/78/10/64/1117781064.db2.gz KGPQRYYSCLOFOR-LBPRGKRZSA-N 1 1 289.350 3.699 20 10 CHCDMO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1cc(F)ccc1O ZINC000185472195 1117828116 /nfs/dbraw/zinc/82/81/16/1117828116.db2.gz YDHCUGSVKSFKNS-WBMJQRKESA-N 1 1 296.430 3.548 20 10 CHCDMO C[C@@H](Cc1ccccc1)C[N@@H+](C)Cc1ccccc1O ZINC000753958312 1117898521 /nfs/dbraw/zinc/89/85/21/1117898521.db2.gz BPPMJVZEFSTUAW-HNNXBMFYSA-N 1 1 269.388 3.703 20 10 CHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccccc1O ZINC000179581754 1128748723 /nfs/dbraw/zinc/74/87/23/1128748723.db2.gz JSVGXGLRVLKIJL-ZDUSSCGKSA-N 1 1 253.345 3.512 20 10 CHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccs1 ZINC000042411801 1118033423 /nfs/dbraw/zinc/03/34/23/1118033423.db2.gz KYMJQIWDCVPWBT-UHFFFAOYSA-N 1 1 298.205 3.506 20 10 CHCDMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564696 1118074234 /nfs/dbraw/zinc/07/42/34/1118074234.db2.gz DIVBQGAHOYJBMM-QWRGUYRKSA-N 1 1 253.773 3.666 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](C)C(C)C ZINC001167241051 1118115185 /nfs/dbraw/zinc/11/51/85/1118115185.db2.gz OQZMSTRJLBEVPT-OAHLLOKOSA-N 1 1 262.441 3.927 20 10 CHCDMO COc1ccc([C@@H](C)C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000179770459 1128758248 /nfs/dbraw/zinc/75/82/48/1128758248.db2.gz HWDBFWQDGIXADM-AWEZNQCLSA-N 1 1 285.387 3.636 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2Cc3cccc(F)c3C2)c1O ZINC001140182504 1118250392 /nfs/dbraw/zinc/25/03/92/1118250392.db2.gz STSZRJMISIPJCW-UHFFFAOYSA-N 1 1 271.335 3.664 20 10 CHCDMO C[N@@H+](Cc1cc(F)ccc1O)[C@@H]1CCc2ccccc21 ZINC000179905777 1128765891 /nfs/dbraw/zinc/76/58/91/1128765891.db2.gz DTJXNQPEYWITBK-MRXNPFEDSA-N 1 1 271.335 3.651 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](C)C2)c1O ZINC000253061182 1118288517 /nfs/dbraw/zinc/28/85/17/1118288517.db2.gz DUKTWBBIIUXNLI-WDEREUQCSA-N 1 1 295.810 3.726 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)c1O ZINC000253061182 1118288522 /nfs/dbraw/zinc/28/85/22/1118288522.db2.gz DUKTWBBIIUXNLI-WDEREUQCSA-N 1 1 295.810 3.726 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000180076162 1128773970 /nfs/dbraw/zinc/77/39/70/1128773970.db2.gz LIYBTEGWUUCAAZ-CYBMUJFWSA-N 1 1 283.371 3.520 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000180076175 1128774124 /nfs/dbraw/zinc/77/41/24/1128774124.db2.gz LIYBTEGWUUCAAZ-ZDUSSCGKSA-N 1 1 283.371 3.520 20 10 CHCDMO Cc1cc(C[NH2+]Cc2cscn2)c(C)n1-c1ccccc1 ZINC000111625012 1118522337 /nfs/dbraw/zinc/52/23/37/1118522337.db2.gz PKHNGCUEPJOKMU-UHFFFAOYSA-N 1 1 297.427 3.840 20 10 CHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000180330589 1128787988 /nfs/dbraw/zinc/78/79/88/1128787988.db2.gz QOTAWQBBRRIBGD-CQSZACIVSA-N 1 1 293.407 3.564 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Br)[C@@H](C)C1 ZINC000707145796 1118648267 /nfs/dbraw/zinc/64/82/67/1118648267.db2.gz HJJZHDSLWDVUJY-MNOVXSKESA-N 1 1 298.224 3.775 20 10 CHCDMO Cc1cc(C[N@@H+]2CCC[C@@H]2C)ccc1N1CCCCC1 ZINC001167487152 1118717428 /nfs/dbraw/zinc/71/74/28/1118717428.db2.gz GNHUZSKWQJHJOW-INIZCTEOSA-N 1 1 272.436 3.970 20 10 CHCDMO C[N@@H+](CCc1cccc(F)c1)Cc1ccc(Cl)cc1O ZINC001140464279 1118734979 /nfs/dbraw/zinc/73/49/79/1118734979.db2.gz JKCVGJQZWCEZLD-UHFFFAOYSA-N 1 1 293.769 3.859 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001140465628 1118743007 /nfs/dbraw/zinc/74/30/07/1118743007.db2.gz OQBZERLYBRTLNN-UHFFFAOYSA-N 1 1 291.753 3.743 20 10 CHCDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140466060 1118745419 /nfs/dbraw/zinc/74/54/19/1118745419.db2.gz VRGCEIYQVAELLU-LBPRGKRZSA-N 1 1 287.790 3.992 20 10 CHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1O ZINC000132571407 1118852735 /nfs/dbraw/zinc/85/27/35/1118852735.db2.gz ZUWZCCVFWZOYTD-LBPRGKRZSA-N 1 1 265.397 3.657 20 10 CHCDMO COc1cccc(C[N@@H+](C)Cc2cccc(Cl)c2)c1O ZINC000161132169 1119006393 /nfs/dbraw/zinc/00/63/93/1119006393.db2.gz QDAURMRLBLKUHL-UHFFFAOYSA-N 1 1 291.778 3.686 20 10 CHCDMO CC[C@@]1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000190348377 1128819486 /nfs/dbraw/zinc/81/94/86/1128819486.db2.gz LKAFLFXWPJPDOC-SFHVURJKSA-N 1 1 285.387 3.546 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)C2CC(C)C2)c1 ZINC001236664122 1128862247 /nfs/dbraw/zinc/86/22/47/1128862247.db2.gz SKBTUSGGYGOHLW-UHFFFAOYSA-N 1 1 298.224 3.693 20 10 CHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)C2CC(C)C2)c1 ZINC001236664122 1128862252 /nfs/dbraw/zinc/86/22/52/1128862252.db2.gz SKBTUSGGYGOHLW-UHFFFAOYSA-N 1 1 298.224 3.693 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000179555607 1119751352 /nfs/dbraw/zinc/75/13/52/1119751352.db2.gz XLJPCZZMMHAVML-UHFFFAOYSA-N 1 1 253.345 3.557 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@H]2c2cccs2)c1O ZINC001140745380 1119793796 /nfs/dbraw/zinc/79/37/96/1119793796.db2.gz HSILNNVLWPAXCM-ZDUSSCGKSA-N 1 1 289.400 3.805 20 10 CHCDMO Cc1cc(O)c(C[N@@H+](C)CCOCC2CC2)cc1C(C)C ZINC000755945619 1119943509 /nfs/dbraw/zinc/94/35/09/1119943509.db2.gz CMEPFQLSNLPADZ-UHFFFAOYSA-N 1 1 291.435 3.682 20 10 CHCDMO Cc1csc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000921668375 1120062603 /nfs/dbraw/zinc/06/26/03/1120062603.db2.gz XSUPXAGDNFVTTO-LBPRGKRZSA-N 1 1 288.416 3.627 20 10 CHCDMO COc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2C)c(O)c1Cl ZINC001236811078 1128895494 /nfs/dbraw/zinc/89/54/94/1128895494.db2.gz GJCHJVANPLLCGQ-WDEREUQCSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2C)c(O)c1Cl ZINC001236811078 1128895499 /nfs/dbraw/zinc/89/54/99/1128895499.db2.gz GJCHJVANPLLCGQ-WDEREUQCSA-N 1 1 283.799 3.675 20 10 CHCDMO CCC[N@@H+](CCCC1CCOCC1)Cc1ccccc1O ZINC000765932640 1120217335 /nfs/dbraw/zinc/21/73/35/1120217335.db2.gz NGBHOEDQMRHFFF-UHFFFAOYSA-N 1 1 291.435 3.811 20 10 CHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(OC)ccc2O)C1 ZINC000180221382 1120269655 /nfs/dbraw/zinc/26/96/55/1120269655.db2.gz GMCNZQDWTOXVIH-HNNXBMFYSA-N 1 1 295.448 3.508 20 10 CHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000184864652 1120364550 /nfs/dbraw/zinc/36/45/50/1120364550.db2.gz MHMXJRJQDUGLIP-UHFFFAOYSA-N 1 1 289.419 3.771 20 10 CHCDMO Oc1ccc(Cl)cc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000069876804 1128912989 /nfs/dbraw/zinc/91/29/89/1128912989.db2.gz KXKMHNNPVYBDBW-UHFFFAOYSA-N 1 1 294.807 3.669 20 10 CHCDMO C[C@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000922836366 1120607572 /nfs/dbraw/zinc/60/75/72/1120607572.db2.gz JFPBDWLJZQFEIA-IUCAKERBSA-N 1 1 289.803 3.558 20 10 CHCDMO C[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1ccc(F)cc1O ZINC000195147334 1120615063 /nfs/dbraw/zinc/61/50/63/1120615063.db2.gz JHOJOBOBACFKTL-GFCCVEGCSA-N 1 1 296.345 3.930 20 10 CHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCOC1 ZINC000093839874 1120887320 /nfs/dbraw/zinc/88/73/20/1120887320.db2.gz WMEBTUYZOWJATP-OAHLLOKOSA-N 1 1 297.398 3.528 20 10 CHCDMO CCSCC[C@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000093871033 1120892737 /nfs/dbraw/zinc/89/27/37/1120892737.db2.gz JLSYXWMNDNERML-ZDUSSCGKSA-N 1 1 267.438 3.664 20 10 CHCDMO CCOc1cccc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1O ZINC000093867482 1120891807 /nfs/dbraw/zinc/89/18/07/1120891807.db2.gz PZVHFWPBAYRNFV-KBXCAEBGSA-N 1 1 297.398 3.984 20 10 CHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCC3CC3)c2c1 ZINC000162890416 1120908163 /nfs/dbraw/zinc/90/81/63/1120908163.db2.gz AOIVRDFNICLDLI-UHFFFAOYSA-N 1 1 285.387 3.786 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)c1 ZINC000251167492 1120963892 /nfs/dbraw/zinc/96/38/92/1120963892.db2.gz OTAORSCZHKPULD-GJZGRUSLSA-N 1 1 259.393 3.713 20 10 CHCDMO CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC)Cc1ccccc1O ZINC001167838924 1121041734 /nfs/dbraw/zinc/04/17/34/1121041734.db2.gz XDPOKZXVIXPMRB-MRXNPFEDSA-N 1 1 292.467 3.725 20 10 CHCDMO C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000220903302 1121127618 /nfs/dbraw/zinc/12/76/18/1121127618.db2.gz UZXNFEOTMGLMIW-UHFFFAOYSA-N 1 1 261.752 3.678 20 10 CHCDMO C[C@H]([NH2+]CC1CC(C)(C)C1)c1ccc(F)cc1O ZINC000701942922 1121174283 /nfs/dbraw/zinc/17/42/83/1121174283.db2.gz DAVHJKNGVXGVEV-JTQLQIEISA-N 1 1 251.345 3.618 20 10 CHCDMO Oc1cccc(F)c1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC001137831601 1121174596 /nfs/dbraw/zinc/17/45/96/1121174596.db2.gz HDOCRXPCRNQYRF-UHFFFAOYSA-N 1 1 299.389 3.986 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172718 1121183926 /nfs/dbraw/zinc/18/39/26/1121183926.db2.gz XOXFXVWVMDAPGB-SMDDNHRTSA-N 1 1 265.784 3.810 20 10 CHCDMO CCC[N@H+](Cc1c(O)ccc(F)c1Cl)CC1CC1 ZINC001237122484 1128979133 /nfs/dbraw/zinc/97/91/33/1128979133.db2.gz VBKAJHPGFWENCL-UHFFFAOYSA-N 1 1 271.763 3.807 20 10 CHCDMO Oc1ccc(F)c(Cl)c1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001237123789 1128981922 /nfs/dbraw/zinc/98/19/22/1128981922.db2.gz LGCPLBWEMYMJSA-MNOVXSKESA-N 1 1 283.774 3.807 20 10 CHCDMO CC[N@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137838695 1121421943 /nfs/dbraw/zinc/42/19/43/1121421943.db2.gz HSXLQRMTTSBYNG-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(O)cccc1F ZINC001137838695 1121421946 /nfs/dbraw/zinc/42/19/46/1121421946.db2.gz HSXLQRMTTSBYNG-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO Cc1ncoc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000894016310 1121455905 /nfs/dbraw/zinc/45/59/05/1121455905.db2.gz ANFNOMMCTSVROM-UHFFFAOYSA-N 1 1 286.375 3.633 20 10 CHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000192515848 1129000789 /nfs/dbraw/zinc/00/07/89/1129000789.db2.gz SQONFJWYBQBIRZ-QGZVFWFLSA-N 1 1 297.398 3.829 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H]2C=CCCC2)c1 ZINC001178059784 1121764174 /nfs/dbraw/zinc/76/41/74/1121764174.db2.gz KHLJJNGTMBYCDB-LBPRGKRZSA-N 1 1 296.208 3.661 20 10 CHCDMO C[N@@H+](CCCc1cccc(F)c1)Cc1ccccc1O ZINC000182873168 1129007960 /nfs/dbraw/zinc/00/79/60/1129007960.db2.gz HIOBQKVQNMIFAU-UHFFFAOYSA-N 1 1 273.351 3.596 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccsc2)cc1 ZINC000773729441 1121773400 /nfs/dbraw/zinc/77/34/00/1121773400.db2.gz CSYWTGNOQURONP-UHFFFAOYSA-N 1 1 274.433 3.836 20 10 CHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccccc2OC)cc1 ZINC000773733754 1121774210 /nfs/dbraw/zinc/77/42/10/1121774210.db2.gz LODBIYHMMFKTTL-UHFFFAOYSA-N 1 1 298.430 3.783 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2cc(C)no2)cc1 ZINC000773731743 1121774284 /nfs/dbraw/zinc/77/42/84/1121774284.db2.gz WRBFAVQINFZNOR-QGZVFWFLSA-N 1 1 299.418 3.776 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)C2CCC2)c1 ZINC001178425883 1121787573 /nfs/dbraw/zinc/78/75/73/1121787573.db2.gz KXAGARAJKLFRJJ-JTQLQIEISA-N 1 1 298.224 3.741 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCCOC(C)(C)C2)c1 ZINC001179935581 1121928349 /nfs/dbraw/zinc/92/83/49/1121928349.db2.gz BQEKNKREAMOCIT-UHFFFAOYSA-N 1 1 277.408 3.517 20 10 CHCDMO CCSCC[C@H](C)[N@@H+](C)Cc1c(C)cc(OC)cc1O ZINC001179962693 1121936958 /nfs/dbraw/zinc/93/69/58/1121936958.db2.gz QSOGNUCPDSYRON-ZDUSSCGKSA-N 1 1 297.464 3.673 20 10 CHCDMO CCC[C@]1(C)CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC001180203261 1121962834 /nfs/dbraw/zinc/96/28/34/1121962834.db2.gz NRXUDIMJMMRWMR-MRXNPFEDSA-N 1 1 265.372 3.934 20 10 CHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(F)F)c1O ZINC000815643674 1121971607 /nfs/dbraw/zinc/97/16/07/1121971607.db2.gz IIZOCGAEGDUTPS-MRVPVSSYSA-N 1 1 263.715 3.660 20 10 CHCDMO CCC[N@H+](Cc1ncc(C(C)C)o1)Cc1ccccc1O ZINC000733309092 1121975133 /nfs/dbraw/zinc/97/51/33/1121975133.db2.gz AGYDTHMEOVKQDQ-UHFFFAOYSA-N 1 1 288.391 3.916 20 10 CHCDMO CCC[N@@H+](Cc1ncc(C(C)C)o1)Cc1ccccc1O ZINC000733309092 1121975137 /nfs/dbraw/zinc/97/51/37/1121975137.db2.gz AGYDTHMEOVKQDQ-UHFFFAOYSA-N 1 1 288.391 3.916 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000733609738 1122000354 /nfs/dbraw/zinc/00/03/54/1122000354.db2.gz HXASFAPXLMUONC-QGZVFWFLSA-N 1 1 270.420 3.826 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001180673487 1122005260 /nfs/dbraw/zinc/00/52/60/1122005260.db2.gz OLAOFOVTMCWWLH-GFCCVEGCSA-N 1 1 296.405 3.899 20 10 CHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc2cnccc21 ZINC000183127201 1129024946 /nfs/dbraw/zinc/02/49/46/1129024946.db2.gz HGHVUCCVPRJQKM-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO Oc1ccc(F)cc1C[N@H+]1Cc2ccccc2C2(CCC2)C1 ZINC001181656677 1122068008 /nfs/dbraw/zinc/06/80/08/1122068008.db2.gz UFOJZFQBHXZANM-UHFFFAOYSA-N 1 1 297.373 3.969 20 10 CHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@H]2CC2(C)C)c1 ZINC001183085138 1122203033 /nfs/dbraw/zinc/20/30/33/1122203033.db2.gz VPRKMXYSMUQELY-OAHLLOKOSA-N 1 1 261.409 3.994 20 10 CHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623144 1122221035 /nfs/dbraw/zinc/22/10/35/1122221035.db2.gz ZFRNCQVXRZNZAU-BLLLJJGKSA-N 1 1 270.376 3.561 20 10 CHCDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623160 1122221243 /nfs/dbraw/zinc/22/12/43/1122221243.db2.gz ZFRNCQVXRZNZAU-WBMJQRKESA-N 1 1 270.376 3.561 20 10 CHCDMO CC1=CCC[C@H](C)[C@H]1C[N@H+]1Cc2cccc(O)c2C1 ZINC001183454575 1122224230 /nfs/dbraw/zinc/22/42/30/1122224230.db2.gz MHLFGBRQEDGYBA-ZFWWWQNUSA-N 1 1 257.377 3.700 20 10 CHCDMO Oc1cccc(F)c1C[NH2+]C/C=C\c1ccc(F)cc1F ZINC001183920028 1122248104 /nfs/dbraw/zinc/24/81/04/1122248104.db2.gz SUSHULIAHGAMRU-IHWYPQMZSA-N 1 1 293.288 3.613 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001203602261 1122303356 /nfs/dbraw/zinc/30/33/56/1122303356.db2.gz LSTGZLFKRPTXRI-ZIAGYGMSSA-N 1 1 277.408 3.659 20 10 CHCDMO Oc1ccc(Cl)cc1C[N@@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001203650743 1122415448 /nfs/dbraw/zinc/41/54/48/1122415448.db2.gz AAHMYQIVTFAGFR-PHIMTYICSA-N 1 1 287.737 3.523 20 10 CHCDMO C[N@H+](Cc1cc(F)ccc1O)Cc1cc(Cl)ccc1F ZINC000775126390 1122430928 /nfs/dbraw/zinc/43/09/28/1122430928.db2.gz USQNMKWYCMKQTE-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO C[N@@H+](Cc1cc(F)ccc1O)Cc1cc(Cl)ccc1F ZINC000775126390 1122430931 /nfs/dbraw/zinc/43/09/31/1122430931.db2.gz USQNMKWYCMKQTE-UHFFFAOYSA-N 1 1 297.732 3.956 20 10 CHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001190935119 1122560668 /nfs/dbraw/zinc/56/06/68/1122560668.db2.gz QEZFNWNIKGIJIX-QGZVFWFLSA-N 1 1 292.492 3.860 20 10 CHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232475 1122586637 /nfs/dbraw/zinc/58/66/37/1122586637.db2.gz IAEMVYMARYNBJA-GDBMZVCRSA-N 1 1 260.425 3.763 20 10 CHCDMO CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775484487 1122616623 /nfs/dbraw/zinc/61/66/23/1122616623.db2.gz CUVFLGLILICUIA-HNNXBMFYSA-N 1 1 296.842 3.572 20 10 CHCDMO CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H]2C)c1O ZINC001193392844 1122688711 /nfs/dbraw/zinc/68/87/11/1122688711.db2.gz NHDIZUGAGMWMFA-XPTSAGLGSA-N 1 1 281.783 3.526 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2cccc(O)c2)c1O ZINC000775633159 1122837818 /nfs/dbraw/zinc/83/78/18/1122837818.db2.gz FDFUIGPKBHBTRP-UHFFFAOYSA-N 1 1 291.778 3.692 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCn3cccc3[C@H]2C)c1O ZINC000775643185 1122850967 /nfs/dbraw/zinc/85/09/67/1122850967.db2.gz NTDZUOAEKRIYQO-GFCCVEGCSA-N 1 1 290.794 3.732 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCn3cccc3[C@H]2C)c1O ZINC000775643185 1122850971 /nfs/dbraw/zinc/85/09/71/1122850971.db2.gz NTDZUOAEKRIYQO-GFCCVEGCSA-N 1 1 290.794 3.732 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000775649082 1122863159 /nfs/dbraw/zinc/86/31/59/1122863159.db2.gz ZREYGZZCTQOPBT-SFHVURJKSA-N 1 1 281.399 3.908 20 10 CHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000775698785 1122911687 /nfs/dbraw/zinc/91/16/87/1122911687.db2.gz ZIOKSXZLBDZVOI-OAHLLOKOSA-N 1 1 279.449 3.808 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)CCS1 ZINC000775702311 1122914457 /nfs/dbraw/zinc/91/44/57/1122914457.db2.gz OQPYGBGLQUAGIN-CYBMUJFWSA-N 1 1 285.840 3.681 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCCC23CCCCC3)c1 ZINC000775724068 1122924590 /nfs/dbraw/zinc/92/45/90/1122924590.db2.gz CJIAUFCIUWFNRL-UHFFFAOYSA-N 1 1 275.392 3.700 20 10 CHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]2C(C)C)c1O ZINC000775766279 1122952443 /nfs/dbraw/zinc/95/24/43/1122952443.db2.gz VXCDUMBJKGJWMH-ZDUSSCGKSA-N 1 1 253.773 3.584 20 10 CHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2C2CCCCC2)cc1O ZINC001203880459 1122959975 /nfs/dbraw/zinc/95/99/75/1122959975.db2.gz SKTBQIZBGDXMPE-HNNXBMFYSA-N 1 1 275.392 3.643 20 10 CHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccccc1O ZINC000776014052 1123035223 /nfs/dbraw/zinc/03/52/23/1123035223.db2.gz QGVSAHASFPGBQN-ZYHUDNBSSA-N 1 1 273.298 3.555 20 10 CHCDMO Cc1cc(C[N@@H+]2CC[C@@H]2C)c(C)n1-c1ccccc1 ZINC001137853997 1123214257 /nfs/dbraw/zinc/21/42/57/1123214257.db2.gz DNKYANOPJAMAHZ-ZDUSSCGKSA-N 1 1 254.377 3.688 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1ccc(F)cc1O ZINC000850511825 1123278377 /nfs/dbraw/zinc/27/83/77/1123278377.db2.gz NYMSIYLOIVXHAS-BXKDBHETSA-N 1 1 280.368 3.790 20 10 CHCDMO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccc(F)cc1O ZINC000850536217 1123287307 /nfs/dbraw/zinc/28/73/07/1123287307.db2.gz IMVHCEXTBZLGIM-RNCFNFMXSA-N 1 1 273.298 3.617 20 10 CHCDMO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cc(F)cc(F)c1O ZINC000850553611 1123290169 /nfs/dbraw/zinc/29/01/69/1123290169.db2.gz ZMNDCSVJXLXHIP-CPCISQLKSA-N 1 1 291.288 3.612 20 10 CHCDMO C[C@H]([NH2+]CC(F)(F)c1ccc(F)cc1)c1ccccc1O ZINC000850562441 1123292671 /nfs/dbraw/zinc/29/26/71/1123292671.db2.gz UPMWBFSGZXEUNI-NSHDSACASA-N 1 1 295.304 3.974 20 10 CHCDMO CSc1cccc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000851840859 1123384356 /nfs/dbraw/zinc/38/43/56/1123384356.db2.gz JXYFVVVSWPBZFV-UHFFFAOYSA-N 1 1 273.401 3.746 20 10 CHCDMO CCCC[N@@H+](Cc1cccc(N)c1)Cc1ccccc1O ZINC000852018623 1123393421 /nfs/dbraw/zinc/39/34/21/1123393421.db2.gz ORWPTTMCGBJUMG-UHFFFAOYSA-N 1 1 284.403 3.777 20 10 CHCDMO CC1(C)CCC[C@@H]1C[NH2+]Cc1cc(F)c(F)cc1O ZINC001205951106 1123444230 /nfs/dbraw/zinc/44/42/30/1123444230.db2.gz HRPCXRVLGRAWHF-LLVKDONJSA-N 1 1 269.335 3.586 20 10 CHCDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1ccccc1O ZINC000112583741 1123494410 /nfs/dbraw/zinc/49/44/10/1123494410.db2.gz FQQLFDMOKBKPLT-UHFFFAOYSA-N 1 1 291.778 3.556 20 10 CHCDMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)n1 ZINC000113334664 1123521681 /nfs/dbraw/zinc/52/16/81/1123521681.db2.gz KRQJTFKSPAXPDX-LLVKDONJSA-N 1 1 293.411 3.507 20 10 CHCDMO C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1ccns1 ZINC000858575533 1123663665 /nfs/dbraw/zinc/66/36/65/1123663665.db2.gz AETKFYDQVOSCMV-YUMQZZPRSA-N 1 1 284.331 3.539 20 10 CHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C2CCCC2)[nH]c1C ZINC000862242314 1123794467 /nfs/dbraw/zinc/79/44/67/1123794467.db2.gz CGTBOJXVBJWJCS-UHFFFAOYSA-N 1 1 299.418 3.677 20 10 CHCDMO Cc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000862242497 1123794728 /nfs/dbraw/zinc/79/47/28/1123794728.db2.gz HMXLUNGDJNPKGD-UHFFFAOYSA-N 1 1 286.375 3.633 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1Cl ZINC000862473138 1123812464 /nfs/dbraw/zinc/81/24/64/1123812464.db2.gz FYFXWWKGMKWQNQ-OLZOCXBDSA-N 1 1 297.851 3.824 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000119380827 1123858335 /nfs/dbraw/zinc/85/83/35/1123858335.db2.gz SALXSSZFKOMOMW-AWEZNQCLSA-N 1 1 285.387 3.984 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC3(CCC3)C[C@@H]2C)c1 ZINC000763648403 1129154691 /nfs/dbraw/zinc/15/46/91/1129154691.db2.gz SHKQNVFREAZSDI-ZDUSSCGKSA-N 1 1 275.392 3.555 20 10 CHCDMO CC[C@H](NCC[NH+](C(C)C)C(C)C)c1ccc(C)cc1O ZINC000794792919 1123950980 /nfs/dbraw/zinc/95/09/80/1123950980.db2.gz HXZRNTSRHSVECN-KRWDZBQOSA-N 1 1 292.467 3.860 20 10 CHCDMO C[C@H](Nc1[nH]c2ccccc2[nH+]1)c1ccc(N(C)C)cc1 ZINC000302435254 1123968750 /nfs/dbraw/zinc/96/87/50/1123968750.db2.gz QHVWBXZOSCVPQQ-LBPRGKRZSA-N 1 1 280.375 3.802 20 10 CHCDMO Cc1cc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)on1 ZINC000865457418 1123985917 /nfs/dbraw/zinc/98/59/17/1123985917.db2.gz ZSONQZWFIWIGOR-UHFFFAOYSA-N 1 1 299.418 3.509 20 10 CHCDMO CC[C@@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(F)cc1O ZINC000840884352 1123996014 /nfs/dbraw/zinc/99/60/14/1123996014.db2.gz KWDRIGCBTUJNKM-SMDDNHRTSA-N 1 1 281.371 3.530 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1 ZINC000783592788 1124001537 /nfs/dbraw/zinc/00/15/37/1124001537.db2.gz KLDRFSWRTMLTFV-XKQJLSEDSA-N 1 1 289.419 3.801 20 10 CHCDMO C[C@H]([NH2+]CC[C@H]1CCSC1)c1ccc(Cl)cc1O ZINC000866403882 1124063625 /nfs/dbraw/zinc/06/36/25/1124063625.db2.gz SLDHLVWHHLXMKI-QWRGUYRKSA-N 1 1 285.840 3.839 20 10 CHCDMO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1ccc(F)cc1O ZINC000866478537 1124070144 /nfs/dbraw/zinc/07/01/44/1124070144.db2.gz JJTZMPOZQYYOCH-CQSZACIVSA-N 1 1 263.312 3.674 20 10 CHCDMO CC[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1)c1ccc(F)cc1O ZINC000872108384 1124684888 /nfs/dbraw/zinc/68/48/88/1124684888.db2.gz SPRWTHYPTUZOPN-MOWSHJCCSA-N 1 1 293.382 3.530 20 10 CHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872261326 1124699065 /nfs/dbraw/zinc/69/90/65/1124699065.db2.gz DMAHFRPWATVALZ-QGZVFWFLSA-N 1 1 289.419 3.624 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000872721387 1124727613 /nfs/dbraw/zinc/72/76/13/1124727613.db2.gz FOYCPQFUFMWBLJ-HUUCEWRRSA-N 1 1 299.439 3.730 20 10 CHCDMO CCCOc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)cc1C ZINC000873080200 1124736808 /nfs/dbraw/zinc/73/68/08/1124736808.db2.gz LEAPZMGLGPLSGI-INIZCTEOSA-N 1 1 299.418 3.674 20 10 CHCDMO CCCOc1ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1C ZINC000873129265 1124739513 /nfs/dbraw/zinc/73/95/13/1124739513.db2.gz JHZVKCPWTHEXDW-GOEBONIOSA-N 1 1 299.418 3.776 20 10 CHCDMO CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Cl)ccc1[O-] ZINC000873240334 1124755340 /nfs/dbraw/zinc/75/53/40/1124755340.db2.gz OFHCIGFENXOWIP-WHOFXGATSA-N 1 1 296.842 3.604 20 10 CHCDMO C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc2ccccc2c1[O-] ZINC000873271232 1124760683 /nfs/dbraw/zinc/76/06/83/1124760683.db2.gz FXOCVWWSDDCGIQ-UONOGXRCSA-N 1 1 298.430 3.584 20 10 CHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c(O)c1 ZINC000876637041 1124966801 /nfs/dbraw/zinc/96/68/01/1124966801.db2.gz PANJZIYPPAOXKI-QGZVFWFLSA-N 1 1 283.371 3.743 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(F)cc(F)c1F ZINC001137873705 1124980655 /nfs/dbraw/zinc/98/06/55/1124980655.db2.gz QMKRDSHCXMJNSG-UHFFFAOYSA-N 1 1 295.304 3.832 20 10 CHCDMO CSC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000877663830 1125061962 /nfs/dbraw/zinc/06/19/62/1125061962.db2.gz ZXBIVGMLOZTYOX-UHFFFAOYSA-N 1 1 289.803 3.512 20 10 CHCDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC000878242893 1125134273 /nfs/dbraw/zinc/13/42/73/1125134273.db2.gz WSHAYIXOLUHZTA-HKUYNNGSSA-N 1 1 297.398 3.744 20 10 CHCDMO C[C@H]([NH2+]Cc1cccc2cccnc21)c1ccc(F)cc1O ZINC000127653782 1125208297 /nfs/dbraw/zinc/20/82/97/1125208297.db2.gz UBOWDLGXQPJEDN-LBPRGKRZSA-N 1 1 296.345 3.930 20 10 CHCDMO C[C@@H]1CCCCC[N@@H+]1Cc1cccc(Br)c1O ZINC000211522580 1125308783 /nfs/dbraw/zinc/30/87/83/1125308783.db2.gz UZNANUFAHAQZLK-LLVKDONJSA-N 1 1 298.224 3.919 20 10 CHCDMO C[C@@H]1CCCCC[N@H+]1Cc1cccc(Br)c1O ZINC000211522580 1125308788 /nfs/dbraw/zinc/30/87/88/1125308788.db2.gz UZNANUFAHAQZLK-LLVKDONJSA-N 1 1 298.224 3.919 20 10 CHCDMO CCC1CCC([N@@H+](C)Cc2cc3c(cc2O)OCO3)CC1 ZINC000109745946 1125358783 /nfs/dbraw/zinc/35/87/83/1125358783.db2.gz BHMNWNDMQNWBII-UHFFFAOYSA-N 1 1 291.391 3.522 20 10 CHCDMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)o1 ZINC000882903821 1125361381 /nfs/dbraw/zinc/36/13/81/1125361381.db2.gz KKZLPNCKDXWDNS-ZANVPECISA-N 1 1 293.313 3.677 20 10 CHCDMO CCC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccn1 ZINC000882979040 1125365338 /nfs/dbraw/zinc/36/53/38/1125365338.db2.gz LMFBBQPBCXUKIJ-CQSZACIVSA-N 1 1 292.329 3.696 20 10 CHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000883013819 1125368276 /nfs/dbraw/zinc/36/82/76/1125368276.db2.gz ATHGABLNXPDTFB-UHFFFAOYSA-N 1 1 293.288 3.588 20 10 CHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000131355578 1125388191 /nfs/dbraw/zinc/38/81/91/1125388191.db2.gz CHADITSYWFMZRV-ZDUSSCGKSA-N 1 1 293.382 3.602 20 10 CHCDMO COc1cccc(C[N@@H+](C)C2CCCCCC2)c1O ZINC000132358005 1125417598 /nfs/dbraw/zinc/41/75/98/1125417598.db2.gz OSSDNODKFJGRES-UHFFFAOYSA-N 1 1 263.381 3.555 20 10 CHCDMO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(F)c(Cl)cc1O ZINC001237947512 1129225430 /nfs/dbraw/zinc/22/54/30/1129225430.db2.gz QIUVRLSLORTTJW-NXEZZACHSA-N 1 1 271.763 3.948 20 10 CHCDMO Cc1cccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000736945886 1129381875 /nfs/dbraw/zinc/38/18/75/1129381875.db2.gz UOMNEZLOMHYTEQ-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CC(C)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000248058537 1129399758 /nfs/dbraw/zinc/39/97/58/1129399758.db2.gz PBOJQROKVZFGIP-UHFFFAOYSA-N 1 1 260.425 3.765 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000092781213 1129407791 /nfs/dbraw/zinc/40/77/91/1129407791.db2.gz MWTROSDFHCFESE-MRXNPFEDSA-N 1 1 275.392 3.555 20 10 CHCDMO COc1cccc(C[N@H+]2CCC3(C2)CCCCC3)c1O ZINC000093663734 1129426687 /nfs/dbraw/zinc/42/66/87/1129426687.db2.gz IOLKTHCZVOCSML-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CCN(C)c1ccc(C[N@H+]2CCc3sccc3C2)cc1 ZINC000741752667 1129451303 /nfs/dbraw/zinc/45/13/03/1129451303.db2.gz DRQMRKWAONQTHJ-UHFFFAOYSA-N 1 1 286.444 3.763 20 10 CHCDMO CC1=C(C)C[N@H+](Cc2cccc(Br)c2O)CC1 ZINC000796019436 1129462881 /nfs/dbraw/zinc/46/28/81/1129462881.db2.gz BDBNPZGUSCGOMM-UHFFFAOYSA-N 1 1 296.208 3.697 20 10 CHCDMO CC1=C(C)C[N@@H+](Cc2cccc(Br)c2O)CC1 ZINC000796019436 1129462884 /nfs/dbraw/zinc/46/28/84/1129462884.db2.gz BDBNPZGUSCGOMM-UHFFFAOYSA-N 1 1 296.208 3.697 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)cc1C(C)C ZINC000742166808 1129468388 /nfs/dbraw/zinc/46/83/88/1129468388.db2.gz RFIZVUYHMQHMKU-IYBDPMFKSA-N 1 1 273.420 3.912 20 10 CHCDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154176 1129468453 /nfs/dbraw/zinc/46/84/53/1129468453.db2.gz FBUNGRJJXAUDBA-KGLIPLIRSA-N 1 1 284.403 3.951 20 10 CHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828273134 1131381675 /nfs/dbraw/zinc/38/16/75/1131381675.db2.gz IADNUJSYFGDYPP-HNNXBMFYSA-N 1 1 290.451 3.532 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(C)cn2)cc1 ZINC000746296371 1129630437 /nfs/dbraw/zinc/63/04/37/1129630437.db2.gz KRTKIZXQEUPAFG-UHFFFAOYSA-N 1 1 297.446 3.868 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)c2cnccn2)cc1 ZINC000767299426 1129784732 /nfs/dbraw/zinc/78/47/32/1129784732.db2.gz PVBFHJABKJBDAS-OAHLLOKOSA-N 1 1 298.434 3.516 20 10 CHCDMO CCOc1ccc(C[N@@H+]([C@@H](C)C(C)C)C2CC2)c(O)c1 ZINC000768137180 1129834760 /nfs/dbraw/zinc/83/47/60/1129834760.db2.gz HHIQKHSAHHICKV-ZDUSSCGKSA-N 1 1 277.408 3.800 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCCCC2)cc1F ZINC000768138489 1129835277 /nfs/dbraw/zinc/83/52/77/1129835277.db2.gz LXQXDVBQFMIUGU-UHFFFAOYSA-N 1 1 264.388 3.656 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000768231119 1129845558 /nfs/dbraw/zinc/84/55/58/1129845558.db2.gz VGYDOGFDHZLLHF-SFHVURJKSA-N 1 1 281.399 3.908 20 10 CHCDMO COc1cccc(C[N@@H+](Cc2ccccc2C)C2CC2)c1O ZINC000768252343 1129846529 /nfs/dbraw/zinc/84/65/29/1129846529.db2.gz JXHAOQGFDSQWMY-UHFFFAOYSA-N 1 1 297.398 3.874 20 10 CHCDMO CC[N@@H+](CCOC)Cc1cc(-c2ccccc2)ccc1O ZINC000768253193 1129846846 /nfs/dbraw/zinc/84/68/46/1129846846.db2.gz VYKNJQDCALZZDP-UHFFFAOYSA-N 1 1 285.387 3.528 20 10 CHCDMO Cc1occc1C[N@@H+](C)Cc1c(O)cccc1Cl ZINC000119127724 1129847355 /nfs/dbraw/zinc/84/73/55/1129847355.db2.gz FWKPJNLIAQGDSR-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO Cc1occc1C[N@H+](C)Cc1c(O)cccc1Cl ZINC000119127724 1129847361 /nfs/dbraw/zinc/84/73/61/1129847361.db2.gz FWKPJNLIAQGDSR-UHFFFAOYSA-N 1 1 265.740 3.579 20 10 CHCDMO CCOc1ccc(C[N@@H+](Cc2ccco2)C(C)C)c(O)c1 ZINC000768251118 1129847658 /nfs/dbraw/zinc/84/76/58/1129847658.db2.gz ZSILCASIYOYVHC-UHFFFAOYSA-N 1 1 289.375 3.795 20 10 CHCDMO Cc1cccc(C[N@H+](C)Cc2cc(C)ccc2O)c1 ZINC000768262877 1129847913 /nfs/dbraw/zinc/84/79/13/1129847913.db2.gz LGRHABKJSPRSMC-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c1 ZINC000768261224 1129849182 /nfs/dbraw/zinc/84/91/82/1129849182.db2.gz AFAOMFMVSACQIQ-HIFRSBDPSA-N 1 1 277.408 3.801 20 10 CHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000768354141 1129853431 /nfs/dbraw/zinc/85/34/31/1129853431.db2.gz FPFHJKHWDUVJJZ-INIZCTEOSA-N 1 1 298.386 3.523 20 10 CHCDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)c(O)cc1C ZINC000768444428 1129857380 /nfs/dbraw/zinc/85/73/80/1129857380.db2.gz YIEOPASCHRSNBR-MRXNPFEDSA-N 1 1 289.419 3.864 20 10 CHCDMO CC[N@@H+](Cc1cc2c(cc1O)CCCC2)C1CCC1 ZINC000768447306 1129857815 /nfs/dbraw/zinc/85/78/15/1129857815.db2.gz OCUBGZAYILTRKB-UHFFFAOYSA-N 1 1 259.393 3.645 20 10 CHCDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c(O)cc1C ZINC000768467097 1129858908 /nfs/dbraw/zinc/85/89/08/1129858908.db2.gz YKTUGBRXJYHJPN-LIRRHRJNSA-N 1 1 297.398 3.902 20 10 CHCDMO C[C@H](C1CC1)[N@@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000768532884 1129860910 /nfs/dbraw/zinc/86/09/10/1129860910.db2.gz QCEIRGVPWOQJOR-GFCCVEGCSA-N 1 1 276.399 3.655 20 10 CHCDMO COCC[C@H]1CCCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768539738 1129861463 /nfs/dbraw/zinc/86/14/63/1129861463.db2.gz BROZZSDMSNSYMK-CYBMUJFWSA-N 1 1 297.826 3.684 20 10 CHCDMO CCOc1ccc(C[N@@H+]([C@H](C)C2CC2)C2CC2)c(O)c1 ZINC000768533358 1129861809 /nfs/dbraw/zinc/86/18/09/1129861809.db2.gz VTWWXQNEIFEFCN-GFCCVEGCSA-N 1 1 275.392 3.554 20 10 CHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000768544021 1129863544 /nfs/dbraw/zinc/86/35/44/1129863544.db2.gz MJVYXTZXBWTPMO-LBPRGKRZSA-N 1 1 265.397 3.657 20 10 CHCDMO C[N@@H+](CCSC1CCCCC1)Cc1ccccc1O ZINC000800355622 1129868295 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Cc1ccc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000769404222 1129906756 /nfs/dbraw/zinc/90/67/56/1129906756.db2.gz KTDDPUSNTSQNNS-IJEWVQPXSA-N 1 1 259.393 3.854 20 10 CHCDMO Cc1ccc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000769404215 1129906975 /nfs/dbraw/zinc/90/69/75/1129906975.db2.gz KTDDPUSNTSQNNS-FMKPAKJESA-N 1 1 259.393 3.854 20 10 CHCDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cccc(OC)c1O ZINC000769428950 1129908072 /nfs/dbraw/zinc/90/80/72/1129908072.db2.gz XGHZVVQWIJTRGA-KRWDZBQOSA-N 1 1 297.398 3.910 20 10 CHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H](OC)C2)cc1 ZINC000769452534 1129911284 /nfs/dbraw/zinc/91/12/84/1129911284.db2.gz VZZNYTNIQXOCTG-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000769470969 1129912646 /nfs/dbraw/zinc/91/26/46/1129912646.db2.gz PJASNOMUHAWEBT-JKSUJKDBSA-N 1 1 272.436 3.907 20 10 CHCDMO CCOc1ccc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC000769540459 1129913158 /nfs/dbraw/zinc/91/31/58/1129913158.db2.gz PZPBMULNHSFILF-LIRRHRJNSA-N 1 1 297.398 3.984 20 10 CHCDMO CCOc1ccc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c(O)c1 ZINC000769540456 1129913347 /nfs/dbraw/zinc/91/33/47/1129913347.db2.gz PZPBMULNHSFILF-AUUYWEPGSA-N 1 1 297.398 3.984 20 10 CHCDMO CC(C)[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCS1 ZINC000769550349 1129917173 /nfs/dbraw/zinc/91/71/73/1129917173.db2.gz RFLJBUDGTIYWKO-AWEZNQCLSA-N 1 1 285.840 3.619 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2ccccc2O)[C@H]2CCCC[C@@H]12 ZINC000770510090 1129947878 /nfs/dbraw/zinc/94/78/78/1129947878.db2.gz XHJMBYSYLJYJDF-KBMXLJTQSA-N 1 1 259.393 3.793 20 10 CHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000770505280 1129948047 /nfs/dbraw/zinc/94/80/47/1129948047.db2.gz NIEKWBKHMVGUBL-KRWDZBQOSA-N 1 1 269.388 3.845 20 10 CHCDMO COc1ccc(N2CCC[N@H+]([C@H](C)CC(C)C)CC2)cc1 ZINC000770509371 1129948793 /nfs/dbraw/zinc/94/87/93/1129948793.db2.gz LONDMFXFYCUZFI-MRXNPFEDSA-N 1 1 290.451 3.642 20 10 CHCDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1ccccc1O ZINC000770510857 1129948857 /nfs/dbraw/zinc/94/88/57/1129948857.db2.gz SIXBAWJQQHFQHH-XJKSGUPXSA-N 1 1 285.362 3.909 20 10 CHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000770511021 1129949099 /nfs/dbraw/zinc/94/90/99/1129949099.db2.gz VRSQMNOOIDXNTM-CYBMUJFWSA-N 1 1 271.335 3.521 20 10 CHCDMO C[N@@H+](CCCCc1ccccc1)Cc1ccccc1O ZINC000770509818 1129949161 /nfs/dbraw/zinc/94/91/61/1129949161.db2.gz UHWQUPUFLDNSAZ-UHFFFAOYSA-N 1 1 269.388 3.847 20 10 CHCDMO Oc1ccccc1C[N@@H+](Cc1ccoc1)Cc1ccco1 ZINC000771924913 1129995134 /nfs/dbraw/zinc/99/51/34/1129995134.db2.gz RRXXPWSLOTWGSA-UHFFFAOYSA-N 1 1 283.327 3.781 20 10 CHCDMO Oc1ccccc1C[N@H+](Cc1ccoc1)Cc1ccco1 ZINC000771924913 1129995135 /nfs/dbraw/zinc/99/51/35/1129995135.db2.gz RRXXPWSLOTWGSA-UHFFFAOYSA-N 1 1 283.327 3.781 20 10 CHCDMO CCO[C@@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000771934513 1129996597 /nfs/dbraw/zinc/99/65/97/1129996597.db2.gz ARMXMGWRFAFCLJ-GOSISDBHSA-N 1 1 290.451 3.534 20 10 CHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000771941322 1129997596 /nfs/dbraw/zinc/99/75/96/1129997596.db2.gz ZYVHFBMNQWYDBO-KRWDZBQOSA-N 1 1 283.371 3.738 20 10 CHCDMO C[C@@H](Nc1cc[nH+]c2ccsc21)c1ccc(N(C)C)cc1 ZINC000772297910 1130016363 /nfs/dbraw/zinc/01/63/63/1130016363.db2.gz OUBZAWMQURBPGS-GFCCVEGCSA-N 1 1 297.427 3.957 20 10 CHCDMO CCCC[N@H+](Cc1ccccc1O)Cc1cccnc1C ZINC000802657825 1130027619 /nfs/dbraw/zinc/02/76/19/1130027619.db2.gz VGEYXORTAXWTCZ-UHFFFAOYSA-N 1 1 284.403 3.898 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@H+]2C[C@H]1CCO[C@H](C)C1 ZINC000785762721 1130054510 /nfs/dbraw/zinc/05/45/10/1130054510.db2.gz XVJNRZJZKHHIPC-CABCVRRESA-N 1 1 289.419 3.653 20 10 CHCDMO COc1ccc2c(c1)CCCC[N@@H+]2C[C@H]1CCO[C@H](C)C1 ZINC000785762721 1130054515 /nfs/dbraw/zinc/05/45/15/1130054515.db2.gz XVJNRZJZKHHIPC-CABCVRRESA-N 1 1 289.419 3.653 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(O)cc2)cc1 ZINC000785970478 1130070954 /nfs/dbraw/zinc/07/09/54/1130070954.db2.gz GZGQSNMHVPJLIS-UHFFFAOYSA-N 1 1 298.430 3.870 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC(C)(C)OC)cc1 ZINC000787151624 1130132633 /nfs/dbraw/zinc/13/26/33/1130132633.db2.gz IQQYWUCKPWLXSY-UHFFFAOYSA-N 1 1 292.467 3.780 20 10 CHCDMO C[C@H]([NH2+][C@@H]1c2ccccc2OC[C@@H]1F)c1ccccc1O ZINC000903271358 1130142658 /nfs/dbraw/zinc/14/26/58/1130142658.db2.gz IJVHXEBYZLSFBF-PZSREKOKSA-N 1 1 287.334 3.515 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1cncs1)c1ccc(F)cc1O ZINC000903309347 1130150776 /nfs/dbraw/zinc/15/07/76/1130150776.db2.gz DQRVRTBBOVQVPS-SKDRFNHKSA-N 1 1 280.368 3.790 20 10 CHCDMO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1c(O)cccc1F ZINC000903335433 1130160685 /nfs/dbraw/zinc/16/06/85/1130160685.db2.gz PCMQLBLJLSFAAH-APPDUMDISA-N 1 1 286.350 3.728 20 10 CHCDMO C[C@@H]([NH2+][C@@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788806991 1130210500 /nfs/dbraw/zinc/21/05/00/1130210500.db2.gz RAIDYMSIHLKDRC-RKDXNWHRSA-N 1 1 291.338 3.567 20 10 CHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1c(O)ccc2ccncc21 ZINC000748263750 1130226466 /nfs/dbraw/zinc/22/64/66/1130226466.db2.gz XRTNSLLPVJQQJD-CYBMUJFWSA-N 1 1 272.392 3.808 20 10 CHCDMO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001170103190 1130246394 /nfs/dbraw/zinc/24/63/94/1130246394.db2.gz DMSDDSUQIZJJTK-CMPLNLGQSA-N 1 1 290.794 3.872 20 10 CHCDMO CC1(C)CC[N@@H+](Cc2cc(Cl)ccc2O)CCS1 ZINC000789763636 1130275115 /nfs/dbraw/zinc/27/51/15/1130275115.db2.gz NPEXCABFUPYAAZ-UHFFFAOYSA-N 1 1 285.840 3.763 20 10 CHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cccc(F)c1 ZINC000790946735 1130339633 /nfs/dbraw/zinc/33/96/33/1130339633.db2.gz HMPDFODCJPKBLX-UHFFFAOYSA-N 1 1 297.732 3.656 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1(OC)CCCC1 ZINC000792156380 1130432258 /nfs/dbraw/zinc/43/22/58/1130432258.db2.gz BUTIPZYKHCLULY-UHFFFAOYSA-N 1 1 290.451 3.534 20 10 CHCDMO Cc1ccnc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000792206588 1130439022 /nfs/dbraw/zinc/43/90/22/1130439022.db2.gz PGMQYTIGOUVALD-UHFFFAOYSA-N 1 1 295.430 3.621 20 10 CHCDMO CN(C)c1ccc(C[N@@H+](C)CC2CC2)c(C(F)(F)F)c1 ZINC000792793522 1130497206 /nfs/dbraw/zinc/49/72/06/1130497206.db2.gz QSIJFGSVOPIYKV-UHFFFAOYSA-N 1 1 286.341 3.613 20 10 CHCDMO C[C@]1(CC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1(F)F ZINC000827260079 1130529451 /nfs/dbraw/zinc/52/94/51/1130529451.db2.gz KNRUEVIGHARMAG-LBPRGKRZSA-N 1 1 293.716 3.710 20 10 CHCDMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccccc3O)C2)c(C)c1 ZINC000793232088 1130532735 /nfs/dbraw/zinc/53/27/35/1130532735.db2.gz IMHCFRGJINGAGF-INIZCTEOSA-N 1 1 281.399 3.999 20 10 CHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000793231272 1130533344 /nfs/dbraw/zinc/53/33/44/1130533344.db2.gz LXVWIFMHYQCPIC-WCQYABFASA-N 1 1 287.325 3.782 20 10 CHCDMO Cc1ccc(O)c(C[N@@H+](CC2CC2)CC2CCC2)c1 ZINC000793390292 1130551566 /nfs/dbraw/zinc/55/15/66/1130551566.db2.gz NVRWCGDFWIYCTC-UHFFFAOYSA-N 1 1 259.393 3.713 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCCCO2)cc1 ZINC000759644398 1130665775 /nfs/dbraw/zinc/66/57/75/1130665775.db2.gz SKVAWVAHNHWESO-SFHVURJKSA-N 1 1 290.451 3.534 20 10 CHCDMO CCC[N@@H+](CCc1ccncc1C)Cc1ccccc1O ZINC000827959379 1130680639 /nfs/dbraw/zinc/68/06/39/1130680639.db2.gz SRRJIDFRUJVZER-UHFFFAOYSA-N 1 1 284.403 3.550 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C(C)C)[C@H]2CCOC2)cc1C(C)C ZINC000812290152 1130682549 /nfs/dbraw/zinc/68/25/49/1130682549.db2.gz AFFJNONUZPACJT-INIZCTEOSA-N 1 1 291.435 3.823 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2CC[C@@H](C)C2)c1 ZINC000780578576 1130684562 /nfs/dbraw/zinc/68/45/62/1130684562.db2.gz XMAHNZKDSDIZRA-BXKDBHETSA-N 1 1 298.224 3.741 20 10 CHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2CC[C@H](C)C2)c1 ZINC000780578608 1130684598 /nfs/dbraw/zinc/68/45/98/1130684598.db2.gz XMAHNZKDSDIZRA-JOYOIKCWSA-N 1 1 298.224 3.741 20 10 CHCDMO CCC[N@@H+](CCC(=O)CC(C)C)Cc1ccccc1O ZINC000827959079 1130684665 /nfs/dbraw/zinc/68/46/65/1130684665.db2.gz KKUIPZPGPWCENT-UHFFFAOYSA-N 1 1 277.408 3.610 20 10 CHCDMO Oc1c(C[N@H+]2C[C@H]3[C@H](CF)[C@H]3C2)cccc1-c1ccccc1 ZINC001234999715 1130699851 /nfs/dbraw/zinc/69/98/51/1130699851.db2.gz YAVXDNORJUSSKT-NNZMDNLPSA-N 1 1 297.373 3.707 20 10 CHCDMO CC[N@@H+](CCOC)Cc1cccc(-c2ccccc2)c1O ZINC001234992921 1130700536 /nfs/dbraw/zinc/70/05/36/1130700536.db2.gz TVFPSVSFHIHMDK-UHFFFAOYSA-N 1 1 285.387 3.528 20 10 CHCDMO CC(C)[N@@H+](CCCO)Cc1cccc(-c2ccccc2)c1O ZINC001234996693 1130700892 /nfs/dbraw/zinc/70/08/92/1130700892.db2.gz MNCIEXCGOWWGMH-UHFFFAOYSA-N 1 1 299.414 3.652 20 10 CHCDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(N)cc1 ZINC001235443866 1130744980 /nfs/dbraw/zinc/74/49/80/1130744980.db2.gz POSPJXZJOYCMKQ-SFHVURJKSA-N 1 1 266.388 3.914 20 10 CHCDMO CC1CC([N@@H+](C)Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235675900 1130765450 /nfs/dbraw/zinc/76/54/50/1130765450.db2.gz LSOSCGXFBOGVLT-UHFFFAOYSA-N 1 1 261.409 3.920 20 10 CHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2O)[C@@H](C)C1 ZINC001235682438 1130767344 /nfs/dbraw/zinc/76/73/44/1130767344.db2.gz WTYZOFLAIUAOEV-XJKSGUPXSA-N 1 1 291.435 3.689 20 10 CHCDMO COCC[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C(C)C ZINC001235681683 1130768523 /nfs/dbraw/zinc/76/85/23/1130768523.db2.gz CFYDLQCZMHHEIH-UHFFFAOYSA-N 1 1 279.424 3.547 20 10 CHCDMO Nc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1 ZINC001235718159 1130772835 /nfs/dbraw/zinc/77/28/35/1130772835.db2.gz FIXXJCHLMKPYNC-QGZVFWFLSA-N 1 1 270.351 3.745 20 10 CHCDMO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000783598517 1130842008 /nfs/dbraw/zinc/84/20/08/1130842008.db2.gz VJFDPIINCGYLKE-HNNXBMFYSA-N 1 1 296.414 3.536 20 10 CHCDMO COc1ccc(O)c(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000783746013 1130852300 /nfs/dbraw/zinc/85/23/00/1130852300.db2.gz UEPWYZFYPDZUFE-UHFFFAOYSA-N 1 1 275.392 3.557 20 10 CHCDMO CCc1nc(C[NH2+][C@H](CC)c2ccc(F)cc2O)cs1 ZINC000796754764 1130928668 /nfs/dbraw/zinc/92/86/68/1130928668.db2.gz LBXQEBDMPIFPQC-CYBMUJFWSA-N 1 1 294.395 3.791 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccc(F)cc1O ZINC000796787583 1130932640 /nfs/dbraw/zinc/93/26/40/1130932640.db2.gz OORDGFCUKNRGHS-BXUZGUMPSA-N 1 1 283.387 3.776 20 10 CHCDMO CC[C@@H]([NH2+]C[C@@H]1CC1(C)C)c1ccc(F)cc1O ZINC000796824508 1130935588 /nfs/dbraw/zinc/93/55/88/1130935588.db2.gz HUNUMBMQJPFKFD-GXFFZTMASA-N 1 1 251.345 3.618 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CC1(C)C)c1ccc(F)cc1O ZINC000796824511 1130936112 /nfs/dbraw/zinc/93/61/12/1130936112.db2.gz HUNUMBMQJPFKFD-MFKMUULPSA-N 1 1 251.345 3.618 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1ccc[nH]1)c1ccc(F)cc1O ZINC000796846804 1130938706 /nfs/dbraw/zinc/93/87/06/1130938706.db2.gz QJLQFZLCDPWZBC-MFKMUULPSA-N 1 1 262.328 3.661 20 10 CHCDMO CC[C@@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1ccc(F)cc1O ZINC000796980795 1130950154 /nfs/dbraw/zinc/95/01/54/1130950154.db2.gz APRHHMPPMKWNNP-YCPHGPKFSA-N 1 1 281.371 3.530 20 10 CHCDMO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)ccc1N(C)C ZINC000815060790 1130954562 /nfs/dbraw/zinc/95/45/62/1130954562.db2.gz SMUVVXFNEHDHLG-LJQANCHMSA-N 1 1 295.430 3.793 20 10 CHCDMO Cc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)ccc1N(C)C ZINC000815059642 1130954632 /nfs/dbraw/zinc/95/46/32/1130954632.db2.gz GAJXWLWHXMSGMG-CQSZACIVSA-N 1 1 260.425 3.681 20 10 CHCDMO C[C@@H]1CC[N@@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236780170 1131006023 /nfs/dbraw/zinc/00/60/23/1131006023.db2.gz YSDUDBUALXBZMG-OAHLLOKOSA-N 1 1 297.398 3.813 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC001236784011 1131006457 /nfs/dbraw/zinc/00/64/57/1131006457.db2.gz RBMQIXUOAMGITL-UHFFFAOYSA-N 1 1 273.351 3.726 20 10 CHCDMO CCc1ccc(C[N@@H+](C)CCc2ccccc2F)c(O)c1 ZINC001236788604 1131007268 /nfs/dbraw/zinc/00/72/68/1131007268.db2.gz PTEPMJOAYUQDLJ-UHFFFAOYSA-N 1 1 287.378 3.768 20 10 CHCDMO CC1=CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000797822319 1131007232 /nfs/dbraw/zinc/00/72/32/1131007232.db2.gz NTDLKFATOQFLJC-UHFFFAOYSA-N 1 1 275.392 3.547 20 10 CHCDMO CCc1ccc(C[N@@H+](C)CCc2cccc(F)c2)c(O)c1 ZINC001236787295 1131007475 /nfs/dbraw/zinc/00/74/75/1131007475.db2.gz HZWNEZOLGSBHQP-UHFFFAOYSA-N 1 1 287.378 3.768 20 10 CHCDMO CCc1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001236791078 1131007747 /nfs/dbraw/zinc/00/77/47/1131007747.db2.gz CWHLORMSMBBBGW-GOSISDBHSA-N 1 1 296.414 3.557 20 10 CHCDMO CCc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c(O)c1 ZINC001236791557 1131009049 /nfs/dbraw/zinc/00/90/49/1131009049.db2.gz ISJJSBPXTJPMMQ-UHFFFAOYSA-N 1 1 290.794 3.635 20 10 CHCDMO Oc1cc(Cl)c(Cl)cc1C[NH+]1CCCCC1 ZINC001236793567 1131009936 /nfs/dbraw/zinc/00/99/36/1131009936.db2.gz LBTXKDBINKDORA-UHFFFAOYSA-N 1 1 260.164 3.685 20 10 CHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C)CC2)c(Cl)c1 ZINC001236797185 1131010069 /nfs/dbraw/zinc/01/00/69/1131010069.db2.gz CNXIONWOYULWCT-NSHDSACASA-N 1 1 283.799 3.676 20 10 CHCDMO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCCC2(F)F)c(O)c1 ZINC000815627015 1131011005 /nfs/dbraw/zinc/01/10/05/1131011005.db2.gz QURWFUBNZWXKQW-YPMHNXCESA-N 1 1 269.335 3.847 20 10 CHCDMO COc1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)c(O)c1Cl ZINC001236811073 1131012385 /nfs/dbraw/zinc/01/23/85/1131012385.db2.gz GJCHJVANPLLCGQ-GHMZBOCLSA-N 1 1 283.799 3.675 20 10 CHCDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2C)c(O)c1Cl ZINC001236811073 1131012390 /nfs/dbraw/zinc/01/23/90/1131012390.db2.gz GJCHJVANPLLCGQ-GHMZBOCLSA-N 1 1 283.799 3.675 20 10 CHCDMO CC[N@@H+](Cc1ccccc1)Cc1c(C)cc(OC)cc1O ZINC001236818301 1131013949 /nfs/dbraw/zinc/01/39/49/1131013949.db2.gz LPGUUDAIWIPUBE-UHFFFAOYSA-N 1 1 285.387 3.731 20 10 CHCDMO CC(C)c1ccc(C[N@H+]2CCCOC(C)(C)C2)c(O)c1 ZINC001237049496 1131040851 /nfs/dbraw/zinc/04/08/51/1131040851.db2.gz PZTXEDZTVGXLET-UHFFFAOYSA-N 1 1 277.408 3.517 20 10 CHCDMO C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1O)C(C)(C)C ZINC001237054882 1131042610 /nfs/dbraw/zinc/04/26/10/1131042610.db2.gz HMVOALNLGDUFQQ-UHFFFAOYSA-N 1 1 291.313 3.564 20 10 CHCDMO COCC[C@@H]1CCCC[N@H+]1Cc1ccc(C(C)C)cc1O ZINC001237054434 1131043328 /nfs/dbraw/zinc/04/33/28/1131043328.db2.gz XYGPOBRAHPQGGU-KRWDZBQOSA-N 1 1 291.435 3.907 20 10 CHCDMO CC[C@@H](C)[N@@H+](C)Cc1c(O)cccc1OC(F)(F)F ZINC001237115046 1131052701 /nfs/dbraw/zinc/05/27/01/1131052701.db2.gz DTEDDFPNHGVMJN-SECBINFHSA-N 1 1 277.286 3.521 20 10 CHCDMO Oc1ccc(C(F)(F)F)cc1C[N@H+]1CCC[C@@H](F)CC1 ZINC001237138093 1131054557 /nfs/dbraw/zinc/05/45/57/1131054557.db2.gz TXOZFKRTKJMNTA-GFCCVEGCSA-N 1 1 291.288 3.735 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237122553 1131054657 /nfs/dbraw/zinc/05/46/57/1131054657.db2.gz VYZMQHQWXPIRQT-JTQLQIEISA-N 1 1 271.763 3.807 20 10 CHCDMO CCc1cccc(C)c1C[N@@H+](C)Cc1ccccc1O ZINC001237330401 1131085571 /nfs/dbraw/zinc/08/55/71/1131085571.db2.gz QUTFYZJRWNZWPZ-UHFFFAOYSA-N 1 1 269.388 3.895 20 10 CHCDMO C[C@H](c1ccco1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816485342 1131097593 /nfs/dbraw/zinc/09/75/93/1131097593.db2.gz JGAGWLAESYSWIW-SECBINFHSA-N 1 1 283.730 3.971 20 10 CHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816485342 1131097599 /nfs/dbraw/zinc/09/75/99/1131097599.db2.gz JGAGWLAESYSWIW-SECBINFHSA-N 1 1 283.730 3.971 20 10 CHCDMO CC[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H](C)O1 ZINC000816496367 1131100951 /nfs/dbraw/zinc/10/09/51/1131100951.db2.gz GZKPJUVWAMGSKV-CZUORRHYSA-N 1 1 285.387 3.545 20 10 CHCDMO CC[N@H+](CCC(F)(F)F)Cc1cc(Cl)c(F)cc1O ZINC000816499233 1131101789 /nfs/dbraw/zinc/10/17/89/1131101789.db2.gz JJMMMUUTZYFSPP-UHFFFAOYSA-N 1 1 299.695 3.959 20 10 CHCDMO CC[N@@H+](CCC(F)(F)F)Cc1cc(Cl)c(F)cc1O ZINC000816499233 1131101792 /nfs/dbraw/zinc/10/17/92/1131101792.db2.gz JJMMMUUTZYFSPP-UHFFFAOYSA-N 1 1 299.695 3.959 20 10 CHCDMO COc1cccc([C@H]2CC[N@@H+](Cc3c(C)cccc3O)C2)c1 ZINC001237490802 1131104345 /nfs/dbraw/zinc/10/43/45/1131104345.db2.gz BKUSCABGFWOIDS-INIZCTEOSA-N 1 1 297.398 3.699 20 10 CHCDMO Cc1ccccc1C[N@H+](C)Cc1c(C)cccc1O ZINC001237489997 1131104703 /nfs/dbraw/zinc/10/47/03/1131104703.db2.gz OOUVXLHBFQJNRY-UHFFFAOYSA-N 1 1 255.361 3.641 20 10 CHCDMO Cc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816531416 1131105845 /nfs/dbraw/zinc/10/58/45/1131105845.db2.gz QVNQQPJNKJMOJV-UHFFFAOYSA-N 1 1 279.742 3.783 20 10 CHCDMO C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccc(F)cc1O ZINC000799729293 1131106069 /nfs/dbraw/zinc/10/60/69/1131106069.db2.gz SACFJCVLYWHKEU-LBPRGKRZSA-N 1 1 298.361 3.906 20 10 CHCDMO Cc1cccc(O)c1C[N@@H+](C)CCc1ccccc1F ZINC001237496504 1131106143 /nfs/dbraw/zinc/10/61/43/1131106143.db2.gz YVKGOXTXBLAQDQ-UHFFFAOYSA-N 1 1 273.351 3.514 20 10 CHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccccc1F ZINC000816529183 1131108397 /nfs/dbraw/zinc/10/83/97/1131108397.db2.gz JTODLQLWBUFABE-UHFFFAOYSA-N 1 1 283.705 3.614 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H]1C ZINC000816648269 1131119263 /nfs/dbraw/zinc/11/92/63/1131119263.db2.gz HZDLMLRHTGBFIL-CABCVRRESA-N 1 1 297.398 3.811 20 10 CHCDMO Oc1ccc(-c2ccc(F)cc2)cc1C[N@H+]1CC[C@@H](F)C1 ZINC001237641599 1131123191 /nfs/dbraw/zinc/12/31/91/1131123191.db2.gz UMHBLRKTGVSBQW-MRXNPFEDSA-N 1 1 289.325 3.742 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)C2CC(C)C2)c1O ZINC001237681394 1131126451 /nfs/dbraw/zinc/12/64/51/1131126451.db2.gz OWTUIXCJLSAXDU-UHFFFAOYSA-N 1 1 253.773 3.584 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@](C)(F)C2)c1O ZINC001237681813 1131127293 /nfs/dbraw/zinc/12/72/93/1131127293.db2.gz SXMWVBGWTFZOLS-CQSZACIVSA-N 1 1 271.763 3.678 20 10 CHCDMO Cc1cc(Cl)cc(C[N@H+](C)C2CC(F)(F)C2)c1O ZINC001237681030 1131127306 /nfs/dbraw/zinc/12/73/06/1131127306.db2.gz KJOKTTWCFOGMOJ-UHFFFAOYSA-N 1 1 275.726 3.584 20 10 CHCDMO COc1ccc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001237715014 1131132576 /nfs/dbraw/zinc/13/25/76/1131132576.db2.gz HWYIIEGFSGCJGO-UHFFFAOYSA-N 1 1 298.430 3.702 20 10 CHCDMO C[C@H]1CC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])[C@@H](C)C1 ZINC001237798439 1131140989 /nfs/dbraw/zinc/14/09/89/1131140989.db2.gz FNHVHSHUHITTEJ-UWVGGRQHSA-N 1 1 271.763 3.805 20 10 CHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808952 1131141864 /nfs/dbraw/zinc/14/18/64/1131141864.db2.gz WUAWRJIYWFDTDH-SNVBAGLBSA-N 1 1 271.763 3.807 20 10 CHCDMO CC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001116441619 1131145241 /nfs/dbraw/zinc/14/52/41/1131145241.db2.gz KGIISMWAZIPODI-MRXNPFEDSA-N 1 1 272.436 3.909 20 10 CHCDMO c1cc(N2CCCC2)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001116442909 1131147212 /nfs/dbraw/zinc/14/72/12/1131147212.db2.gz WRPDXNRXZGIYHS-HDICACEKSA-N 1 1 284.447 3.909 20 10 CHCDMO Oc1cc(Cl)c(F)cc1C[NH+]1CC2CCC(CC2)C1 ZINC001237939634 1131152630 /nfs/dbraw/zinc/15/26/30/1131152630.db2.gz DZRNJLSNLVKSNC-UHFFFAOYSA-N 1 1 283.774 3.807 20 10 CHCDMO c1cc(N2CCCC2)ccc1C[N@H+]1CCCC2(CC2)C1 ZINC001116631701 1131157619 /nfs/dbraw/zinc/15/76/19/1131157619.db2.gz JNYWUHSHBPIELA-UHFFFAOYSA-N 1 1 270.420 3.663 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(F)CC2)c1O ZINC001238058201 1131165287 /nfs/dbraw/zinc/16/52/87/1131165287.db2.gz PHDSAZZHLTUDGB-HNNXBMFYSA-N 1 1 269.335 3.554 20 10 CHCDMO Cc1ccc(CC[N@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238060674 1131166532 /nfs/dbraw/zinc/16/65/32/1131166532.db2.gz DZHYSCVCCOLIMH-UHFFFAOYSA-N 1 1 287.378 3.823 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC001238063579 1131167123 /nfs/dbraw/zinc/16/71/23/1131167123.db2.gz YZNKUNZIBIYURX-LLVKDONJSA-N 1 1 291.288 3.614 20 10 CHCDMO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2nccs2)c1O ZINC001238071369 1131167731 /nfs/dbraw/zinc/16/77/31/1131167731.db2.gz VXUUTMLBDBJUPE-CYBMUJFWSA-N 1 1 292.379 3.633 20 10 CHCDMO Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2nccs2)c1O ZINC001238071369 1131167734 /nfs/dbraw/zinc/16/77/34/1131167734.db2.gz VXUUTMLBDBJUPE-CYBMUJFWSA-N 1 1 292.379 3.633 20 10 CHCDMO C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817966260 1131194302 /nfs/dbraw/zinc/19/43/02/1131194302.db2.gz JWJQNTROTYSNNT-AUUYWEPGSA-N 1 1 298.430 3.586 20 10 CHCDMO C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1[O-] ZINC000817986853 1131195406 /nfs/dbraw/zinc/19/54/06/1131195406.db2.gz USPWNYRKEZYTMX-CQSZACIVSA-N 1 1 296.414 3.506 20 10 CHCDMO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cccc(C(F)(F)F)c1O ZINC000818357908 1131211812 /nfs/dbraw/zinc/21/18/12/1131211812.db2.gz BZTJJCNEZJWKMI-MMWGEVLESA-N 1 1 285.309 3.860 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001137837557 1131420955 /nfs/dbraw/zinc/42/09/55/1131420955.db2.gz LTDFHWKCKLGNPX-OAHLLOKOSA-N 1 1 285.362 3.911 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001137837557 1131420958 /nfs/dbraw/zinc/42/09/58/1131420958.db2.gz LTDFHWKCKLGNPX-OAHLLOKOSA-N 1 1 285.362 3.911 20 10 CHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001137838831 1131421402 /nfs/dbraw/zinc/42/14/02/1131421402.db2.gz LFSBCUXPEVVEKP-IUODEOHRSA-N 1 1 263.356 3.686 20 10 CHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001137838831 1131421406 /nfs/dbraw/zinc/42/14/06/1131421406.db2.gz LFSBCUXPEVVEKP-IUODEOHRSA-N 1 1 263.356 3.686 20 10 CHCDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138215734 1131477923 /nfs/dbraw/zinc/47/79/23/1131477923.db2.gz RRPHEELARQYUCR-ZBFHGGJFSA-N 1 1 276.399 3.609 20 10 CHCDMO CCC[N@@H+](CCOC)Cc1ccc(N2CCCCC2)cc1 ZINC001138214192 1131477942 /nfs/dbraw/zinc/47/79/42/1131477942.db2.gz XEIYVOBOPYRDGW-UHFFFAOYSA-N 1 1 290.451 3.535 20 10 CHCDMO CS[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000824683232 1131479824 /nfs/dbraw/zinc/47/98/24/1131479824.db2.gz ANOWTNCDGUGOPK-QGZVFWFLSA-N 1 1 299.439 3.997 20 10 CHCDMO CC[N@@H+](Cc1c2ccccc2n(C)c1C)Cc1ccncc1 ZINC001138252983 1131482113 /nfs/dbraw/zinc/48/21/13/1131482113.db2.gz YSUYJVSACATPHQ-UHFFFAOYSA-N 1 1 293.414 3.904 20 10 CHCDMO Cc1c(C[N@H+]2CCC[C@@](C)(F)C2)c2ccccc2n1C ZINC001138252929 1131482370 /nfs/dbraw/zinc/48/23/70/1131482370.db2.gz XRKOVIGDWLDLFS-QGZVFWFLSA-N 1 1 274.383 3.811 20 10 CHCDMO Cc1c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c2ccccc2n1C ZINC001138252786 1131482413 /nfs/dbraw/zinc/48/24/13/1131482413.db2.gz UWZDNPNEKTUXIE-LBPRGKRZSA-N 1 1 292.373 3.964 20 10 CHCDMO Cc1c(C[N@@H+]2C[C@@H](C)CC23CC3)c2ccccc2n1C ZINC001138259087 1131482982 /nfs/dbraw/zinc/48/29/82/1131482982.db2.gz AHBNRVOMXKKWET-ZDUSSCGKSA-N 1 1 268.404 3.861 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824820230 1131485827 /nfs/dbraw/zinc/48/58/27/1131485827.db2.gz BPBDHOKDKDZLOJ-KRWDZBQOSA-N 1 1 299.414 3.792 20 10 CHCDMO Cc1ccc2c(C[N@H+](C)Cc3ccccc3O)c[nH]c2c1 ZINC001136976038 1131491716 /nfs/dbraw/zinc/49/17/16/1131491716.db2.gz WQCKDXHBGZROAX-UHFFFAOYSA-N 1 1 280.371 3.814 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCCC[C@](C)(F)C3)ccc21 ZINC001138354672 1131493596 /nfs/dbraw/zinc/49/35/96/1131493596.db2.gz POFCKUFIKLUOQS-SFHVURJKSA-N 1 1 290.426 3.783 20 10 CHCDMO CN1CCCc2cc(C[N@@H+](C)Cc3cccs3)ccc21 ZINC001138358591 1131494217 /nfs/dbraw/zinc/49/42/17/1131494217.db2.gz VSENGBIASJJKMV-UHFFFAOYSA-N 1 1 286.444 3.763 20 10 CHCDMO CN1CCCc2cc(C[N@H+]3CCC[C@H]4CCC[C@H]43)ccc21 ZINC001138355739 1131494274 /nfs/dbraw/zinc/49/42/74/1131494274.db2.gz BDCPTXRWNAKFBF-VQIMIIECSA-N 1 1 284.447 3.834 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCCC2)c(OC)c1 ZINC001138389339 1131496874 /nfs/dbraw/zinc/49/68/74/1131496874.db2.gz MKMPMPOFIFDBHK-UHFFFAOYSA-N 1 1 290.451 3.916 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(F)cccc1OC ZINC001138386946 1131496895 /nfs/dbraw/zinc/49/68/95/1131496895.db2.gz RLKZFVLFLWZRKC-UHFFFAOYSA-N 1 1 289.350 3.562 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215277 1131502200 /nfs/dbraw/zinc/50/22/00/1131502200.db2.gz KSPJWEKQMVIGLW-HNNXBMFYSA-N 1 1 297.851 3.765 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CCSC3)C2)cc1C ZINC000825215042 1131502605 /nfs/dbraw/zinc/50/26/05/1131502605.db2.gz DMIANLVVMVYFHQ-KRWDZBQOSA-N 1 1 291.460 3.728 20 10 CHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)c2ccccn2)cc1Cl ZINC000825450498 1131511926 /nfs/dbraw/zinc/51/19/26/1131511926.db2.gz HOFFDIQYYDMGKV-LBPRGKRZSA-N 1 1 290.794 3.942 20 10 CHCDMO CC(C)Oc1cccc(C[N@H+]2CCc3cccc(O)c3C2)c1 ZINC001138985894 1131568418 /nfs/dbraw/zinc/56/84/18/1131568418.db2.gz PAEURCLYIWDNLX-UHFFFAOYSA-N 1 1 297.398 3.738 20 10 CHCDMO Cc1cc(O)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1C ZINC000753106442 1131575097 /nfs/dbraw/zinc/57/50/97/1131575097.db2.gz QVMYMWYFQRLHLH-DOTOQJQBSA-N 1 1 291.460 3.869 20 10 CHCDMO C[N@@H+](Cc1ccc2cccnc2c1)Cc1ccccc1O ZINC001139170482 1131591094 /nfs/dbraw/zinc/59/10/94/1131591094.db2.gz FDAMXJKUDDLXSB-UHFFFAOYSA-N 1 1 278.355 3.572 20 10 CHCDMO Cc1cc(C[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)ccc1N(C)C ZINC001139671772 1131626545 /nfs/dbraw/zinc/62/65/45/1131626545.db2.gz ZZYZUZZWROPJBI-CABCVRRESA-N 1 1 294.389 3.538 20 10 CHCDMO Cc1cc(C[N@H+]2CCCC3(CCC3)C2)ccc1N(C)C ZINC001139673966 1131628214 /nfs/dbraw/zinc/62/82/14/1131628214.db2.gz OOAFFIGCPFNOHD-UHFFFAOYSA-N 1 1 272.436 3.827 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cncc2ccccc21 ZINC001139896837 1131649319 /nfs/dbraw/zinc/64/93/19/1131649319.db2.gz MTGYOVCFLVIEJF-UHFFFAOYSA-N 1 1 292.382 3.963 20 10 CHCDMO CCC[N@@H+](Cc1cc2cnccc2o1)Cc1ccccc1O ZINC000845906452 1131668932 /nfs/dbraw/zinc/66/89/32/1131668932.db2.gz LIIXVOAEAGVXEV-UHFFFAOYSA-N 1 1 296.370 3.946 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)c1O ZINC001140178643 1131673499 /nfs/dbraw/zinc/67/34/99/1131673499.db2.gz RZICUHXCAKRQGA-ZDUSSCGKSA-N 1 1 287.325 3.578 20 10 CHCDMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H]2Cc2ccccn2)c1O ZINC001140182496 1131673530 /nfs/dbraw/zinc/67/35/30/1131673530.db2.gz SJVDYPKSWFVWSH-QGZVFWFLSA-N 1 1 296.414 3.611 20 10 CHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1F ZINC000846107850 1131686317 /nfs/dbraw/zinc/68/63/17/1131686317.db2.gz LCPGCYMOBHORKH-HNNXBMFYSA-N 1 1 298.352 3.513 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846103844 1131690131 /nfs/dbraw/zinc/69/01/31/1131690131.db2.gz ACTZHHBFJHXHIP-INIZCTEOSA-N 1 1 294.389 3.682 20 10 CHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001140338114 1131702502 /nfs/dbraw/zinc/70/25/02/1131702502.db2.gz VRIICMFNYKICFY-GFCCVEGCSA-N 1 1 293.716 3.615 20 10 CHCDMO C[C@@]1(F)CCCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001140337872 1131702375 /nfs/dbraw/zinc/70/23/75/1131702375.db2.gz KFWGHIWJZVTFPP-CQSZACIVSA-N 1 1 271.763 3.760 20 10 CHCDMO C[N@H+](Cc1c(O)cccc1Cl)C[C@@H]1CC1(C)C ZINC001140341581 1131703142 /nfs/dbraw/zinc/70/31/42/1131703142.db2.gz XHILSCMVDPYOPX-JTQLQIEISA-N 1 1 253.773 3.524 20 10 CHCDMO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)C(F)F ZINC000834828537 1131707523 /nfs/dbraw/zinc/70/75/23/1131707523.db2.gz VFOYNEYJHHTXLU-ZYHUDNBSSA-N 1 1 257.324 3.703 20 10 CHCDMO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1ccc(F)cc1O ZINC000834896362 1131722432 /nfs/dbraw/zinc/72/24/32/1131722432.db2.gz VJYVWELBPOGSJD-RISCZKNCSA-N 1 1 291.370 3.550 20 10 CHCDMO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)co1 ZINC000834896414 1131722460 /nfs/dbraw/zinc/72/24/60/1131722460.db2.gz AVXZSIBCRKJCOD-JTQLQIEISA-N 1 1 294.782 3.755 20 10 CHCDMO CCCc1ncc(C[NH2+][C@H](CC)c2ccc(F)cc2O)o1 ZINC000834901285 1131724657 /nfs/dbraw/zinc/72/46/57/1131724657.db2.gz ZAFYNYPCLYTSJC-CQSZACIVSA-N 1 1 292.354 3.713 20 10 CHCDMO CC[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(F)cc1O ZINC000834909832 1131730057 /nfs/dbraw/zinc/73/00/57/1131730057.db2.gz MHCOOPQOOILOHN-WFASDCNBSA-N 1 1 295.398 3.777 20 10 CHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCCC(F)(F)CC1 ZINC001140461605 1131746974 /nfs/dbraw/zinc/74/69/74/1131746974.db2.gz NGSVXDAQWLWZBS-UHFFFAOYSA-N 1 1 275.726 3.667 20 10 CHCDMO C[C@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461632 1131749267 /nfs/dbraw/zinc/74/92/67/1131749267.db2.gz OFVVENBTEZXYMC-NSHDSACASA-N 1 1 253.773 3.668 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(Cl)cc1[O-])CC1CC1 ZINC001140466942 1131752783 /nfs/dbraw/zinc/75/27/83/1131752783.db2.gz NANBEFVHKAIWQS-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO CC(C)[N@@H+](Cc1ccc(Cl)cc1O)CC1CC1 ZINC001140466942 1131752786 /nfs/dbraw/zinc/75/27/86/1131752786.db2.gz NANBEFVHKAIWQS-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO CC(C)[N@H+](Cc1ccc(Cl)cc1O)CC1CC1 ZINC001140466942 1131752791 /nfs/dbraw/zinc/75/27/91/1131752791.db2.gz NANBEFVHKAIWQS-UHFFFAOYSA-N 1 1 253.773 3.666 20 10 CHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000835025438 1131759424 /nfs/dbraw/zinc/75/94/24/1131759424.db2.gz VJSMIJQBRIRMEH-UTSMFGRCSA-N 1 1 295.430 3.931 20 10 CHCDMO CC(C)OCCC[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835025912 1131759678 /nfs/dbraw/zinc/75/96/78/1131759678.db2.gz NJLQZACAVUVHPB-VURMDHGXSA-N 1 1 290.451 3.513 20 10 CHCDMO C[C@@H](c1cccnc1)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835048546 1131765423 /nfs/dbraw/zinc/76/54/23/1131765423.db2.gz UJMVUKKRJVRYRS-WLMCBFPDSA-N 1 1 295.430 3.854 20 10 CHCDMO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(C)ccc1O ZINC001140622914 1131831214 /nfs/dbraw/zinc/83/12/14/1131831214.db2.gz HIDVKZYFSVRSTL-UHFFFAOYSA-N 1 1 273.351 3.862 20 10 CHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2cccc3cccnc32)c1 ZINC001140621130 1131831671 /nfs/dbraw/zinc/83/16/71/1131831671.db2.gz QADYBAFWSFAJAA-UHFFFAOYSA-N 1 1 292.382 3.881 20 10 CHCDMO Cc1c(O)ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC001140749190 1131906998 /nfs/dbraw/zinc/90/69/98/1131906998.db2.gz QUCDOJHEZKCANS-UKRRQHHQSA-N 1 1 275.392 3.561 20 10 CHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccccc2)c(O)c1 ZINC001140852005 1131947835 /nfs/dbraw/zinc/94/78/35/1131947835.db2.gz YDUBITRCPDGMNR-UHFFFAOYSA-N 1 1 298.430 3.870 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001140949651 1131969314 /nfs/dbraw/zinc/96/93/14/1131969314.db2.gz HCFCPCLDCGSFGS-KRWDZBQOSA-N 1 1 281.399 3.765 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3C)C2)c(O)c1 ZINC001140949820 1131969734 /nfs/dbraw/zinc/96/97/34/1131969734.db2.gz MIMLCPGBCAPLGH-QGZVFWFLSA-N 1 1 297.398 3.662 20 10 CHCDMO Cc1ccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC001140950978 1131972279 /nfs/dbraw/zinc/97/22/79/1131972279.db2.gz RONZBACKZMTSFY-HNNXBMFYSA-N 1 1 285.362 3.829 20 10 CHCDMO CCC[C@H]1CCCC[N@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028380 1131989692 /nfs/dbraw/zinc/98/96/92/1131989692.db2.gz MPAWEMOPRATVNL-ZDUSSCGKSA-N 1 1 293.407 3.564 20 10 CHCDMO c1c(C[N@H+]2CCC3(CCC3)C2)cc2c3c1CCCN3CCC2 ZINC001141078329 1132007073 /nfs/dbraw/zinc/00/70/73/1132007073.db2.gz RZVZUQPPBPQJOA-UHFFFAOYSA-N 1 1 296.458 3.761 20 10 CHCDMO Cc1cc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)no1 ZINC000838949660 1132161433 /nfs/dbraw/zinc/16/14/33/1132161433.db2.gz RSGCAUGJPQEVFP-UHFFFAOYSA-N 1 1 299.418 3.509 20 10 CHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839193920 1132190108 /nfs/dbraw/zinc/19/01/08/1132190108.db2.gz ZAQUFGRPHNCNOC-IRXDYDNUSA-N 1 1 297.423 3.749 20 10 CHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H](C)CCOCC(C)C ZINC001172485278 1132230774 /nfs/dbraw/zinc/23/07/74/1132230774.db2.gz VRAQFZFIQGKPSE-HNNXBMFYSA-N 1 1 279.424 3.665 20 10 CHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000840142307 1132247010 /nfs/dbraw/zinc/24/70/10/1132247010.db2.gz FRQPCQNQDVRDFQ-QGZVFWFLSA-N 1 1 291.460 3.728 20 10 CHCDMO CO[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H]1C ZINC000840127113 1132247726 /nfs/dbraw/zinc/24/77/26/1132247726.db2.gz RLPJDUTWEWZWHZ-KDOFPFPSSA-N 1 1 291.435 3.681 20 10 CHCDMO C[N@H+]1CC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231319764 1132280079 /nfs/dbraw/zinc/28/00/79/1132280079.db2.gz KSZSXXPIHDLLHY-KRWDZBQOSA-N 1 1 297.358 3.891 20 10 CHCDMO Cc1ccc(C[N@H+]2CCc3cccc(O)c3C2)cc1Cl ZINC001231424357 1132292360 /nfs/dbraw/zinc/29/23/60/1132292360.db2.gz RSZXSFGPXCXUEL-UHFFFAOYSA-N 1 1 287.790 3.912 20 10 CHCDMO CC[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(F)cc1O ZINC000840875734 1132299114 /nfs/dbraw/zinc/29/91/14/1132299114.db2.gz GLDXFMXFSPUSGF-OAHLLOKOSA-N 1 1 295.398 3.777 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCc3cccc(O)c3C2)cc1C ZINC001231485878 1132299986 /nfs/dbraw/zinc/29/99/86/1132299986.db2.gz OGUYTCFRHYEGET-UHFFFAOYSA-N 1 1 281.399 3.876 20 10 CHCDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(N(C)C)cc1C ZINC000840912385 1132308376 /nfs/dbraw/zinc/30/83/76/1132308376.db2.gz GBFDFUWHPAFUSH-UHFFFAOYSA-N 1 1 288.357 3.835 20 10 CHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000840947029 1132311531 /nfs/dbraw/zinc/31/15/31/1132311531.db2.gz ZPMXARXMJZQBCC-IBGZPJMESA-N 1 1 295.430 3.793 20 10 CHCDMO CCOc1cccc(C[N@@H+](CC)Cc2occc2C)c1O ZINC000840970789 1132314993 /nfs/dbraw/zinc/31/49/93/1132314993.db2.gz WHYRQTTYBXSADD-UHFFFAOYSA-N 1 1 289.375 3.714 20 10 CHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)CCC[C@@]1(C)O ZINC001231586953 1132316980 /nfs/dbraw/zinc/31/69/80/1132316980.db2.gz NTLNOTIRAQHSDX-AUUYWEPGSA-N 1 1 299.414 3.528 20 10 CHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCc2occc2C1 ZINC001231590845 1132318008 /nfs/dbraw/zinc/31/80/08/1132318008.db2.gz NUTJHIIMKNVENK-UHFFFAOYSA-N 1 1 279.339 3.697 20 10 CHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)C1CC(F)(F)C1 ZINC001231588325 1132319139 /nfs/dbraw/zinc/31/91/39/1132319139.db2.gz PLUYZFCVDXXAKF-UHFFFAOYSA-N 1 1 277.314 3.775 20 10 CHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@H](OC)C1 ZINC001172950292 1132373253 /nfs/dbraw/zinc/37/32/53/1132373253.db2.gz MGPWCMBGCOZFRU-ROUUACIJSA-N 1 1 290.451 3.532 20 10 CHCDMO CCC(CC)[N@@H+](CC)Cc1ccc(N(C)C)cc1OC ZINC001231854593 1132378241 /nfs/dbraw/zinc/37/82/41/1132378241.db2.gz JBTJZAYWUGKOHW-UHFFFAOYSA-N 1 1 278.440 3.772 20 10 CHCDMO Cc1cc(C)c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001231845931 1132380050 /nfs/dbraw/zinc/38/00/50/1132380050.db2.gz 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