smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CO[C@@H](C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)C1CCC1 ZINC001167107925 1013148985 /nfs/dbraw/zinc/14/89/85/1013148985.db2.gz LFFFUBRBUHCPNY-IBGZPJMESA-N 1 1 304.478 3.778 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)c1O ZINC000894461911 1013379158 /nfs/dbraw/zinc/37/91/58/1013379158.db2.gz LZHIOFVPBPABDI-PBHICJAKSA-N 1 1 312.413 3.687 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(C)cc(OC)c2O)cc1C ZINC000164284871 1013469450 /nfs/dbraw/zinc/46/94/50/1013469450.db2.gz YEFMIOBISSYEBN-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H](C)c2nnc(C)[nH]2)cc1 ZINC000894771824 1013481429 /nfs/dbraw/zinc/48/14/29/1013481429.db2.gz XPEUTVZBSXDNAZ-CQSZACIVSA-N 1 1 315.465 3.590 20 10 DHCDMO C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000839183552 1013622022 /nfs/dbraw/zinc/62/20/22/1013622022.db2.gz YBZDPZQLAGVGAK-NSHDSACASA-N 1 1 317.260 3.521 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1O ZINC000894887587 1013625385 /nfs/dbraw/zinc/62/53/85/1013625385.db2.gz GNSYEHCUMXPHCN-YPMHNXCESA-N 1 1 317.351 3.872 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1O ZINC000894887585 1013626287 /nfs/dbraw/zinc/62/62/87/1013626287.db2.gz GNSYEHCUMXPHCN-DGCLKSJQSA-N 1 1 317.351 3.872 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000153231822 1033568344 /nfs/dbraw/zinc/56/83/44/1033568344.db2.gz ZFFLWWKLGNLXSY-OAHLLOKOSA-N 1 1 303.427 3.635 20 10 DHCDMO Cc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(C)c1F ZINC001143385450 1014460228 /nfs/dbraw/zinc/46/02/28/1014460228.db2.gz SMCVBGFJGMWZSA-UHFFFAOYSA-N 1 1 315.388 3.802 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C(=O)OC)c1ccccc1 ZINC000157059047 1014692974 /nfs/dbraw/zinc/69/29/74/1014692974.db2.gz UWDQZHPQRPNXMG-GOSISDBHSA-N 1 1 313.397 3.519 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)OC)c1ccccc1 ZINC000157059047 1014692988 /nfs/dbraw/zinc/69/29/88/1014692988.db2.gz UWDQZHPQRPNXMG-GOSISDBHSA-N 1 1 313.397 3.519 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC[C@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000834906919 1015015915 /nfs/dbraw/zinc/01/59/15/1015015915.db2.gz UFSCMQFFEOULHV-VYUIOLGVSA-N 1 1 304.217 3.511 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](O)c1cccc(C)c1)c1ccc(F)cc1O ZINC000796836057 1015214214 /nfs/dbraw/zinc/21/42/14/1015214214.db2.gz NWJNZHFQGHPTFX-FUHWJXTLSA-N 1 1 303.377 3.614 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581141 1015219008 /nfs/dbraw/zinc/21/90/08/1015219008.db2.gz LUNITFVKGBREQU-SECBINFHSA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581141 1015219015 /nfs/dbraw/zinc/21/90/15/1015219015.db2.gz LUNITFVKGBREQU-SECBINFHSA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581141 1015219021 /nfs/dbraw/zinc/21/90/21/1015219021.db2.gz LUNITFVKGBREQU-SECBINFHSA-N 1 1 312.797 3.631 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccccc2)C2CC2)c(O)c1OC ZINC000891560532 1015393725 /nfs/dbraw/zinc/39/37/25/1015393725.db2.gz CBRFZLFXIOWAQY-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(Cl)cc1O ZINC001140464426 1015507425 /nfs/dbraw/zinc/50/74/25/1015507425.db2.gz PDJSDZMZIJCSRM-UHFFFAOYSA-N 1 1 319.788 3.796 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896228878 1015512606 /nfs/dbraw/zinc/51/26/06/1015512606.db2.gz VKEBVUQTQZOMGU-GFCCVEGCSA-N 1 1 323.717 3.912 20 10 DHCDMO CC(C)C[N@H+](Cc1ccccn1)Cc1cc(F)cc(F)c1O ZINC000896660639 1015694977 /nfs/dbraw/zinc/69/49/77/1015694977.db2.gz AIVFGAUNMVQCRL-UHFFFAOYSA-N 1 1 306.356 3.724 20 10 DHCDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1cc(F)cc(F)c1O ZINC000896660639 1015694982 /nfs/dbraw/zinc/69/49/82/1015694982.db2.gz AIVFGAUNMVQCRL-UHFFFAOYSA-N 1 1 306.356 3.724 20 10 DHCDMO COc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1OC(C)C ZINC000896641916 1015695053 /nfs/dbraw/zinc/69/50/53/1015695053.db2.gz VECNSZGRAKITQL-UHFFFAOYSA-N 1 1 319.376 3.617 20 10 DHCDMO COc1ccccc1[C@H]([NH2+]Cc1ccccc1O)c1ccco1 ZINC000151116171 1016021087 /nfs/dbraw/zinc/02/10/87/1016021087.db2.gz WKHABSBBNPMPAH-IBGZPJMESA-N 1 1 309.365 3.873 20 10 DHCDMO Cn1ccnc1[C@H]1[N@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000294746416 1032139353 /nfs/dbraw/zinc/13/93/53/1032139353.db2.gz HTTFGUADHHZTDL-GOSISDBHSA-N 1 1 321.424 3.862 20 10 DHCDMO Cn1ccnc1[C@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000294746416 1032139359 /nfs/dbraw/zinc/13/93/59/1032139359.db2.gz HTTFGUADHHZTDL-GOSISDBHSA-N 1 1 321.424 3.862 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(F)cc1O ZINC000185079835 1016545850 /nfs/dbraw/zinc/54/58/50/1016545850.db2.gz NOOYOSDGMFYIIX-PXAZEXFGSA-N 1 1 320.383 3.624 20 10 DHCDMO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3ncc[nH]3)cc2Cl)C1 ZINC000281959366 1016836323 /nfs/dbraw/zinc/83/63/23/1016836323.db2.gz JHKLSDFCWPJTDH-ZDUSSCGKSA-N 1 1 318.852 3.589 20 10 DHCDMO CCC[N@@H+](CCc1cccs1)Cc1cccc(OC)c1O ZINC000185586227 1017032891 /nfs/dbraw/zinc/03/28/91/1017032891.db2.gz KLOHDEXMOFVGJX-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO CC(C)[N@@H+](CCc1cscn1)Cc1ccc(N(C)C)cc1 ZINC000294793141 1032154722 /nfs/dbraw/zinc/15/47/22/1032154722.db2.gz BMPJXOHLVWOJHE-UHFFFAOYSA-N 1 1 303.475 3.662 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccn(C)n1 ZINC000840815274 1017078152 /nfs/dbraw/zinc/07/81/52/1017078152.db2.gz DHUMPUXLMKEEQY-RKDXNWHRSA-N 1 1 314.216 3.844 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)c(C)o1 ZINC000160193156 1011986640 /nfs/dbraw/zinc/98/66/40/1011986640.db2.gz OMRMVLLRHFXBOJ-GOSISDBHSA-N 1 1 315.413 3.783 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccnc1Cl ZINC000122433948 1032606859 /nfs/dbraw/zinc/60/68/59/1032606859.db2.gz HVKVFJNSXVQWOY-NSHDSACASA-N 1 1 307.800 3.791 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCc3nc(C(C)C)ncc3C2)cc1 ZINC000857880819 1032701881 /nfs/dbraw/zinc/70/18/81/1032701881.db2.gz OVBFDUJIJYIVAR-UHFFFAOYSA-N 1 1 324.472 3.614 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCc3nc(C(C)C)ncc3C2)cc1 ZINC000857880819 1032701901 /nfs/dbraw/zinc/70/19/01/1032701901.db2.gz OVBFDUJIJYIVAR-UHFFFAOYSA-N 1 1 324.472 3.614 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1ccc(N(C)C)cc1C ZINC000840917912 1017481871 /nfs/dbraw/zinc/48/18/71/1017481871.db2.gz VQLKRGCVGVZUMF-UHFFFAOYSA-N 1 1 303.475 3.582 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171494784 1032735032 /nfs/dbraw/zinc/73/50/32/1032735032.db2.gz TZVNDMKGSBFYGY-HNNXBMFYSA-N 1 1 303.352 3.660 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171494785 1032735902 /nfs/dbraw/zinc/73/59/02/1032735902.db2.gz TZVNDMKGSBFYGY-OAHLLOKOSA-N 1 1 303.352 3.660 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)c1O ZINC000858016044 1032745599 /nfs/dbraw/zinc/74/55/99/1032745599.db2.gz HLHANKMBIVUUHA-SFHVURJKSA-N 1 1 324.424 3.626 20 10 DHCDMO C[N@H+](Cc1cc2c(cc1O)OCO2)Cc1cc(Cl)ccc1F ZINC000766091091 1018265628 /nfs/dbraw/zinc/26/56/28/1018265628.db2.gz MBZBVDZCHFDAAI-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO C[N@@H+](Cc1cc2c(cc1O)OCO2)Cc1cc(Cl)ccc1F ZINC000766091091 1018265634 /nfs/dbraw/zinc/26/56/34/1018265634.db2.gz MBZBVDZCHFDAAI-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NCC2([NH+](C)C)CCCC2)cc1 ZINC000764652927 1018338387 /nfs/dbraw/zinc/33/83/87/1018338387.db2.gz BKWZJZNLKORMHS-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO COc1c(O)c(C[N@H+](C)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000278216928 1018379005 /nfs/dbraw/zinc/37/90/05/1018379005.db2.gz LCUCWYSFLQNRAA-LBPRGKRZSA-N 1 1 316.357 3.502 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000278216928 1018379015 /nfs/dbraw/zinc/37/90/15/1018379015.db2.gz LCUCWYSFLQNRAA-LBPRGKRZSA-N 1 1 316.357 3.502 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CCCc3occc32)cc1F ZINC000858095010 1032763368 /nfs/dbraw/zinc/76/33/68/1032763368.db2.gz UMIHGESDRHPWBH-HNNXBMFYSA-N 1 1 306.356 3.791 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000764933637 1018430486 /nfs/dbraw/zinc/43/04/86/1018430486.db2.gz QFUYVOVXKOOBDT-ZACQAIPSSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000764933637 1018430490 /nfs/dbraw/zinc/43/04/90/1018430490.db2.gz QFUYVOVXKOOBDT-ZACQAIPSSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H]1OCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@H]1C ZINC000765099356 1018474759 /nfs/dbraw/zinc/47/47/59/1018474759.db2.gz PDTDAWMFSBNCHV-QWHCGFSZSA-N 1 1 315.413 3.626 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccc(F)c(F)c2)cc1F ZINC000858108676 1032769461 /nfs/dbraw/zinc/76/94/61/1032769461.db2.gz DZLUOOWRPLRKRB-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1cccc(O)c1 ZINC000858127723 1032774188 /nfs/dbraw/zinc/77/41/88/1032774188.db2.gz NUOBQIVAFQXFAK-LLVKDONJSA-N 1 1 306.356 3.587 20 10 DHCDMO C[C@@H](NCC[N@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000765349908 1018766851 /nfs/dbraw/zinc/76/68/51/1018766851.db2.gz ODZTWLRLVXAFPO-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H](NCC[N@@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000765349908 1018766863 /nfs/dbraw/zinc/76/68/63/1018766863.db2.gz ODZTWLRLVXAFPO-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3c([O-])cccc3F)C2)cc1 ZINC001137839668 1018768994 /nfs/dbraw/zinc/76/89/94/1018768994.db2.gz GKBJGMZXVIAGIH-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc([C@@H]2CC[N@H+](Cc3c(O)cccc3F)C2)cc1 ZINC001137839668 1018769010 /nfs/dbraw/zinc/76/90/10/1018769010.db2.gz GKBJGMZXVIAGIH-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3c(O)cccc3F)C2)cc1 ZINC001137839668 1018769026 /nfs/dbraw/zinc/76/90/26/1018769026.db2.gz GKBJGMZXVIAGIH-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CSc3ccccc32)cc1F ZINC000858142349 1032781770 /nfs/dbraw/zinc/78/17/70/1032781770.db2.gz ZFFCOVRALYJFFI-HNNXBMFYSA-N 1 1 320.408 3.967 20 10 DHCDMO CC[NH+](CC)CCC[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000020828418 1032794804 /nfs/dbraw/zinc/79/48/04/1032794804.db2.gz GLHUIXHCARWMIP-OAHLLOKOSA-N 1 1 300.446 3.928 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@H]2c2ccnn2C)cc1Cl ZINC000825768511 1032798717 /nfs/dbraw/zinc/79/87/17/1032798717.db2.gz PIFUQVDTNTZRFB-INIZCTEOSA-N 1 1 319.836 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2ccnn2C)cc1Cl ZINC000825768511 1032798730 /nfs/dbraw/zinc/79/87/30/1032798730.db2.gz PIFUQVDTNTZRFB-INIZCTEOSA-N 1 1 319.836 3.815 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)Cc2ccccc2C)c1O ZINC000387256909 1019063635 /nfs/dbraw/zinc/06/36/35/1019063635.db2.gz DWQHTPLHESRIGZ-UHFFFAOYSA-N 1 1 301.361 3.674 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@@]1(C)O ZINC001143103331 1019357311 /nfs/dbraw/zinc/35/73/11/1019357311.db2.gz AMGNUBVMWZKRNJ-AUUYWEPGSA-N 1 1 305.462 3.673 20 10 DHCDMO CC(C)[N@@H+](C)[C@H]1CCN(Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112296 1019401361 /nfs/dbraw/zinc/40/13/61/1019401361.db2.gz PEFHDGZWPTTYLT-INIZCTEOSA-N 1 1 304.478 3.604 20 10 DHCDMO CC(C)N(C)[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112296 1019401364 /nfs/dbraw/zinc/40/13/64/1019401364.db2.gz PEFHDGZWPTTYLT-INIZCTEOSA-N 1 1 304.478 3.604 20 10 DHCDMO CC(C)N(C)[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112296 1019401370 /nfs/dbraw/zinc/40/13/70/1019401370.db2.gz PEFHDGZWPTTYLT-INIZCTEOSA-N 1 1 304.478 3.604 20 10 DHCDMO CCCC[N@@H+](Cc1ccnn1CC1CC1)Cc1ccccc1O ZINC000825788397 1032834530 /nfs/dbraw/zinc/83/45/30/1032834530.db2.gz GSROPSKQJXMIKQ-UHFFFAOYSA-N 1 1 313.445 3.801 20 10 DHCDMO CCCC[N@@H+](Cc1c(C2CC2)cnn1C)Cc1ccccc1O ZINC000825788675 1032839941 /nfs/dbraw/zinc/83/99/41/1032839941.db2.gz ISGMZNCQMOLGBQ-UHFFFAOYSA-N 1 1 313.445 3.805 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](N3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000727170104 1019658469 /nfs/dbraw/zinc/65/84/69/1019658469.db2.gz SHLBSCVQPCRJPI-QGZVFWFLSA-N 1 1 316.489 3.668 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](N3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000727170104 1019658477 /nfs/dbraw/zinc/65/84/77/1019658477.db2.gz SHLBSCVQPCRJPI-QGZVFWFLSA-N 1 1 316.489 3.668 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000727467424 1019718390 /nfs/dbraw/zinc/71/83/90/1019718390.db2.gz XJILQPIJKGLPAQ-UHFFFAOYSA-N 1 1 308.429 3.699 20 10 DHCDMO CO[C@@H]1CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000728049212 1019866292 /nfs/dbraw/zinc/86/62/92/1019866292.db2.gz BMVLZAJMXIEPTK-CYBMUJFWSA-N 1 1 315.413 3.628 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC001171760091 1032863840 /nfs/dbraw/zinc/86/38/40/1032863840.db2.gz QMRYLPUTXQHILR-FXAWDEMLSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171760091 1032863861 /nfs/dbraw/zinc/86/38/61/1032863861.db2.gz QMRYLPUTXQHILR-FXAWDEMLSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171760091 1032863877 /nfs/dbraw/zinc/86/38/77/1032863877.db2.gz QMRYLPUTXQHILR-FXAWDEMLSA-N 1 1 324.468 3.877 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(Br)cc(F)c1[O-] ZINC000715819688 1020175379 /nfs/dbraw/zinc/17/53/79/1020175379.db2.gz ZBGJLSFFFIGMJD-DTORHVGOSA-N 1 1 302.187 3.667 20 10 DHCDMO CCCC[N@@H+](CCCn1ccnc1C)Cc1ccccc1O ZINC000282571314 1020464158 /nfs/dbraw/zinc/46/41/58/1020464158.db2.gz ZOKVPBIDYJGGQF-UHFFFAOYSA-N 1 1 301.434 3.590 20 10 DHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(O)c(C)c2O)cc1 ZINC001140748520 1020600549 /nfs/dbraw/zinc/60/05/49/1020600549.db2.gz HREQGBGJMADQPB-CYBMUJFWSA-N 1 1 301.386 3.608 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc3ncccc3c2)cc1 ZINC000155188058 1020739076 /nfs/dbraw/zinc/73/90/76/1020739076.db2.gz MUBPSRIIWCEUSJ-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO C[C@@H]1SCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)[C@H]1C ZINC000735668619 1020760280 /nfs/dbraw/zinc/76/02/80/1020760280.db2.gz JYLSQRJRDGTEAS-RYUDHWBXSA-N 1 1 309.475 3.721 20 10 DHCDMO CCN(CC)c1ccc(CN[C@H](C)C[NH+]2CCCCC2)cc1F ZINC000740001239 1020922978 /nfs/dbraw/zinc/92/29/78/1020922978.db2.gz IJBXOHIGKRVGHK-MRXNPFEDSA-N 1 1 321.484 3.636 20 10 DHCDMO C[C@H](NCC[N@@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274070 1021036255 /nfs/dbraw/zinc/03/62/55/1021036255.db2.gz SKOGRQWVUOSVNP-ROUUACIJSA-N 1 1 315.505 3.812 20 10 DHCDMO C[C@H](NCC[N@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274070 1021036261 /nfs/dbraw/zinc/03/62/61/1021036261.db2.gz SKOGRQWVUOSVNP-ROUUACIJSA-N 1 1 315.505 3.812 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)CCO1 ZINC000742160122 1021096299 /nfs/dbraw/zinc/09/62/99/1021096299.db2.gz BFULCDSDPCJHRR-OAQYLSRUSA-N 1 1 323.436 3.763 20 10 DHCDMO CC[N@H+](C)C[C@@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398920 1021284502 /nfs/dbraw/zinc/28/45/02/1021284502.db2.gz OSIXZGQDTSYMCG-INIZCTEOSA-N 1 1 304.478 3.598 20 10 DHCDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398920 1021284512 /nfs/dbraw/zinc/28/45/12/1021284512.db2.gz OSIXZGQDTSYMCG-INIZCTEOSA-N 1 1 304.478 3.598 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125775554 1032969633 /nfs/dbraw/zinc/96/96/33/1032969633.db2.gz NUKDMQHPCQVNDV-ROUUACIJSA-N 1 1 317.521 3.914 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125775554 1032969644 /nfs/dbraw/zinc/96/96/44/1032969644.db2.gz NUKDMQHPCQVNDV-ROUUACIJSA-N 1 1 317.521 3.914 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1cccc(Cl)c1 ZINC000743870485 1021396603 /nfs/dbraw/zinc/39/66/03/1021396603.db2.gz TWJAZKBBTYHMGS-SFHVURJKSA-N 1 1 319.832 3.991 20 10 DHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)n1 ZINC000877813681 1033463976 /nfs/dbraw/zinc/46/39/76/1033463976.db2.gz NPALWDKCVKGYBT-NSHDSACASA-N 1 1 308.834 3.800 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCc2ccco2)c1 ZINC000850407847 1021515183 /nfs/dbraw/zinc/51/51/83/1021515183.db2.gz QGXHLJDYOWJGQQ-UHFFFAOYSA-N 1 1 324.218 3.779 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H](C)c2nccn2C)cc1 ZINC000850410457 1021516877 /nfs/dbraw/zinc/51/68/77/1021516877.db2.gz MJZLPIFRIKGHEI-MRXNPFEDSA-N 1 1 314.477 3.897 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)c2ccc(OC)cc2)c1O ZINC000125813622 1032986857 /nfs/dbraw/zinc/98/68/57/1032986857.db2.gz COADGSNDFXMKPL-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCN(C2CCCCC2)C1)c1ccc(F)cc1O ZINC000850537912 1021591830 /nfs/dbraw/zinc/59/18/30/1021591830.db2.gz AZSMZHHTPDEYRF-ZFWWWQNUSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@@H]([NH2+]CC1CCC(O)CC1)c1cccc(C(F)(F)F)c1O ZINC000850552638 1021599662 /nfs/dbraw/zinc/59/96/62/1021599662.db2.gz PBCAILCDHIUCFW-VOMCLLRMSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+]CCC1SCCS1)c1cc(F)cc(F)c1O ZINC000850571059 1021614135 /nfs/dbraw/zinc/61/41/35/1021614135.db2.gz PZWXQYQSUREWQX-QMMMGPOBSA-N 1 1 305.415 3.517 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000182418778 1021648898 /nfs/dbraw/zinc/64/88/98/1021648898.db2.gz WYRMCKYTPKFHPN-GFCCVEGCSA-N 1 1 323.396 3.503 20 10 DHCDMO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)Cc1ccccc1O ZINC000109773306 1021745711 /nfs/dbraw/zinc/74/57/11/1021745711.db2.gz WXCDMXJRVAABMV-GFCCVEGCSA-N 1 1 318.804 3.505 20 10 DHCDMO CC(C)c1ccc(NC(=O)C[N@H+](C)Cc2ccccc2O)cc1 ZINC000109769521 1021746801 /nfs/dbraw/zinc/74/68/01/1021746801.db2.gz IAFPHCZFSKDMFQ-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO CC(C)c1ccc(NC(=O)C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000109769521 1021746815 /nfs/dbraw/zinc/74/68/15/1021746815.db2.gz IAFPHCZFSKDMFQ-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO C[N@@H+](CCC(=O)Nc1ccc(Cl)cc1)Cc1ccccc1O ZINC000109769061 1021746921 /nfs/dbraw/zinc/74/69/21/1021746921.db2.gz SHQNSFWCZVMQQM-UHFFFAOYSA-N 1 1 318.804 3.506 20 10 DHCDMO C[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccccc1O ZINC000109771481 1021747525 /nfs/dbraw/zinc/74/75/25/1021747525.db2.gz GTXBTTCLUOOAAJ-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccccc1O ZINC000109771481 1021747537 /nfs/dbraw/zinc/74/75/37/1021747537.db2.gz GTXBTTCLUOOAAJ-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000746025110 1021828312 /nfs/dbraw/zinc/82/83/12/1021828312.db2.gz JXDIKRKOOOUXQF-ZDUSSCGKSA-N 1 1 311.381 3.847 20 10 DHCDMO CC(C)[N@@H+](Cc1cccs1)Cc1cc2c(cc1O)OCO2 ZINC000919957217 1021986766 /nfs/dbraw/zinc/98/67/66/1021986766.db2.gz UHRQCAPBMTURQG-UHFFFAOYSA-N 1 1 305.399 3.593 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000179661357 1022071897 /nfs/dbraw/zinc/07/18/97/1022071897.db2.gz LEHNKHYIFKLUQZ-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)ccc1N(C)C ZINC000852596354 1022147383 /nfs/dbraw/zinc/14/73/83/1022147383.db2.gz LFCJBAFWWOUNDB-ICSRJNTNSA-N 1 1 316.489 3.842 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)c1 ZINC000763620139 1022157522 /nfs/dbraw/zinc/15/75/22/1022157522.db2.gz FUNXMLWWYQALPR-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO C[C@H](CC[NH2+][C@@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183541040 1022181178 /nfs/dbraw/zinc/18/11/78/1022181178.db2.gz QMDWPXZUOFGKRC-SJORKVTESA-N 1 1 312.457 3.953 20 10 DHCDMO C[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241443 1022240977 /nfs/dbraw/zinc/24/09/77/1022240977.db2.gz VFFXRVDYUWOLLD-SJLPKXTDSA-N 1 1 315.505 3.525 20 10 DHCDMO C[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241443 1022240983 /nfs/dbraw/zinc/24/09/83/1022240983.db2.gz VFFXRVDYUWOLLD-SJLPKXTDSA-N 1 1 315.505 3.525 20 10 DHCDMO Cc1n[nH]cc1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278824694 1022250126 /nfs/dbraw/zinc/25/01/26/1022250126.db2.gz SSUNVNHAEPUYTO-QMMMGPOBSA-N 1 1 300.189 3.581 20 10 DHCDMO Cn1c2ccc(Cl)cc2nc1C[N@H+](C)Cc1ccccc1O ZINC000111235033 1022252241 /nfs/dbraw/zinc/25/22/41/1022252241.db2.gz NVURFDTUDJGLOF-UHFFFAOYSA-N 1 1 315.804 3.564 20 10 DHCDMO Cn1c2ccc(Cl)cc2nc1C[N@@H+](C)Cc1ccccc1O ZINC000111235033 1022252247 /nfs/dbraw/zinc/25/22/47/1022252247.db2.gz NVURFDTUDJGLOF-UHFFFAOYSA-N 1 1 315.804 3.564 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000179553449 1022470413 /nfs/dbraw/zinc/47/04/13/1022470413.db2.gz OAEFNWLVUGDXBO-INIZCTEOSA-N 1 1 311.381 3.501 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccccc2OC)C2CC2)c1 ZINC000179679430 1022506916 /nfs/dbraw/zinc/50/69/16/1022506916.db2.gz OHTFCBKYPBJMIL-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO C[C@H](COc1ccccc1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756497048 1022535736 /nfs/dbraw/zinc/53/57/36/1022535736.db2.gz ZZEDMYSTVPOZBL-NEPJUHHUSA-N 1 1 307.340 3.789 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCOCC1)CCCC2 ZINC000776769689 1022559170 /nfs/dbraw/zinc/55/91/70/1022559170.db2.gz VWYJIQWPDBIOBR-IBGZPJMESA-N 1 1 315.457 3.662 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H](CCF)C1 ZINC000689882362 1022704149 /nfs/dbraw/zinc/70/41/49/1022704149.db2.gz OIVGIHIWLXCXTM-LLVKDONJSA-N 1 1 316.214 3.726 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000689882362 1022704163 /nfs/dbraw/zinc/70/41/63/1022704163.db2.gz OIVGIHIWLXCXTM-LLVKDONJSA-N 1 1 316.214 3.726 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(C)c3)C2)c1O ZINC000180414515 1022724927 /nfs/dbraw/zinc/72/49/27/1022724927.db2.gz ZWTLXWGUMIQNLW-GOSISDBHSA-N 1 1 315.388 3.722 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)n1 ZINC000768132708 1022901145 /nfs/dbraw/zinc/90/11/45/1022901145.db2.gz IRFKXQPZAINLOV-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO Oc1ccc(Br)cc1C[N@@H+]1CCc2sccc2C1 ZINC000768227978 1022928467 /nfs/dbraw/zinc/92/84/67/1022928467.db2.gz XBQBHYHOEVJLMI-UHFFFAOYSA-N 1 1 324.243 3.775 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCc2sccc2C1 ZINC000768227978 1022928480 /nfs/dbraw/zinc/92/84/80/1022928480.db2.gz XBQBHYHOEVJLMI-UHFFFAOYSA-N 1 1 324.243 3.775 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000768230176 1022930256 /nfs/dbraw/zinc/93/02/56/1022930256.db2.gz RZZFVUITTGRKJN-SFHVURJKSA-N 1 1 311.425 3.998 20 10 DHCDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)c(C)c1 ZINC000768269343 1022935440 /nfs/dbraw/zinc/93/54/40/1022935440.db2.gz RHTDNWAPGVZNHU-CQSZACIVSA-N 1 1 313.397 3.931 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C)CCC(C)C)c1O ZINC000768262992 1022936728 /nfs/dbraw/zinc/93/67/28/1022936728.db2.gz NHORDDRDDXDSKQ-UHFFFAOYSA-N 1 1 316.239 3.641 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc3c(c2)COC3)C2CC2)cc1 ZINC000768257179 1022937071 /nfs/dbraw/zinc/93/70/71/1022937071.db2.gz IXHZHTUJAGHJHX-UHFFFAOYSA-N 1 1 322.452 3.947 20 10 DHCDMO CCCC[N@H+](C)CC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000768304209 1022942990 /nfs/dbraw/zinc/94/29/90/1022942990.db2.gz UOKSEPGCYOACLU-UHFFFAOYSA-N 1 1 324.896 3.990 20 10 DHCDMO CCCC[N@@H+](C)CC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000768304209 1022942998 /nfs/dbraw/zinc/94/29/98/1022942998.db2.gz UOKSEPGCYOACLU-UHFFFAOYSA-N 1 1 324.896 3.990 20 10 DHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(C)cc2O)C1 ZINC000768465365 1022973093 /nfs/dbraw/zinc/97/30/93/1022973093.db2.gz HJTARZOGVHTBBI-GJZGRUSLSA-N 1 1 309.475 3.815 20 10 DHCDMO CCC(CC)[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876571474 1033095673 /nfs/dbraw/zinc/09/56/73/1033095673.db2.gz YSDGMISQBUMXMK-UHFFFAOYSA-N 1 1 316.489 3.801 20 10 DHCDMO COc1cccc(C[N@@H+](C)CCCOc2ccccc2C)c1O ZINC000768921153 1023057725 /nfs/dbraw/zinc/05/77/25/1023057725.db2.gz WUMNAPXMLUWTGN-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[O-])CC1 ZINC000768926821 1023058257 /nfs/dbraw/zinc/05/82/57/1023058257.db2.gz OGOZDVCLJPPQSC-UHFFFAOYSA-N 1 1 310.869 3.598 20 10 DHCDMO CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[O-])CC1 ZINC000768926821 1023058265 /nfs/dbraw/zinc/05/82/65/1023058265.db2.gz OGOZDVCLJPPQSC-UHFFFAOYSA-N 1 1 310.869 3.598 20 10 DHCDMO COc1ccc2c(c1)C[N@H+](Cc1c(O)cccc1Cl)CC2 ZINC000769119559 1023086178 /nfs/dbraw/zinc/08/61/78/1023086178.db2.gz CFGJPOFYESBELC-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)C(C)C ZINC000769155873 1023092851 /nfs/dbraw/zinc/09/28/51/1023092851.db2.gz YZZGPFGPWXCHJG-HNNXBMFYSA-N 1 1 308.441 3.529 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c1 ZINC000769244758 1023108003 /nfs/dbraw/zinc/10/80/03/1023108003.db2.gz ORGZKVYQURJIIV-AZUAARDMSA-N 1 1 311.425 3.789 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000769332433 1023124755 /nfs/dbraw/zinc/12/47/55/1023124755.db2.gz DQLSOJNGPNYWIH-UHFFFAOYSA-N 1 1 316.420 3.575 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000769380290 1023135385 /nfs/dbraw/zinc/13/53/85/1023135385.db2.gz FWYPTWNSZMPOPD-LLVKDONJSA-N 1 1 306.431 3.667 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000769385345 1023137682 /nfs/dbraw/zinc/13/76/82/1023137682.db2.gz WDTJBRUYWOYYLQ-UHFFFAOYSA-N 1 1 300.450 3.668 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000769385345 1023137686 /nfs/dbraw/zinc/13/76/86/1023137686.db2.gz WDTJBRUYWOYYLQ-UHFFFAOYSA-N 1 1 300.450 3.668 20 10 DHCDMO C[C@]1(c2ccccc2)C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769399877 1023139197 /nfs/dbraw/zinc/13/91/97/1023139197.db2.gz WOHDAOJGPPYFDP-GOSISDBHSA-N 1 1 317.816 3.793 20 10 DHCDMO C[C@]1(c2ccccc2)C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769399877 1023139199 /nfs/dbraw/zinc/13/91/99/1023139199.db2.gz WOHDAOJGPPYFDP-GOSISDBHSA-N 1 1 317.816 3.793 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000769399219 1023141646 /nfs/dbraw/zinc/14/16/46/1023141646.db2.gz XZHHIJXERFDEDT-HNNXBMFYSA-N 1 1 315.388 3.920 20 10 DHCDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769405385 1023142760 /nfs/dbraw/zinc/14/27/60/1023142760.db2.gz UXWZFDKRMFYNNR-KPFFTGBYSA-N 1 1 314.473 3.676 20 10 DHCDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC000769421686 1023145463 /nfs/dbraw/zinc/14/54/63/1023145463.db2.gz CIBCDTIEJJYYGE-QGZVFWFLSA-N 1 1 322.468 3.920 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000769481886 1023152123 /nfs/dbraw/zinc/15/21/23/1023152123.db2.gz ANRPKFDXLQNIKQ-FXAWDEMLSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCN(CC)C[C@@H]2C)cc1 ZINC000769481886 1023152137 /nfs/dbraw/zinc/15/21/37/1023152137.db2.gz ANRPKFDXLQNIKQ-FXAWDEMLSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCN(CC)C[C@@H]2C)cc1 ZINC000769481886 1023152141 /nfs/dbraw/zinc/15/21/41/1023152141.db2.gz ANRPKFDXLQNIKQ-FXAWDEMLSA-N 1 1 317.521 3.695 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000769464790 1023159783 /nfs/dbraw/zinc/15/97/83/1023159783.db2.gz ANVMVIRFNUYCII-ZFWWWQNUSA-N 1 1 315.388 3.918 20 10 DHCDMO CCC[N@@H+](Cc1cc(C)ccc1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000769471642 1023163301 /nfs/dbraw/zinc/16/33/01/1023163301.db2.gz WXBWJRMFSIDTEK-KBAYOESNSA-N 1 1 303.446 3.726 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000769497794 1023166005 /nfs/dbraw/zinc/16/60/05/1023166005.db2.gz BHULPBXEVHQXMB-RDJZCZTQSA-N 1 1 311.425 3.854 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCSC2(CCCCC2)C1 ZINC000769502137 1023169052 /nfs/dbraw/zinc/16/90/52/1023169052.db2.gz UZPHAJZPQUBNGQ-UHFFFAOYSA-N 1 1 307.459 3.653 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)cc1F ZINC000769514280 1023171118 /nfs/dbraw/zinc/17/11/18/1023171118.db2.gz IJYGEJDXUGWMCQ-SJORKVTESA-N 1 1 320.452 3.530 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)c1 ZINC000769537989 1023175961 /nfs/dbraw/zinc/17/59/61/1023175961.db2.gz OGBKQUKOKCCXPY-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO C[N@@H+](CCOCC1CCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000770290493 1023293292 /nfs/dbraw/zinc/29/32/92/1023293292.db2.gz CEFKLGKMCBLVBK-UHFFFAOYSA-N 1 1 316.489 3.925 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](CC(=O)OC(C)(C)C)C2)c1 ZINC000770331960 1023293507 /nfs/dbraw/zinc/29/35/07/1023293507.db2.gz JYNDWQKYXCZBEH-HNNXBMFYSA-N 1 1 319.445 3.644 20 10 DHCDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000770510038 1023315734 /nfs/dbraw/zinc/31/57/34/1023315734.db2.gz VURWMPZSMLUGSI-QFBILLFUSA-N 1 1 302.462 3.534 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000770508682 1023316801 /nfs/dbraw/zinc/31/68/01/1023316801.db2.gz DLVGJEWKRVPJGD-UHFFFAOYSA-N 1 1 305.381 3.558 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cc(F)c(F)cc2F)cc1 ZINC000771934886 1023489599 /nfs/dbraw/zinc/48/95/99/1023489599.db2.gz FXCITVPIFKXVCO-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(F)c(F)cc2F)cc1 ZINC000771934886 1023489602 /nfs/dbraw/zinc/48/96/02/1023489602.db2.gz FXCITVPIFKXVCO-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1 ZINC000787417502 1023790768 /nfs/dbraw/zinc/79/07/68/1023790768.db2.gz OCWQLDGDGWGAGJ-AWEZNQCLSA-N 1 1 300.368 3.915 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000746717648 1023834234 /nfs/dbraw/zinc/83/42/34/1023834234.db2.gz YQRVHNRZLSXFNW-QGZVFWFLSA-N 1 1 304.393 3.930 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccc(F)cc1O ZINC000796800957 1023857315 /nfs/dbraw/zinc/85/73/15/1023857315.db2.gz XGXSXZUPCSQICW-SJORKVTESA-N 1 1 309.425 3.903 20 10 DHCDMO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788606860 1023912341 /nfs/dbraw/zinc/91/23/41/1023912341.db2.gz AYKWASSFEOYNLP-GRYCIOLGSA-N 1 1 319.367 3.859 20 10 DHCDMO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H](O)c1ccccc1 ZINC000788623034 1023915651 /nfs/dbraw/zinc/91/56/51/1023915651.db2.gz VCDMBOIRBKPQPB-MJXNMMHHSA-N 1 1 317.404 3.940 20 10 DHCDMO C[C@H]1CC[C@@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)O1 ZINC000789306483 1024041879 /nfs/dbraw/zinc/04/18/79/1024041879.db2.gz OYADKLYAJXCICS-LPHOPBHVSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC=C(c3ccccc3)C2)c1O ZINC000789544815 1024111686 /nfs/dbraw/zinc/11/16/86/1024111686.db2.gz DVJUQXWENCXRPC-UHFFFAOYSA-N 1 1 309.409 3.999 20 10 DHCDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882899476 1024164117 /nfs/dbraw/zinc/16/41/17/1024164117.db2.gz NYLFWBGALWHGNX-SECBINFHSA-N 1 1 311.303 3.669 20 10 DHCDMO Cc1cc(C[N@@H+](C)CCCn2ccnc2)c(O)c(C(C)(C)C)c1 ZINC000130591256 1024189863 /nfs/dbraw/zinc/18/98/63/1024189863.db2.gz NDYWUHSTOBQWJJ-UHFFFAOYSA-N 1 1 315.461 3.717 20 10 DHCDMO CC[C@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000269054837 1024232543 /nfs/dbraw/zinc/23/25/43/1024232543.db2.gz WNKAMEIBNMXNRI-FQEVSTJZSA-N 1 1 315.505 3.810 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC000883131733 1024254119 /nfs/dbraw/zinc/25/41/19/1024254119.db2.gz PYFKZYLCGFRSBR-LLVKDONJSA-N 1 1 307.365 3.650 20 10 DHCDMO CN1CCCc2cc(C[NH2+]Cc3nc4ccccc4o3)ccc21 ZINC000876987276 1033197009 /nfs/dbraw/zinc/19/70/09/1033197009.db2.gz VVRHTQPLSAIXSO-UHFFFAOYSA-N 1 1 307.397 3.500 20 10 DHCDMO CC(C)(C)c1ccncc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883145529 1024258568 /nfs/dbraw/zinc/25/85/68/1024258568.db2.gz FELJOAHFWLXFLB-UHFFFAOYSA-N 1 1 306.356 3.653 20 10 DHCDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)cn1 ZINC000790958725 1024404716 /nfs/dbraw/zinc/40/47/16/1024404716.db2.gz MCWUOEFUGGYYDK-SNVBAGLBSA-N 1 1 311.788 3.813 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1O ZINC000271158710 1024464400 /nfs/dbraw/zinc/46/44/00/1024464400.db2.gz DVSGVLPYEZNTFW-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC3(CCOCC3)C2)c(O)c1 ZINC000271210815 1024471283 /nfs/dbraw/zinc/47/12/83/1024471283.db2.gz YKNKNKHVBOUUFO-UHFFFAOYSA-N 1 1 319.445 3.574 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310167924 1024494988 /nfs/dbraw/zinc/49/49/88/1024494988.db2.gz SPAAPPAZLFVEPJ-IEBWSBKVSA-N 1 1 324.468 3.701 20 10 DHCDMO Oc1ccccc1C[N@H+](C[C@@H](O)c1ccccc1)C1CCCC1 ZINC000791459730 1024506503 /nfs/dbraw/zinc/50/65/03/1024506503.db2.gz UVYWHKQTNDGGKJ-HXUWFJFHSA-N 1 1 311.425 3.870 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC000792179393 1024642959 /nfs/dbraw/zinc/64/29/59/1024642959.db2.gz GWFMULDPQYTNLP-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000792174175 1024643124 /nfs/dbraw/zinc/64/31/24/1024643124.db2.gz RRNAQZUBSRLVAJ-AWEZNQCLSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000792174175 1024643129 /nfs/dbraw/zinc/64/31/29/1024643129.db2.gz RRNAQZUBSRLVAJ-AWEZNQCLSA-N 1 1 313.800 3.576 20 10 DHCDMO Cc1ccnc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000792247960 1024652152 /nfs/dbraw/zinc/65/21/52/1024652152.db2.gz BLJUCMSOLIXZBC-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1ccnc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000792247960 1024652172 /nfs/dbraw/zinc/65/21/72/1024652172.db2.gz BLJUCMSOLIXZBC-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](C(C)C)N1CCCC1)c1ccc(F)cc1O ZINC000796696004 1024658991 /nfs/dbraw/zinc/65/89/91/1024658991.db2.gz PCIGWUOBKRVTOR-SJORKVTESA-N 1 1 308.441 3.692 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccccc1SC ZINC000793233956 1024947630 /nfs/dbraw/zinc/94/76/30/1024947630.db2.gz XASWZMVTXKSJDB-UHFFFAOYSA-N 1 1 303.427 3.755 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)cc1F ZINC000793620454 1025135130 /nfs/dbraw/zinc/13/51/30/1025135130.db2.gz PGFQZDGDPKHFMY-IBGZPJMESA-N 1 1 320.452 3.674 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC000793706824 1025152294 /nfs/dbraw/zinc/15/22/94/1025152294.db2.gz UWBMIBWMIUZANI-CYBMUJFWSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC000793706824 1025152302 /nfs/dbraw/zinc/15/23/02/1025152302.db2.gz UWBMIBWMIUZANI-CYBMUJFWSA-N 1 1 317.351 3.551 20 10 DHCDMO CC[C@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000796954974 1025175204 /nfs/dbraw/zinc/17/52/04/1025175204.db2.gz TYKYIMVYWPLOKM-PKOBYXMFSA-N 1 1 317.404 3.870 20 10 DHCDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877313456 1033279787 /nfs/dbraw/zinc/27/97/87/1033279787.db2.gz UIXSSTDMAKZQDK-KRWDZBQOSA-N 1 1 316.489 3.516 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](CC1=NOCC1)Cc1ccccc1O ZINC001168244936 1025385622 /nfs/dbraw/zinc/38/56/22/1025385622.db2.gz VKYAHPDXWFDQFI-HNNXBMFYSA-N 1 1 310.397 3.732 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1C[C@]12CCOC2 ZINC000885940675 1025412100 /nfs/dbraw/zinc/41/21/00/1025412100.db2.gz OWEZCRFPMYDJHP-QUCCMNQESA-N 1 1 314.473 3.535 20 10 DHCDMO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886505032 1025659048 /nfs/dbraw/zinc/65/90/48/1025659048.db2.gz FZCOOSALHHAEBS-LBPRGKRZSA-N 1 1 304.365 3.564 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886527933 1025676161 /nfs/dbraw/zinc/67/61/61/1025676161.db2.gz CSOTXJVTYBWGNU-ZDUSSCGKSA-N 1 1 302.393 3.757 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1c(O)cccc1F ZINC000886547311 1025695220 /nfs/dbraw/zinc/69/52/20/1025695220.db2.gz IZXKZPNGMAHXOM-QMTHXVAHSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1c(O)cccc1F ZINC000886597083 1025731414 /nfs/dbraw/zinc/73/14/14/1025731414.db2.gz VXIPSANVUWPRDJ-HZMBPMFUSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1c(O)cccc1F ZINC000886644928 1025756019 /nfs/dbraw/zinc/75/60/19/1025756019.db2.gz OHOPSYYJCQRWBH-PNPHSEOMSA-N 1 1 301.361 3.712 20 10 DHCDMO CC(C)[C@H](CO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000806170035 1025798473 /nfs/dbraw/zinc/79/84/73/1025798473.db2.gz VTBJXOGRRDWUAV-UWVGGRQHSA-N 1 1 306.233 3.614 20 10 DHCDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc(OC)c2O)s1 ZINC000093612540 1026118003 /nfs/dbraw/zinc/11/80/03/1026118003.db2.gz GRMNIIPNDUDYEG-GFCCVEGCSA-N 1 1 320.458 3.921 20 10 DHCDMO CCCOc1ccc(C[N@@H+](CC)CCc2nccs2)c(O)c1 ZINC000093764636 1026124344 /nfs/dbraw/zinc/12/43/44/1026124344.db2.gz HIWPVRYYQWSDBT-UHFFFAOYSA-N 1 1 320.458 3.702 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1 ZINC000093769047 1026126669 /nfs/dbraw/zinc/12/66/69/1026126669.db2.gz HJIQAJRQSCZMRF-GUYCJALGSA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c1 ZINC000289811692 1026185105 /nfs/dbraw/zinc/18/51/05/1026185105.db2.gz SXFOHSOWZGTJMO-AABGKKOBSA-N 1 1 323.436 3.705 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)Cc2ccncc2)cc1 ZINC000289907588 1026229628 /nfs/dbraw/zinc/22/96/28/1026229628.db2.gz UWMJZHPLJLZZRP-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)Cc2ccncc2)cc1 ZINC000289907588 1026229638 /nfs/dbraw/zinc/22/96/38/1026229638.db2.gz UWMJZHPLJLZZRP-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC001204931510 1026296813 /nfs/dbraw/zinc/29/68/13/1026296813.db2.gz YRSVOQQDGDAJBO-UHFFFAOYSA-N 1 1 303.352 3.878 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000808729096 1026381443 /nfs/dbraw/zinc/38/14/43/1026381443.db2.gz ZHPPVFIBPNHEMZ-BLLLJJGKSA-N 1 1 301.361 3.748 20 10 DHCDMO CC[C@H]([NH2+][C@H]1COc2ccc(F)cc2C1)c1ccc(F)cc1O ZINC000808730062 1026383172 /nfs/dbraw/zinc/38/31/72/1026383172.db2.gz SAXDIRLDRKHYNO-ZBFHGGJFSA-N 1 1 319.351 3.715 20 10 DHCDMO Cc1cc(O)c(C[N@H+](CCN(C)C)Cc2ccccc2)cc1C ZINC000809727991 1026595468 /nfs/dbraw/zinc/59/54/68/1026595468.db2.gz GFWQWUXSYIDGDN-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](CCN(C)C)Cc2ccccc2)cc1C ZINC000809727991 1026595473 /nfs/dbraw/zinc/59/54/73/1026595473.db2.gz GFWQWUXSYIDGDN-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(N(CC)CC)cc1)C2 ZINC000809707129 1026600310 /nfs/dbraw/zinc/60/03/10/1026600310.db2.gz CWYHKZVKGGYXPC-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO Cc1cccc(C[N@@H+](CCN(C)C)Cc2cc(C)ccc2O)c1 ZINC000809741776 1026612930 /nfs/dbraw/zinc/61/29/30/1026612930.db2.gz WAWGMUNDBFRUID-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1cccc(C[N@H+](CCN(C)C)Cc2cc(C)ccc2O)c1 ZINC000809741776 1026612933 /nfs/dbraw/zinc/61/29/33/1026612933.db2.gz WAWGMUNDBFRUID-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccccc2)C2CCN(C)CC2)c1O ZINC000809764538 1026620952 /nfs/dbraw/zinc/62/09/52/1026620952.db2.gz JUKGJIQGVQSBMJ-UHFFFAOYSA-N 1 1 324.468 3.797 20 10 DHCDMO CC[N@H+](Cc1cc(Br)cc(OC)c1O)CC(C)C ZINC000768335254 1026697829 /nfs/dbraw/zinc/69/78/29/1026697829.db2.gz KRXBZLGZKPSONV-UHFFFAOYSA-N 1 1 316.239 3.641 20 10 DHCDMO CC[C@H]([NH2+]Cc1cocn1)c1ccc(C(F)(F)F)cc1O ZINC000810232028 1026715300 /nfs/dbraw/zinc/71/53/00/1026715300.db2.gz USOIZPGWPHTDMB-LBPRGKRZSA-N 1 1 300.280 3.640 20 10 DHCDMO Cc1cnc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)s1 ZINC000295294541 1027183778 /nfs/dbraw/zinc/18/37/78/1027183778.db2.gz XGBVRPVPULTHBW-UHFFFAOYSA-N 1 1 315.486 3.978 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C)[C@H](C)C3)cc2)CC1 ZINC000828576519 1027205145 /nfs/dbraw/zinc/20/51/45/1027205145.db2.gz NCEYNBUMTVJLIQ-DLBZAZTESA-N 1 1 316.489 3.780 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1F ZINC000295348195 1027216155 /nfs/dbraw/zinc/21/61/55/1027216155.db2.gz YSKWGYLLVUDRFM-XJKSGUPXSA-N 1 1 316.424 3.664 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C(C)C)C3CC3)cc2)CC1 ZINC000295591280 1027348749 /nfs/dbraw/zinc/34/87/49/1027348749.db2.gz SVAWCGGLVIEDCW-UHFFFAOYSA-N 1 1 302.462 3.675 20 10 DHCDMO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1cc2c(cc1O)CCCC2 ZINC000296286400 1027596894 /nfs/dbraw/zinc/59/68/94/1027596894.db2.gz FHADAYOHSZLOLH-DXJOGWAWSA-N 1 1 314.473 3.547 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(CO)cc2)cc1 ZINC000778932995 1027601056 /nfs/dbraw/zinc/60/10/56/1027601056.db2.gz GLTXFHZTWKWFRB-UHFFFAOYSA-N 1 1 312.457 3.657 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(CO)cc1)Cc1ccc(N(C)C)cc1 ZINC000778939703 1027607802 /nfs/dbraw/zinc/60/78/02/1027607802.db2.gz ONUUKKIQPXFODE-UHFFFAOYSA-N 1 1 312.457 3.656 20 10 DHCDMO C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000296595204 1027681180 /nfs/dbraw/zinc/68/11/80/1027681180.db2.gz VFSHTJNLRNNZKV-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000778996027 1027747179 /nfs/dbraw/zinc/74/71/79/1027747179.db2.gz KJHGJQIDDVDBOE-MRXNPFEDSA-N 1 1 303.402 3.821 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@@H](C)CO1 ZINC000779021303 1027870681 /nfs/dbraw/zinc/87/06/81/1027870681.db2.gz YOXPUEDBDDUDHM-IFXJQAMLSA-N 1 1 315.388 3.802 20 10 DHCDMO CN1CC[C@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178113 1027913862 /nfs/dbraw/zinc/91/38/62/1027913862.db2.gz CGHOPBVLAGZMJM-NRFANRHFSA-N 1 1 322.452 3.587 20 10 DHCDMO CN1CC[C@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178113 1027913874 /nfs/dbraw/zinc/91/38/74/1027913874.db2.gz CGHOPBVLAGZMJM-NRFANRHFSA-N 1 1 322.452 3.587 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](c3ccccc3)C1)OCO2 ZINC000814226409 1027961445 /nfs/dbraw/zinc/96/14/45/1027961445.db2.gz WMXJNWGCNPERDW-OAHLLOKOSA-N 1 1 311.381 3.501 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000367718090 1028229810 /nfs/dbraw/zinc/22/98/10/1028229810.db2.gz FFWVAHKBERLSIV-AWEZNQCLSA-N 1 1 305.809 3.723 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+][C@H]1CCCc2occc21 ZINC000048795417 1028250992 /nfs/dbraw/zinc/25/09/92/1028250992.db2.gz LYMSOHHPABGAEH-ZDUSSCGKSA-N 1 1 322.202 3.915 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+][C@@H]1CCCc2occc21 ZINC000048795415 1028251344 /nfs/dbraw/zinc/25/13/44/1028251344.db2.gz LYMSOHHPABGAEH-CYBMUJFWSA-N 1 1 322.202 3.915 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@@H]2c2cc(C)on2)c1 ZINC000368046118 1028289489 /nfs/dbraw/zinc/28/94/89/1028289489.db2.gz YOFHHVCOFXQUST-MLGOLLRUSA-N 1 1 302.374 3.595 20 10 DHCDMO COC1(CC[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCC1 ZINC000815019940 1028329334 /nfs/dbraw/zinc/32/93/34/1028329334.db2.gz WCHAFIUQPWRIOO-UHFFFAOYSA-N 1 1 304.478 3.922 20 10 DHCDMO Cc1cc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)ccc1N(C)C ZINC000815052158 1028334937 /nfs/dbraw/zinc/33/49/37/1028334937.db2.gz DZAHQIXMZGUWLO-LJQANCHMSA-N 1 1 315.505 3.511 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1N(C)C ZINC000815080547 1028352097 /nfs/dbraw/zinc/35/20/97/1028352097.db2.gz SMMYKPVECAGUPX-MJGOQNOKSA-N 1 1 316.489 3.700 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccccc1O ZINC000368484440 1028363462 /nfs/dbraw/zinc/36/34/62/1028363462.db2.gz YIPIBUJRXOEHSA-KNBMTAEXSA-N 1 1 310.441 3.736 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCCO1)c1cccc(C(F)(F)F)c1O ZINC000815566288 1028546556 /nfs/dbraw/zinc/54/65/56/1028546556.db2.gz OLGSPOXINSQFBJ-QWRGUYRKSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1cccc(C(F)(F)F)c1O ZINC000815589388 1028559511 /nfs/dbraw/zinc/55/95/11/1028559511.db2.gz QPJAYXOXZNKKES-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(O)c1)c1cccc(C(F)(F)F)c1O ZINC000815573616 1028566660 /nfs/dbraw/zinc/56/66/60/1028566660.db2.gz OPXYCJDVNILMKF-JTQLQIEISA-N 1 1 311.303 3.967 20 10 DHCDMO COCCCCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815571556 1028567925 /nfs/dbraw/zinc/56/79/25/1028567925.db2.gz GYBFUXKPNVGONX-LLVKDONJSA-N 1 1 305.340 3.878 20 10 DHCDMO COC1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CCC1 ZINC000815614661 1028572904 /nfs/dbraw/zinc/57/29/04/1028572904.db2.gz YAAWZAPBKVFOIC-SNVBAGLBSA-N 1 1 303.324 3.631 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccc(F)cc1O ZINC000815648172 1028593282 /nfs/dbraw/zinc/59/32/82/1028593282.db2.gz GHNPGQJWMQGLKR-RHSMWYFYSA-N 1 1 309.425 3.761 20 10 DHCDMO CO[C@@H](C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C1CC1 ZINC000815651201 1028595427 /nfs/dbraw/zinc/59/54/27/1028595427.db2.gz NGTULINVHISLIO-CLAHSXSESA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1ccc(N2CCCCC2)cc1 ZINC000370662699 1028630824 /nfs/dbraw/zinc/63/08/24/1028630824.db2.gz NNQFTVAVLZOLIR-YJBOKZPZSA-N 1 1 324.472 3.608 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@@H](n2nc(C)cc2C)C1 ZINC000372597181 1028874717 /nfs/dbraw/zinc/87/47/17/1028874717.db2.gz XUJIVPPEFIDESN-AEFFLSMTSA-N 1 1 313.445 3.994 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000372595040 1028876012 /nfs/dbraw/zinc/87/60/12/1028876012.db2.gz OVLKJTMUCCPYMP-HKUYNNGSSA-N 1 1 313.397 3.622 20 10 DHCDMO COCC[N@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816480888 1028888247 /nfs/dbraw/zinc/88/82/47/1028888247.db2.gz AAVZOGOQRQTCSA-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO COCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816480888 1028888259 /nfs/dbraw/zinc/88/82/59/1028888259.db2.gz AAVZOGOQRQTCSA-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO CCc1nocc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000816487269 1028892682 /nfs/dbraw/zinc/89/26/82/1028892682.db2.gz IBLDMAZOCODGED-UHFFFAOYSA-N 1 1 301.434 3.714 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000816515449 1028915578 /nfs/dbraw/zinc/91/55/78/1028915578.db2.gz ZTQOMHACQNDKAS-INIZCTEOSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000816515449 1028915606 /nfs/dbraw/zinc/91/56/06/1028915606.db2.gz ZTQOMHACQNDKAS-INIZCTEOSA-N 1 1 313.800 3.577 20 10 DHCDMO C[C@H](COc1ccccc1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816541935 1028927271 /nfs/dbraw/zinc/92/72/71/1028927271.db2.gz YNXBGBHJCXOLMN-LLVKDONJSA-N 1 1 309.768 3.742 20 10 DHCDMO CS[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816549960 1028929698 /nfs/dbraw/zinc/92/96/98/1028929698.db2.gz DGSWWTAEBKUFJK-QWRGUYRKSA-N 1 1 303.830 3.949 20 10 DHCDMO CC(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554781 1028942602 /nfs/dbraw/zinc/94/26/02/1028942602.db2.gz IVUPRMPHZVHJGT-ZBEGNZNMSA-N 1 1 315.816 3.726 20 10 DHCDMO CC(C)(C[NH2+]Cc1cc(Cl)c(F)cc1O)[C@H]1CCCCO1 ZINC000816556661 1028942922 /nfs/dbraw/zinc/94/29/22/1028942922.db2.gz QQNNRSRJVOPIGH-OAHLLOKOSA-N 1 1 315.816 3.870 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H]2C2CCOCC2)ccc2ccccc21 ZINC000816560477 1028943790 /nfs/dbraw/zinc/94/37/90/1028943790.db2.gz PZEXEYQYYOJPAV-LJQANCHMSA-N 1 1 311.425 3.936 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000816559918 1028944131 /nfs/dbraw/zinc/94/41/31/1028944131.db2.gz YXVOGRCUDRLLCL-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc3ccccc3c2[O-])c1 ZINC000816561876 1028944599 /nfs/dbraw/zinc/94/45/99/1028944599.db2.gz PADPCIYOQNGKTH-UHFFFAOYSA-N 1 1 320.436 3.897 20 10 DHCDMO Cc1ccc(C[N@@H+](CCO)Cc2ccc3ccccc3c2O)cc1 ZINC000816567300 1028947449 /nfs/dbraw/zinc/94/74/49/1028947449.db2.gz WMQTTWJJUXQOCS-UHFFFAOYSA-N 1 1 321.420 3.848 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000816566839 1028949120 /nfs/dbraw/zinc/94/91/20/1028949120.db2.gz IKOHSDPYSBTGNL-ZDUSSCGKSA-N 1 1 320.795 3.644 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000816566839 1028949127 /nfs/dbraw/zinc/94/91/27/1028949127.db2.gz IKOHSDPYSBTGNL-ZDUSSCGKSA-N 1 1 320.795 3.644 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594754 1028956262 /nfs/dbraw/zinc/95/62/62/1028956262.db2.gz OGSDGCXSWYGKJE-CBAPKCEASA-N 1 1 311.706 3.957 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594754 1028956271 /nfs/dbraw/zinc/95/62/71/1028956271.db2.gz OGSDGCXSWYGKJE-CBAPKCEASA-N 1 1 311.706 3.957 20 10 DHCDMO C[C@H]1C[C@H](N2CCCC2)C[N@H+]1Cc1ccc2ccccc2c1O ZINC000816608979 1028960557 /nfs/dbraw/zinc/96/05/57/1028960557.db2.gz OWBKSGCEXYNDHD-YJBOKZPZSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1C[C@H]([NH+]2CCCC2)CN1Cc1ccc2ccccc2c1O ZINC000816608979 1028960559 /nfs/dbraw/zinc/96/05/59/1028960559.db2.gz OWBKSGCEXYNDHD-YJBOKZPZSA-N 1 1 310.441 3.604 20 10 DHCDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000155431912 1029234428 /nfs/dbraw/zinc/23/44/28/1029234428.db2.gz RVSIBEFWENWEQU-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817938475 1029282077 /nfs/dbraw/zinc/28/20/77/1029282077.db2.gz LDEDVBCNBZKDLJ-RBUKOAKNSA-N 1 1 315.436 3.632 20 10 DHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817940266 1029282530 /nfs/dbraw/zinc/28/25/30/1029282530.db2.gz FCYIJLZAFHMYEL-IRXDYDNUSA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1csc(Cl)c1 ZINC000817940738 1029282758 /nfs/dbraw/zinc/28/27/58/1029282758.db2.gz HPEHQGPMOKYBKI-IAQYHMDHSA-N 1 1 323.893 3.818 20 10 DHCDMO Cc1cc(F)ccc1[C@H](C)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940010 1029283279 /nfs/dbraw/zinc/28/32/79/1029283279.db2.gz DTOJPNWGEQWTLM-LIRRHRJNSA-N 1 1 315.436 3.551 20 10 DHCDMO CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947133 1029291294 /nfs/dbraw/zinc/29/12/94/1029291294.db2.gz KYGKUQJTCGXUNS-YIZWMMSDSA-N 1 1 316.367 3.722 20 10 DHCDMO CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817958935 1029297759 /nfs/dbraw/zinc/29/77/59/1029297759.db2.gz NCALJSHJHWZNGY-NXEZZACHSA-N 1 1 305.249 3.723 20 10 DHCDMO C[C@H](NCC[NH2+]C1CCCCCC1)c1cc(F)cc(F)c1O ZINC000817959376 1029301580 /nfs/dbraw/zinc/30/15/80/1029301580.db2.gz CJPLNGKNMXCGCS-LBPRGKRZSA-N 1 1 312.404 3.633 20 10 DHCDMO C[C@H](NCCC[NH2+]C1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817983899 1029320416 /nfs/dbraw/zinc/32/04/16/1029320416.db2.gz LAVOOVUGJYKHEQ-HNNXBMFYSA-N 1 1 319.468 3.609 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000817985165 1029324066 /nfs/dbraw/zinc/32/40/66/1029324066.db2.gz BJYTZJALLSMJDD-QSPRXWTASA-N 1 1 310.441 3.584 20 10 DHCDMO Cc1ccc(C[NH2+]Cc2cc(C)cc(Br)c2O)o1 ZINC000865724564 1029990896 /nfs/dbraw/zinc/99/08/96/1029990896.db2.gz XWMLDZQOCXUBFB-UHFFFAOYSA-N 1 1 310.191 3.654 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3oc(C)nc32)cc1 ZINC000924711639 1030168838 /nfs/dbraw/zinc/16/88/38/1030168838.db2.gz VEPCTDCBODTLIY-QGZVFWFLSA-N 1 1 313.445 3.996 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)c1ccc(F)cc1O ZINC000866539721 1030361181 /nfs/dbraw/zinc/36/11/81/1030361181.db2.gz PUZZCQZWEHODNS-JQFCIGGWSA-N 1 1 307.409 3.635 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)Cc1cc(F)ncc1F ZINC000824344738 1030533253 /nfs/dbraw/zinc/53/32/53/1030533253.db2.gz RTUCDLXYSUIPFT-UHFFFAOYSA-N 1 1 306.356 3.868 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@H](CO)c2ccccc2)c1O ZINC000824697098 1030603406 /nfs/dbraw/zinc/60/34/06/1030603406.db2.gz YUEZHTUDHNKSEU-MRXNPFEDSA-N 1 1 305.805 3.519 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c(O)c1 ZINC000824714270 1030619663 /nfs/dbraw/zinc/61/96/63/1030619663.db2.gz AVMXGGMDPNFONK-YPMHNXCESA-N 1 1 317.351 3.954 20 10 DHCDMO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000824798638 1030641144 /nfs/dbraw/zinc/64/11/44/1030641144.db2.gz GLHNUSCACIFZOW-BZNIZROVSA-N 1 1 315.816 3.726 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc[nH]2)c(O)c(C(C)(C)C)c1 ZINC000824907037 1030663659 /nfs/dbraw/zinc/66/36/59/1030663659.db2.gz UXJRMKGSVOIDCL-UHFFFAOYSA-N 1 1 302.418 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C(C)C)C2CCOCC2)cc1 ZINC000093605053 1030700393 /nfs/dbraw/zinc/70/03/93/1030700393.db2.gz COHOCPXXSIHSKE-UHFFFAOYSA-N 1 1 304.478 3.922 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)c2nccn21 ZINC000825017723 1030700652 /nfs/dbraw/zinc/70/06/52/1030700652.db2.gz YJBFXTIRNAQZIP-QAPCUYQASA-N 1 1 310.445 3.669 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H]1OCCc2sccc21 ZINC000291935074 1030708449 /nfs/dbraw/zinc/70/84/49/1030708449.db2.gz PDGQAGYPYUOCBD-WVQJBOLRSA-N 1 1 321.417 3.946 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)cc1 ZINC000825091067 1030724065 /nfs/dbraw/zinc/72/40/65/1030724065.db2.gz TWQYOCJUOHSYAJ-SFHVURJKSA-N 1 1 304.478 3.516 20 10 DHCDMO Cc1cccc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000825321620 1030773253 /nfs/dbraw/zinc/77/32/53/1030773253.db2.gz JAKISEMIIPVETE-SFHVURJKSA-N 1 1 323.484 3.598 20 10 DHCDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825500800 1030829688 /nfs/dbraw/zinc/82/96/88/1030829688.db2.gz ICRIZNRUCOSPHY-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000237449441 1030964614 /nfs/dbraw/zinc/96/46/14/1030964614.db2.gz SDYDAWSSSYJRJA-GFCCVEGCSA-N 1 1 303.406 3.540 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1c(O)cccc1F ZINC000926918973 1030992592 /nfs/dbraw/zinc/99/25/92/1030992592.db2.gz KPPHJTPELFKICE-VXGBXAGGSA-N 1 1 301.361 3.706 20 10 DHCDMO C[C@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1ccc(Cl)cc1O ZINC000926961264 1031020574 /nfs/dbraw/zinc/02/05/74/1031020574.db2.gz XUSUQPUKYPQRKA-ZANVPECISA-N 1 1 324.774 3.579 20 10 DHCDMO CCC[N@@H+](Cc1cc(OC(C)C)ccn1)Cc1ccccc1O ZINC000844301081 1031052643 /nfs/dbraw/zinc/05/26/43/1031052643.db2.gz PXIGHBDZKRQDNY-UHFFFAOYSA-N 1 1 314.429 3.987 20 10 DHCDMO c1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000123654112 1031226911 /nfs/dbraw/zinc/22/69/11/1031226911.db2.gz ITXAOIBKAMNLDV-NRFANRHFSA-N 1 1 322.452 3.860 20 10 DHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F)CCCC3 ZINC000844753376 1031313199 /nfs/dbraw/zinc/31/31/99/1031313199.db2.gz PZUCVOGQYYHDFI-BETUJISGSA-N 1 1 319.351 3.714 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](C3CCC3)C2)c1O ZINC001171154540 1031386999 /nfs/dbraw/zinc/38/69/99/1031386999.db2.gz AGNRLZUZAZAUMU-ZDUSSCGKSA-N 1 1 307.821 3.870 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872018535 1031400958 /nfs/dbraw/zinc/40/09/58/1031400958.db2.gz NTIPDORWAINMPN-GFCCVEGCSA-N 1 1 317.364 3.651 20 10 DHCDMO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299931 1031439752 /nfs/dbraw/zinc/43/97/52/1031439752.db2.gz MSAOKQJMXDQYFT-VHSXEESVSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299931 1031439758 /nfs/dbraw/zinc/43/97/58/1031439758.db2.gz MSAOKQJMXDQYFT-VHSXEESVSA-N 1 1 316.214 3.914 20 10 DHCDMO Cc1nc(C)c(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)[nH]1 ZINC000929296786 1031486892 /nfs/dbraw/zinc/48/68/92/1031486892.db2.gz RLULRTLYWISTKT-UHFFFAOYSA-N 1 1 300.450 3.503 20 10 DHCDMO CCc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000929636115 1031562488 /nfs/dbraw/zinc/56/24/88/1031562488.db2.gz ROKVSOOPMOEDIM-UHFFFAOYSA-N 1 1 300.402 3.887 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c(O)c1 ZINC000872261070 1031565204 /nfs/dbraw/zinc/56/52/04/1031565204.db2.gz ZBGDYXWLZOXSBF-QGZVFWFLSA-N 1 1 319.445 3.715 20 10 DHCDMO Cc1[nH+]cc(CN(C)c2ccc(OCc3ccccc3)cc2)n1C ZINC000825629324 1031664736 /nfs/dbraw/zinc/66/47/36/1031664736.db2.gz WBCKDAGLOWMWEJ-UHFFFAOYSA-N 1 1 321.424 3.944 20 10 DHCDMO Cc1[nH]c(CN(Cc2ccco2)Cc2ccccc2O)c(C)[nH+]1 ZINC000929973160 1031667067 /nfs/dbraw/zinc/66/70/67/1031667067.db2.gz XEIQVKOHQLPKKB-UHFFFAOYSA-N 1 1 311.385 3.528 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)cc1C ZINC000872815975 1031667711 /nfs/dbraw/zinc/66/77/11/1031667711.db2.gz FFTSONKLSVZAAV-WFASDCNBSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3cccc(C)c3O)C2)s1 ZINC000361049922 1031695785 /nfs/dbraw/zinc/69/57/85/1031695785.db2.gz TXGRNPCCEQTALT-HNNXBMFYSA-N 1 1 302.443 3.845 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC000846104146 1031881094 /nfs/dbraw/zinc/88/10/94/1031881094.db2.gz FKQXNDFVYPRDHZ-CQSZACIVSA-N 1 1 301.764 3.975 20 10 DHCDMO C[C@@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccc(Cl)cc1O ZINC000846186857 1031919200 /nfs/dbraw/zinc/91/92/00/1031919200.db2.gz GKCJPCANNWZXMQ-PIGZYNQJSA-N 1 1 309.837 3.901 20 10 DHCDMO CCCC[N@@H+](Cc1cnn(CC(F)F)c1)Cc1ccccc1O ZINC000294534646 1032050046 /nfs/dbraw/zinc/05/00/46/1032050046.db2.gz DGVVRSMSXGZTHJ-UHFFFAOYSA-N 1 1 323.387 3.656 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c(O)c1 ZINC000877507953 1033329870 /nfs/dbraw/zinc/32/98/70/1033329870.db2.gz SXJUMAKPGMAVPD-KGLIPLIRSA-N 1 1 300.229 3.716 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000877516611 1033331391 /nfs/dbraw/zinc/33/13/91/1033331391.db2.gz GYAPVKDWLIOIKB-AQNXPRMDSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000877634466 1033392715 /nfs/dbraw/zinc/39/27/15/1033392715.db2.gz QAOANWIYNGOADC-SFHVURJKSA-N 1 1 313.397 3.647 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](O)C[C@@H]1c1ccccc1 ZINC000877672365 1033406018 /nfs/dbraw/zinc/40/60/18/1033406018.db2.gz CPRHVIVTDVQTRU-DLBZAZTESA-N 1 1 317.816 3.744 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)c1O ZINC000877672696 1033408445 /nfs/dbraw/zinc/40/84/45/1033408445.db2.gz KXWDLWPCIRPNRY-MOPGFXCFSA-N 1 1 311.425 3.653 20 10 DHCDMO Cc1ccc2c(c1)C[C@@H]([N@H+]1CCCc3cc(O)c(O)cc3C1)CC2 ZINC001172844895 1033415426 /nfs/dbraw/zinc/41/54/26/1033415426.db2.gz VIUOUZQMKVBUJK-IBGZPJMESA-N 1 1 323.436 3.712 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000877755963 1033430951 /nfs/dbraw/zinc/43/09/51/1033430951.db2.gz UZWNTZWZAQVWAO-LMMKCTJWSA-N 1 1 324.468 3.953 20 10 DHCDMO C[C@]1(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCCS1 ZINC000862212092 1033782017 /nfs/dbraw/zinc/78/20/17/1033782017.db2.gz GMNYWQMXVDUDSV-SJLPKXTDSA-N 1 1 321.486 3.659 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)CCC1(F)F ZINC000862370420 1033833340 /nfs/dbraw/zinc/83/33/40/1033833340.db2.gz LLHWKHATNYONIX-JTQLQIEISA-N 1 1 304.331 3.508 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CCC1(F)F ZINC000862370420 1033833352 /nfs/dbraw/zinc/83/33/52/1033833352.db2.gz LLHWKHATNYONIX-JTQLQIEISA-N 1 1 304.331 3.508 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)cccc2Br)CCC1(F)F ZINC000862369995 1033833666 /nfs/dbraw/zinc/83/36/66/1033833666.db2.gz GLHDQGCEOPFFCW-VIFPVBQESA-N 1 1 320.177 3.632 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1O ZINC000862485204 1033865293 /nfs/dbraw/zinc/86/52/93/1033865293.db2.gz JUKQXAILHZGHDD-GOEBONIOSA-N 1 1 319.445 3.500 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(F)ccc3O)C2)cc1F ZINC000862541382 1033882342 /nfs/dbraw/zinc/88/23/42/1033882342.db2.gz PVLXEBXCLVQLMQ-ZDUSSCGKSA-N 1 1 319.351 3.669 20 10 DHCDMO C/C=C\C[C@H]1CCC[N@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000862550477 1033885883 /nfs/dbraw/zinc/88/58/83/1033885883.db2.gz LVNMLDIQNDMNSQ-WSNITJDQSA-N 1 1 305.418 3.588 20 10 DHCDMO Cc1ccccc1-c1noc([C@@H](C)[N@H+](C)Cc2ccccc2O)n1 ZINC000174157342 1033908492 /nfs/dbraw/zinc/90/84/92/1033908492.db2.gz ZERGWTQADCLEEW-CQSZACIVSA-N 1 1 323.396 3.944 20 10 DHCDMO Cc1ccccc1-c1noc([C@@H](C)[N@@H+](C)Cc2ccccc2O)n1 ZINC000174157342 1033908503 /nfs/dbraw/zinc/90/85/03/1033908503.db2.gz ZERGWTQADCLEEW-CQSZACIVSA-N 1 1 323.396 3.944 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(-c2cccs2)no1 ZINC000879651832 1034073938 /nfs/dbraw/zinc/07/39/38/1034073938.db2.gz LYOOWTZRYHKEIC-QWRGUYRKSA-N 1 1 315.398 3.916 20 10 DHCDMO C[C@@H]1CC[C@@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CN1 ZINC000863546201 1034126674 /nfs/dbraw/zinc/12/66/74/1034126674.db2.gz JVCWQLCTSPOPHT-POAQFYNOSA-N 1 1 324.468 3.796 20 10 DHCDMO CC(C)[C@@H](CO)[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C(C)C ZINC001202513131 1034318079 /nfs/dbraw/zinc/31/80/79/1034318079.db2.gz JPRPPTMMKRRKFQ-WBMJQRKESA-N 1 1 317.832 3.563 20 10 DHCDMO CCc1cc(C[N@H+]2CCC[C@](C)(O)CC2)c(O)c(C(C)(C)C)c1 ZINC000794672987 1034336148 /nfs/dbraw/zinc/33/61/48/1034336148.db2.gz PEWFRUCRFIQGLP-FQEVSTJZSA-N 1 1 319.489 3.989 20 10 DHCDMO C[C@H](N[C@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1O ZINC000183396396 1034382583 /nfs/dbraw/zinc/38/25/83/1034382583.db2.gz GGRHMOVDMZHYTA-QFBILLFUSA-N 1 1 310.441 3.880 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@@H](C)c1cccc(OC)c1 ZINC000120158661 1034399736 /nfs/dbraw/zinc/39/97/36/1034399736.db2.gz QPFBKZAMUSEUPX-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2ccncc2)c1O ZINC000184744954 1034499371 /nfs/dbraw/zinc/49/93/71/1034499371.db2.gz YSZUCKOHCDNIIS-LLVKDONJSA-N 1 1 306.793 3.642 20 10 DHCDMO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cn1 ZINC000185046067 1034524953 /nfs/dbraw/zinc/52/49/53/1034524953.db2.gz JKRASBGOBUINJG-LBPRGKRZSA-N 1 1 304.365 3.564 20 10 DHCDMO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185839621 1034576889 /nfs/dbraw/zinc/57/68/89/1034576889.db2.gz NBLKURDFOWCZPG-JRPNMDOOSA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185839579 1034577076 /nfs/dbraw/zinc/57/70/76/1034577076.db2.gz NBLKURDFOWCZPG-ZETOZRRWSA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(F)cc1O ZINC000186009328 1034593283 /nfs/dbraw/zinc/59/32/83/1034593283.db2.gz MJMSFZAGUZCGQG-BONVTDFDSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186518288 1034638773 /nfs/dbraw/zinc/63/87/73/1034638773.db2.gz UGACFSIQHDCTFH-QLFBSQMISA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518977 1034639219 /nfs/dbraw/zinc/63/92/19/1034639219.db2.gz FPQLFRJDJAAAKD-RBSFLKMASA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518977 1034639224 /nfs/dbraw/zinc/63/92/24/1034639224.db2.gz FPQLFRJDJAAAKD-RBSFLKMASA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@H]([NH2+]CC1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000192790288 1034818106 /nfs/dbraw/zinc/81/81/06/1034818106.db2.gz WXOOPBSSXBTYEM-VIFPVBQESA-N 1 1 304.217 3.776 20 10 DHCDMO CCN(C)c1ccc(CN2CC[N@@H+](C3CCCC3)[C@@H](C)C2)cc1 ZINC001176154545 1035219904 /nfs/dbraw/zinc/21/99/04/1035219904.db2.gz PQFFMVGXNXKAMO-KRWDZBQOSA-N 1 1 315.505 3.591 20 10 DHCDMO Cc1cc([C@@H]2CCCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)[nH]n1 ZINC001176484119 1035278334 /nfs/dbraw/zinc/27/83/34/1035278334.db2.gz ANQNPJKOKJTDFI-IBGZPJMESA-N 1 1 312.461 3.820 20 10 DHCDMO Cc1cc(C[N@H+]2CCCSC[C@H]2C2CC2)ccc1N(C)C ZINC001176650833 1035314923 /nfs/dbraw/zinc/31/49/23/1035314923.db2.gz WVNATIXHUMGFGD-SFHVURJKSA-N 1 1 304.503 3.779 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@]23CCCOC3)cc1 ZINC001177008673 1035343386 /nfs/dbraw/zinc/34/33/86/1035343386.db2.gz NCDJPTRCRBJSNP-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO CCC(C)(C)C[NH2+]Cc1cc(C)cc(Br)c1O ZINC001178488526 1035432435 /nfs/dbraw/zinc/43/24/35/1035432435.db2.gz WNKYGMYWGDHQHV-UHFFFAOYSA-N 1 1 300.240 3.989 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000773756019 1035436019 /nfs/dbraw/zinc/43/60/19/1035436019.db2.gz SSTWEMLEVXPMDV-HXUWFJFHSA-N 1 1 310.441 3.716 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000773756019 1035436026 /nfs/dbraw/zinc/43/60/26/1035436026.db2.gz SSTWEMLEVXPMDV-HXUWFJFHSA-N 1 1 310.441 3.716 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)cc1 ZINC000773756081 1035438901 /nfs/dbraw/zinc/43/89/01/1035438901.db2.gz SZKBMBJLNRZPJT-NRFANRHFSA-N 1 1 324.468 3.625 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C1(C)C ZINC001179898460 1035521485 /nfs/dbraw/zinc/52/14/85/1035521485.db2.gz OAPBQKCYBYLPQE-HZPDHXFCSA-N 1 1 311.853 3.989 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)Cc2ccsc2)c1O ZINC001180057506 1035579515 /nfs/dbraw/zinc/57/95/15/1035579515.db2.gz GXCCMAQRYOATOX-CYBMUJFWSA-N 1 1 305.443 3.834 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@@H]2C(C)C)cc1OC ZINC001180331434 1035657596 /nfs/dbraw/zinc/65/75/96/1035657596.db2.gz GIJDWENRAYTXLN-OAHLLOKOSA-N 1 1 307.434 3.810 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@H](CCOC)C2)cc1 ZINC000773855568 1035661257 /nfs/dbraw/zinc/66/12/57/1035661257.db2.gz ICZSJWGOQOOFQN-QGZVFWFLSA-N 1 1 304.478 3.781 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(C)cc2O)cc1OC ZINC001180497628 1035705686 /nfs/dbraw/zinc/70/56/86/1035705686.db2.gz OEFMOUYHZRVWJD-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO COC1CCC(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CC1 ZINC001180557815 1035718545 /nfs/dbraw/zinc/71/85/45/1035718545.db2.gz HFRBRALRRIFKRW-UHFFFAOYSA-N 1 1 316.489 3.922 20 10 DHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001193869889 1035761207 /nfs/dbraw/zinc/76/12/07/1035761207.db2.gz ALBXPSFKNMEIRG-LJQANCHMSA-N 1 1 304.478 3.924 20 10 DHCDMO COc1cccc2c1C[N@@H+](Cc1ccc(N(C)C)cc1C)CC2 ZINC001181818168 1036000732 /nfs/dbraw/zinc/00/07/32/1036000732.db2.gz JKNMJCTWIKHAOQ-UHFFFAOYSA-N 1 1 310.441 3.628 20 10 DHCDMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001195213807 1036181875 /nfs/dbraw/zinc/18/18/75/1036181875.db2.gz IWJZUFGCMHNSFW-SFHVURJKSA-N 1 1 316.489 3.781 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C1CC1)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774131716 1036189324 /nfs/dbraw/zinc/18/93/24/1036189324.db2.gz RJCSWJQZIOOOFI-YMTOWFKASA-N 1 1 317.260 3.690 20 10 DHCDMO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CCCC[C@@H]1C ZINC001195358063 1036226733 /nfs/dbraw/zinc/22/67/33/1036226733.db2.gz KCKWXYFIFGUPRR-JKSUJKDBSA-N 1 1 319.445 3.584 20 10 DHCDMO COc1ccc(C[N@H+]2CC3(CCCC3)[C@H]2C(C)C)c(O)c1OC ZINC001182332350 1036232183 /nfs/dbraw/zinc/23/21/83/1036232183.db2.gz BZMGRUHRBWSULT-GOSISDBHSA-N 1 1 319.445 3.810 20 10 DHCDMO CCC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774185946 1036236430 /nfs/dbraw/zinc/23/64/30/1036236430.db2.gz WKAZYQINFDHPAU-LKFCYVNXSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@@H]([NH2+]CC1(CCO)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774257953 1036263068 /nfs/dbraw/zinc/26/30/68/1036263068.db2.gz QCBQBLPYIZZTBR-SNVBAGLBSA-N 1 1 318.244 3.902 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1(CC)CC ZINC001204335835 1036251026 /nfs/dbraw/zinc/25/10/26/1036251026.db2.gz XMDUBUCTRAMKHR-QZTJIDSGSA-N 1 1 321.461 3.816 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC3(CC=CC3)[C@@H]2C(C)C)c1O ZINC001182694671 1036429501 /nfs/dbraw/zinc/42/95/01/1036429501.db2.gz XHOBTTTYTVOQLT-SFHVURJKSA-N 1 1 301.430 3.886 20 10 DHCDMO CCN1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715832 1036532573 /nfs/dbraw/zinc/53/25/73/1036532573.db2.gz MIHRYYSLKIBPLM-BBRMVZONSA-N 1 1 310.869 3.659 20 10 DHCDMO CCN1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715832 1036532584 /nfs/dbraw/zinc/53/25/84/1036532584.db2.gz MIHRYYSLKIBPLM-BBRMVZONSA-N 1 1 310.869 3.659 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCCN(Cc3ccccc3)C[C@H]2C)c1O ZINC000775716436 1036534175 /nfs/dbraw/zinc/53/41/75/1036534175.db2.gz XDVOETPKIBDVPE-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)c1O ZINC000775716436 1036534188 /nfs/dbraw/zinc/53/41/88/1036534188.db2.gz XDVOETPKIBDVPE-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CCC[N@H+](Cc3ccccc3)C[C@H]2C)c1O ZINC000775716436 1036534195 /nfs/dbraw/zinc/53/41/95/1036534195.db2.gz XDVOETPKIBDVPE-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(Cl)cc(F)c2[O-])s1 ZINC000775727790 1036576367 /nfs/dbraw/zinc/57/63/67/1036576367.db2.gz YKZYMAOYHMGIMU-UHFFFAOYSA-N 1 1 314.813 3.624 20 10 DHCDMO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)C12CCC2 ZINC001183920320 1036714121 /nfs/dbraw/zinc/71/41/21/1036714121.db2.gz WWPGFRNQEFXSEH-JKSUJKDBSA-N 1 1 307.409 3.747 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2C[C@H]3[C@H]4CC[C@H](C4)[C@@]3(C)C2)cc1F ZINC001184056980 1036739190 /nfs/dbraw/zinc/73/91/90/1036739190.db2.gz UJTCWXIRGMMVNB-OUFKLWKOSA-N 1 1 320.427 3.899 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](Cc3nccs3)C2)cc1Cl ZINC001184265038 1036791698 /nfs/dbraw/zinc/79/16/98/1036791698.db2.gz OEQCRICOTNAGST-LBPRGKRZSA-N 1 1 322.861 3.875 20 10 DHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(Br)cc1)CC2 ZINC001203911449 1037070608 /nfs/dbraw/zinc/07/06/08/1037070608.db2.gz LPQISOHRPLEDSE-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(Br)cc1)CC2 ZINC001203911449 1037070627 /nfs/dbraw/zinc/07/06/27/1037070627.db2.gz LPQISOHRPLEDSE-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1ccccc1O ZINC000762971839 1037186070 /nfs/dbraw/zinc/18/60/70/1037186070.db2.gz VQSFKTYWYYGMOF-UHFFFAOYSA-N 1 1 302.374 3.773 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccccc2Cl)c1O ZINC000915815013 1037198588 /nfs/dbraw/zinc/19/85/88/1037198588.db2.gz CYZXTRPPGLJTDQ-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1c(O)c(C[NH2+]C[C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774983622 1037329049 /nfs/dbraw/zinc/32/90/49/1037329049.db2.gz HRCCDFPXASQKQP-GFCCVEGCSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)c1O ZINC000775125417 1037646093 /nfs/dbraw/zinc/64/60/93/1037646093.db2.gz RNMBAWQOFWHXRO-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CCCN(Cc1cnc(-c2ccccc2)[nH]1)c1ccc(C[NH3+])cc1 ZINC000775140315 1037705832 /nfs/dbraw/zinc/70/58/32/1037705832.db2.gz LSZUKCCJZCMIQT-UHFFFAOYSA-N 1 1 320.440 3.952 20 10 DHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(OCC)ccc1O ZINC000775206178 1038013916 /nfs/dbraw/zinc/01/39/16/1038013916.db2.gz VYDDZPVNGQOKHH-GOSISDBHSA-N 1 1 307.434 3.572 20 10 DHCDMO COc1cc(C)cc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)c1O ZINC000164472742 1038202387 /nfs/dbraw/zinc/20/23/87/1038202387.db2.gz JLRUSXJOHPMXJW-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCc3c(F)ccc(F)c3C2)c1O ZINC000164472742 1038202398 /nfs/dbraw/zinc/20/23/98/1038202398.db2.gz JLRUSXJOHPMXJW-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[C@H](C2CC2)O1 ZINC001190436879 1038314802 /nfs/dbraw/zinc/31/48/02/1038314802.db2.gz NEQHTNCQBCSMSK-VQTJNVASSA-N 1 1 316.489 3.921 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)CCc2nccs2)cc1C(C)C ZINC000157136570 1038514819 /nfs/dbraw/zinc/51/48/19/1038514819.db2.gz CFHFPVHDZINTLF-UHFFFAOYSA-N 1 1 304.459 3.955 20 10 DHCDMO CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000775501980 1038587488 /nfs/dbraw/zinc/58/74/88/1038587488.db2.gz NOGLXIYSRNOPDP-MRXNPFEDSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1cc[nH]n1)Cc1ccccc1O ZINC001192302432 1038633530 /nfs/dbraw/zinc/63/35/30/1038633530.db2.gz JTIFFAGELGIHQO-HNNXBMFYSA-N 1 1 307.397 3.879 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cc[nH]n1)Cc1ccccc1O ZINC001192302432 1038633539 /nfs/dbraw/zinc/63/35/39/1038633539.db2.gz JTIFFAGELGIHQO-HNNXBMFYSA-N 1 1 307.397 3.879 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccc(F)cc1O ZINC000170789161 1038965814 /nfs/dbraw/zinc/96/58/14/1038965814.db2.gz WSSOPQGOZRNMKS-WDEREUQCSA-N 1 1 303.333 3.672 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCO2 ZINC000170789159 1038965897 /nfs/dbraw/zinc/96/58/97/1038965897.db2.gz WSSOPQGOZRNMKS-MNOVXSKESA-N 1 1 303.333 3.672 20 10 DHCDMO Cc1cnc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)s1 ZINC000230687092 1039962108 /nfs/dbraw/zinc/96/21/08/1039962108.db2.gz WNDNOHMSXBRCAB-UHFFFAOYSA-N 1 1 301.459 3.732 20 10 DHCDMO CC[N@H+](C)C[C@H]1CCN(Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489713 1040312380 /nfs/dbraw/zinc/31/23/80/1040312380.db2.gz ICGHEBOFQPNRSB-MRXNPFEDSA-N 1 1 318.505 3.772 20 10 DHCDMO CC[N@@H+](C)C[C@H]1CCN(Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489713 1040312393 /nfs/dbraw/zinc/31/23/93/1040312393.db2.gz ICGHEBOFQPNRSB-MRXNPFEDSA-N 1 1 318.505 3.772 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(C)cc2)c1O ZINC000761184255 1040494155 /nfs/dbraw/zinc/49/41/55/1040494155.db2.gz VSFHTWNTJUYKCE-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2c2cc(C)no2)c1O ZINC000761192350 1040556943 /nfs/dbraw/zinc/55/69/43/1040556943.db2.gz KWNGGTXCXIAMCP-ZDUSSCGKSA-N 1 1 322.792 3.688 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2cc(C)no2)c1O ZINC000761192350 1040556959 /nfs/dbraw/zinc/55/69/59/1040556959.db2.gz KWNGGTXCXIAMCP-ZDUSSCGKSA-N 1 1 322.792 3.688 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)CCc2ccc(F)cc2)c1O ZINC000761191845 1040559132 /nfs/dbraw/zinc/55/91/32/1040559132.db2.gz CMBPHOGJJHATRT-UHFFFAOYSA-N 1 1 323.795 3.868 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2cccc(C)c2)c1O ZINC000761191374 1040561688 /nfs/dbraw/zinc/56/16/88/1040561688.db2.gz QXLIOVHIGMFRRH-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO CC[N@@H+](Cc1cc(C)ccc1O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000761226947 1040820074 /nfs/dbraw/zinc/82/00/74/1040820074.db2.gz XWSMKNMXYIZXJE-FQEVSTJZSA-N 1 1 324.468 3.797 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3occc32)c1 ZINC000273437056 130122185 /nfs/dbraw/zinc/12/21/85/130122185.db2.gz XDTOITOLTNSCCF-XHDPSFHLSA-N 1 1 315.369 3.500 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286128830 131221283 /nfs/dbraw/zinc/22/12/83/131221283.db2.gz OKXFKLQFQPKVJD-MAUKXSAKSA-N 1 1 317.404 3.738 20 10 DHCDMO CC[C@@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(F)cc1O ZINC000286302518 131228664 /nfs/dbraw/zinc/22/86/64/131228664.db2.gz XBKJXJPLSDPZFP-HUUCEWRRSA-N 1 1 307.365 3.943 20 10 DHCDMO CC[C@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(N(C)C)cc1 ZINC000287524210 131285254 /nfs/dbraw/zinc/28/52/54/131285254.db2.gz OQOXNCAZXIALSP-SFHVURJKSA-N 1 1 313.445 3.900 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000289141965 131361763 /nfs/dbraw/zinc/36/17/63/131361763.db2.gz AJTUYIUBOOCYGV-OAHLLOKOSA-N 1 1 313.401 3.770 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000289141965 131361764 /nfs/dbraw/zinc/36/17/64/131361764.db2.gz AJTUYIUBOOCYGV-OAHLLOKOSA-N 1 1 313.401 3.770 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC3(CC(OCC)C3)C2)c(O)c1 ZINC000289254360 131369412 /nfs/dbraw/zinc/36/94/12/131369412.db2.gz FHVOCYZXQCFROK-UHFFFAOYSA-N 1 1 319.445 3.572 20 10 DHCDMO COc1cccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)c1O ZINC000289419521 131384879 /nfs/dbraw/zinc/38/48/79/131384879.db2.gz IVUUTEWSJRZNQY-HNNXBMFYSA-N 1 1 321.367 3.757 20 10 DHCDMO C[C@@H](CCO)CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000297269546 132007021 /nfs/dbraw/zinc/00/70/21/132007021.db2.gz KQPFMRVRQYEKIF-ZJUUUORDSA-N 1 1 306.233 3.758 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(-c2cc[nH]n2)cc1)c1ccc(F)cc1O ZINC000320564868 335084044 /nfs/dbraw/zinc/08/40/44/335084044.db2.gz OUCNKGWSKISQMG-LBPRGKRZSA-N 1 1 311.360 3.772 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1ccc(F)cc1O ZINC000185261872 333206445 /nfs/dbraw/zinc/20/64/45/333206445.db2.gz CEFBEKYUXNVNPP-GFCCVEGCSA-N 1 1 316.376 3.566 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CCCCO)cc1 ZINC000296767665 335148065 /nfs/dbraw/zinc/14/80/65/335148065.db2.gz LGKYOADCSVEHFB-UHFFFAOYSA-N 1 1 318.486 3.589 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1O ZINC000285739908 334149698 /nfs/dbraw/zinc/14/96/98/334149698.db2.gz RCOMHDQFMORARA-QGZVFWFLSA-N 1 1 302.393 3.838 20 10 DHCDMO C[C@H](Nc1cc[nH+]cc1Cl)c1ccc(N2CCOCC2)cc1 ZINC000301522113 336312277 /nfs/dbraw/zinc/31/22/77/336312277.db2.gz NXOQGZSTBIQZDV-ZDUSSCGKSA-N 1 1 317.820 3.745 20 10 DHCDMO CCOc1ccc(O)c(C[NH2+][C@@H]2COc3cccc(Cl)c32)c1 ZINC000367386105 336770876 /nfs/dbraw/zinc/77/08/76/336770876.db2.gz OXHBZQRYULOSJI-CQSZACIVSA-N 1 1 319.788 3.668 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[C@H](CO)c2ccccc21)c1ccc(F)cc1O ZINC000375897965 337022566 /nfs/dbraw/zinc/02/25/66/337022566.db2.gz NAEXNXCYDWZKKW-UUWFMWQGSA-N 1 1 315.388 3.793 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000376412991 337032912 /nfs/dbraw/zinc/03/29/12/337032912.db2.gz IVWSWILPJHOWKG-AWEZNQCLSA-N 1 1 313.800 3.624 20 10 DHCDMO CCc1nc(N2CC=C(c3ccc(Cl)nc3)CC2)cc(C)[nH+]1 ZINC000376449453 337033672 /nfs/dbraw/zinc/03/36/72/337033672.db2.gz PSFBRCCCNZMHGB-UHFFFAOYSA-N 1 1 314.820 3.690 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)c1 ZINC000377624218 337056709 /nfs/dbraw/zinc/05/67/09/337056709.db2.gz KLRJKGFPUHMXEH-SUNYJGFJSA-N 1 1 312.413 3.940 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000377631073 337056897 /nfs/dbraw/zinc/05/68/97/337056897.db2.gz SLSNMOQQJSVHPC-ZFWWWQNUSA-N 1 1 317.351 3.623 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@@H+](C)[C@H]2CCCc3cccnc32)c1 ZINC000377690675 337058628 /nfs/dbraw/zinc/05/86/28/337058628.db2.gz DMOVQCHGKMYQQO-DYVFJYSZSA-N 1 1 312.413 3.866 20 10 DHCDMO Oc1c(Cl)cccc1CN1CCC([NH2+]C2CCCC2)CC1 ZINC000378436822 337072575 /nfs/dbraw/zinc/07/25/75/337072575.db2.gz DMDFGLCSCLFPKZ-UHFFFAOYSA-N 1 1 308.853 3.542 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@@H]2c2ccc(C)o2)c1 ZINC000378445162 337073035 /nfs/dbraw/zinc/07/30/35/337073035.db2.gz SHZIIEDUUDCAOJ-OAHLLOKOSA-N 1 1 319.426 3.592 20 10 DHCDMO Cc1nnc([C@H]([NH2+][C@H](C)c2ccc(C)cc2O)c2ccccc2)[nH]1 ZINC000185324712 337205092 /nfs/dbraw/zinc/20/50/92/337205092.db2.gz UHBWPGWCFSEEQQ-FZKQIMNGSA-N 1 1 322.412 3.567 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000121199665 337396276 /nfs/dbraw/zinc/39/62/76/337396276.db2.gz YVKLKACWTRLNDQ-HNNXBMFYSA-N 1 1 307.397 3.648 20 10 DHCDMO Fc1ccc(F)c(C[NH2+]Cc2ccc3c(c2)CCO3)c1Cl ZINC000527652317 337756296 /nfs/dbraw/zinc/75/62/96/337756296.db2.gz MMHJHMDEORIESY-UHFFFAOYSA-N 1 1 309.743 3.843 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000527928214 337776005 /nfs/dbraw/zinc/77/60/05/337776005.db2.gz NTXQTMFLIVABGF-NEPJUHHUSA-N 1 1 317.351 3.878 20 10 DHCDMO CC[N@H+](Cc1cccc(F)c1O)[C@H]1CCCc2cccnc21 ZINC000365002903 521349175 /nfs/dbraw/zinc/34/91/75/521349175.db2.gz PTHAVALKGGOZSY-INIZCTEOSA-N 1 1 300.377 3.826 20 10 DHCDMO CC[N@@H+](Cc1cccc(F)c1O)[C@H]1CCCc2cccnc21 ZINC000365002903 521349183 /nfs/dbraw/zinc/34/91/83/521349183.db2.gz PTHAVALKGGOZSY-INIZCTEOSA-N 1 1 300.377 3.826 20 10 DHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000191278914 521662272 /nfs/dbraw/zinc/66/22/72/521662272.db2.gz DUDFQUJBYJWCHE-UHFFFAOYSA-N 1 1 315.461 3.680 20 10 DHCDMO COc1ccc(N2CCC([N@@H+](C)Cc3ccc(C)o3)CC2)cc1 ZINC000367433502 524403336 /nfs/dbraw/zinc/40/33/36/524403336.db2.gz XVUQMXIRYBBIOD-UHFFFAOYSA-N 1 1 314.429 3.697 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000180703301 524737391 /nfs/dbraw/zinc/73/73/91/524737391.db2.gz BAUIEJWHLZAWBY-UHFFFAOYSA-N 1 1 303.324 3.565 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000180285499 525339255 /nfs/dbraw/zinc/33/92/55/525339255.db2.gz FHPWJQBIYNZLLY-FPTDNZKUSA-N 1 1 317.454 3.631 20 10 DHCDMO Cc1cccnc1C1(C[NH2+][C@@H](C)c2ccc(F)cc2O)CC1 ZINC000366039362 525508057 /nfs/dbraw/zinc/50/80/57/525508057.db2.gz JMENHUWXWFETNG-ZDUSSCGKSA-N 1 1 300.377 3.617 20 10 DHCDMO Oc1ccccc1C[N@@H+](CC1=CCCOC1)C1CCCCC1 ZINC000156781600 526371237 /nfs/dbraw/zinc/37/12/37/526371237.db2.gz DFSNJCZBTONRPX-UHFFFAOYSA-N 1 1 301.430 3.874 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(F)ccc1O)CCC2 ZINC000180148815 527111074 /nfs/dbraw/zinc/11/10/74/527111074.db2.gz ZGJYFEOGNHDJKO-CQSZACIVSA-N 1 1 306.406 3.806 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000894491206 1013387576 /nfs/dbraw/zinc/38/75/76/1013387576.db2.gz LESNXOYQGBYNSA-DGCLKSJQSA-N 1 1 317.351 3.872 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H](CO)C(C)(C)C ZINC000093821787 1013387611 /nfs/dbraw/zinc/38/76/11/1013387611.db2.gz QNDWJZADNHUAOZ-GOSISDBHSA-N 1 1 304.478 3.516 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]C2CCN(CCC(C)C)CC2)c1 ZINC000894502062 1013397204 /nfs/dbraw/zinc/39/72/04/1013397204.db2.gz KLZNBEKFVQWBSR-HNNXBMFYSA-N 1 1 320.477 3.562 20 10 DHCDMO CCOc1cc(F)c(C[N@H+](C)Cc2ccccc2O)c(F)c1 ZINC001143575565 1013465823 /nfs/dbraw/zinc/46/58/23/1013465823.db2.gz FEPFZDFWAOYJRL-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCOc1cc(F)c(C[N@@H+](C)Cc2ccccc2O)c(F)c1 ZINC001143575565 1013465829 /nfs/dbraw/zinc/46/58/29/1013465829.db2.gz FEPFZDFWAOYJRL-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(C)cc(OC)c1O ZINC000894783888 1013488660 /nfs/dbraw/zinc/48/86/60/1013488660.db2.gz ZKFFOJXFRFNEBF-INIZCTEOSA-N 1 1 300.402 3.687 20 10 DHCDMO CCOC1CC2(C1)CC[N@H+](Cc1cc(Cl)c(F)cc1O)C2 ZINC000294608540 1032078323 /nfs/dbraw/zinc/07/83/23/1032078323.db2.gz IJHLCHOUBKBFBL-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc(Cl)c(F)cc1O)C2 ZINC000294608540 1032078343 /nfs/dbraw/zinc/07/83/43/1032078343.db2.gz IJHLCHOUBKBFBL-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@H](c1ccco1)[N@H+](C)Cc1cccc(Br)c1O ZINC000131096467 1024258378 /nfs/dbraw/zinc/25/83/78/1024258378.db2.gz KOJWVBOMXDGJHN-SNVBAGLBSA-N 1 1 310.191 3.941 20 10 DHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1cccc(Br)c1O ZINC000131096467 1024258386 /nfs/dbraw/zinc/25/83/86/1024258386.db2.gz KOJWVBOMXDGJHN-SNVBAGLBSA-N 1 1 310.191 3.941 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000796828057 1014101946 /nfs/dbraw/zinc/10/19/46/1014101946.db2.gz WGZWQDGYJCVVFS-MJGOQNOKSA-N 1 1 315.388 3.886 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310343178 1014108934 /nfs/dbraw/zinc/10/89/34/1014108934.db2.gz DOXPGVGMLIKNDB-MJGOQNOKSA-N 1 1 324.468 3.955 20 10 DHCDMO CCOC[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000160196664 1014364754 /nfs/dbraw/zinc/36/47/54/1014364754.db2.gz FZASETXSKSRDAU-HNNXBMFYSA-N 1 1 303.446 3.520 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)c1O ZINC000834882436 1014936844 /nfs/dbraw/zinc/93/68/44/1014936844.db2.gz KCNJIOUYIMNCSF-SECBINFHSA-N 1 1 314.216 3.592 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)cn1 ZINC000276330544 1014958890 /nfs/dbraw/zinc/95/88/90/1014958890.db2.gz GQVMTDIOHOAFNP-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(N(C)C)cc1 ZINC000163173166 1015001187 /nfs/dbraw/zinc/00/11/87/1015001187.db2.gz LDVNYYJXORWLLO-MRXNPFEDSA-N 1 1 320.440 3.789 20 10 DHCDMO CCC1([NH+]2CCCC2)CCN(Cc2cc(F)cc(F)c2O)CC1 ZINC000895440752 1015152059 /nfs/dbraw/zinc/15/20/59/1015152059.db2.gz XUAKGVFXDSRIPD-UHFFFAOYSA-N 1 1 324.415 3.511 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000895454659 1015166270 /nfs/dbraw/zinc/16/62/70/1015166270.db2.gz OFNVSVGBMUYDCM-QGZVFWFLSA-N 1 1 319.445 3.633 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](c3nccs3)C2)c1O ZINC000895580960 1015216530 /nfs/dbraw/zinc/21/65/30/1015216530.db2.gz JOODQHMSGQCWAM-JTQLQIEISA-N 1 1 324.833 3.500 20 10 DHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1CCC[C@H](Cc2nccs2)C1 ZINC000896529001 1015613389 /nfs/dbraw/zinc/61/33/89/1015613389.db2.gz VRDBVWYLSRSRNM-LLVKDONJSA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H](Cc2nccs2)C1 ZINC000896529001 1015613394 /nfs/dbraw/zinc/61/33/94/1015613394.db2.gz VRDBVWYLSRSRNM-LLVKDONJSA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@H](Cc2nccs2)C1 ZINC000896529001 1015613402 /nfs/dbraw/zinc/61/34/02/1015613402.db2.gz VRDBVWYLSRSRNM-LLVKDONJSA-N 1 1 324.396 3.582 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H](Cc3nccs3)C2)c1 ZINC000896531774 1015619576 /nfs/dbraw/zinc/61/95/76/1015619576.db2.gz OWLWIMIDDLXUQR-CQSZACIVSA-N 1 1 302.443 3.612 20 10 DHCDMO Cc1cc(CO)cc(C)c1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000896560898 1015642567 /nfs/dbraw/zinc/64/25/67/1015642567.db2.gz HNNGBXNAWSPSCG-UHFFFAOYSA-N 1 1 323.795 3.584 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2c(C)cccc2O)o1 ZINC000877396004 1033295195 /nfs/dbraw/zinc/29/51/95/1033295195.db2.gz QLSGULNPCRJFED-MRXNPFEDSA-N 1 1 301.386 3.777 20 10 DHCDMO COc1cccc(C[NH2+]Cc2c(O)cccc2F)c1OC(C)C ZINC000896641459 1015695355 /nfs/dbraw/zinc/69/53/55/1015695355.db2.gz ROJOGCXMXFCGCW-UHFFFAOYSA-N 1 1 319.376 3.617 20 10 DHCDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(O)c1OC ZINC000891950092 1015784723 /nfs/dbraw/zinc/78/47/23/1015784723.db2.gz FQWHXWIISYEGRG-ZDUSSCGKSA-N 1 1 313.397 3.529 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(F)cc1[O-] ZINC000796838668 1016418643 /nfs/dbraw/zinc/41/86/43/1016418643.db2.gz JJSKXZQANZYHBY-YJBOKZPZSA-N 1 1 322.468 3.940 20 10 DHCDMO COc1ccccc1O[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185579994 1017030168 /nfs/dbraw/zinc/03/01/68/1017030168.db2.gz PCXJHBLLOBOABQ-OLZOCXBDSA-N 1 1 319.376 3.658 20 10 DHCDMO CC1(C)C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC001308957600 1032197406 /nfs/dbraw/zinc/19/74/06/1032197406.db2.gz VTWNFOGYPDIFHA-JTQLQIEISA-N 1 1 303.830 3.949 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccn(C)n1 ZINC000840815272 1017077014 /nfs/dbraw/zinc/07/70/14/1017077014.db2.gz DHUMPUXLMKEEQY-DTWKUNHWSA-N 1 1 314.216 3.844 20 10 DHCDMO C[C@@H]([NH2+]CCOc1ccc(F)cc1F)c1ccc(F)cc1O ZINC000185646976 1017080086 /nfs/dbraw/zinc/08/00/86/1017080086.db2.gz ZZTXNVQEUCVISA-SNVBAGLBSA-N 1 1 311.303 3.539 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000092973935 1032518371 /nfs/dbraw/zinc/51/83/71/1032518371.db2.gz QZYQPIXWCSSJRW-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000092973935 1032518377 /nfs/dbraw/zinc/51/83/77/1032518377.db2.gz QZYQPIXWCSSJRW-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1c[nH]c2nc(NCc3cc4ccccc4cc3O)[nH+]cc12 ZINC001171399507 1032583004 /nfs/dbraw/zinc/58/30/04/1032583004.db2.gz IKFHGZFUAUJRCX-UHFFFAOYSA-N 1 1 304.353 3.689 20 10 DHCDMO C[N@@H+](Cc1ccsc1)Cc1cc(Br)ccc1O ZINC000120448121 1012527401 /nfs/dbraw/zinc/52/74/01/1012527401.db2.gz BINADDNPDDMTSL-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CC[C@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926904936 1032664479 /nfs/dbraw/zinc/66/44/79/1032664479.db2.gz KDZQUOWTIUDLKY-OPQQBVKSSA-N 1 1 321.314 3.682 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C2CCC(C[NH+](C)C)CC2)c(Cl)c1 ZINC000840906948 1017449126 /nfs/dbraw/zinc/44/91/26/1017449126.db2.gz LFOHHCBILPUFON-UHFFFAOYSA-N 1 1 310.869 3.564 20 10 DHCDMO CC[NH+](CC)CCN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764542667 1018310378 /nfs/dbraw/zinc/31/03/78/1018310378.db2.gz AAQHNOCJTJQGQZ-INIZCTEOSA-N 1 1 321.484 3.808 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCCc3occc32)cc1F ZINC000858095011 1032764995 /nfs/dbraw/zinc/76/49/95/1032764995.db2.gz UMIHGESDRHPWBH-OAHLLOKOSA-N 1 1 306.356 3.791 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCOC3(CCCC3)C2)cc1C(C)C ZINC000765103410 1018475259 /nfs/dbraw/zinc/47/52/59/1018475259.db2.gz OVIHSDMKFZHKKD-UHFFFAOYSA-N 1 1 303.446 3.969 20 10 DHCDMO COc1cccc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c1O ZINC000157022617 1018578838 /nfs/dbraw/zinc/57/88/38/1018578838.db2.gz KOXFCQBMQTWMFS-QGZVFWFLSA-N 1 1 312.413 3.913 20 10 DHCDMO CC(C)n1cc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)cn1 ZINC000858135487 1032776951 /nfs/dbraw/zinc/77/69/51/1032776951.db2.gz VTMVFEGKIUYOPH-LBPRGKRZSA-N 1 1 322.403 3.659 20 10 DHCDMO CC[C@H](CSC)[N@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000157975038 1018722040 /nfs/dbraw/zinc/72/20/40/1018722040.db2.gz CGWMXYLPMZXBCG-CYBMUJFWSA-N 1 1 315.866 3.822 20 10 DHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000157975038 1018722055 /nfs/dbraw/zinc/72/20/55/1018722055.db2.gz CGWMXYLPMZXBCG-CYBMUJFWSA-N 1 1 315.866 3.822 20 10 DHCDMO c1sc(C[NH2+]Cc2ccc3c(c2)CCCO3)nc1C1CC1 ZINC000921857504 1019005322 /nfs/dbraw/zinc/00/53/22/1019005322.db2.gz VAOLXCTZWFIMAH-UHFFFAOYSA-N 1 1 300.427 3.635 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+]Cc2c(O)ccc(Cl)c2F)nc1 ZINC000858241634 1032813393 /nfs/dbraw/zinc/81/33/93/1032813393.db2.gz AZRPVJMEAOLQIX-UHFFFAOYSA-N 1 1 322.811 3.956 20 10 DHCDMO CC[C@@H]1CCCC[N@@H+]1CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000765962609 1019193839 /nfs/dbraw/zinc/19/38/39/1019193839.db2.gz ULXFBRCWCUDSEG-SJLPKXTDSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000765962609 1019193857 /nfs/dbraw/zinc/19/38/57/1019193857.db2.gz ULXFBRCWCUDSEG-SJLPKXTDSA-N 1 1 303.494 3.668 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(Cl)cc2)cc1OC ZINC000158833982 1019396436 /nfs/dbraw/zinc/39/64/36/1019396436.db2.gz TYOOBKQSPUJXSN-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000170789002 1019434049 /nfs/dbraw/zinc/43/40/49/1019434049.db2.gz TYOIBBYRTJRTMZ-RYUDHWBXSA-N 1 1 316.376 3.902 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000922217445 1019896359 /nfs/dbraw/zinc/89/63/59/1019896359.db2.gz QBRFTQHQJCSDSE-LLVKDONJSA-N 1 1 304.390 3.537 20 10 DHCDMO Cc1cc(C)n(CC[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000731848322 1020156417 /nfs/dbraw/zinc/15/64/17/1020156417.db2.gz VTRVTPXADLDMRO-UHFFFAOYSA-N 1 1 313.445 3.650 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@H](C)O1 ZINC000732184566 1020208551 /nfs/dbraw/zinc/20/85/51/1020208551.db2.gz CVYLSJNXLGARSK-GOEBONIOSA-N 1 1 305.462 3.997 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000179558660 1020407580 /nfs/dbraw/zinc/40/75/80/1020407580.db2.gz BBQHQXXYEUGRNS-FQEVSTJZSA-N 1 1 304.393 3.799 20 10 DHCDMO CCCc1noc(C[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000733613779 1020418436 /nfs/dbraw/zinc/41/84/36/1020418436.db2.gz LALHUPGCEQVDOB-UHFFFAOYSA-N 1 1 315.417 3.673 20 10 DHCDMO CCn1cc(C[N@@H+](C)Cc2cc(C)cc(C(C)(C)C)c2O)cn1 ZINC000733791013 1020445554 /nfs/dbraw/zinc/44/55/54/1020445554.db2.gz XEFZRQKZDZADKM-UHFFFAOYSA-N 1 1 315.461 3.847 20 10 DHCDMO CCC[N@@H+](CCc1cccs1)Cc1cc2c(cc1O)OCO2 ZINC000766026866 1020478671 /nfs/dbraw/zinc/47/86/71/1020478671.db2.gz BSEBWHZXZFLFQA-UHFFFAOYSA-N 1 1 319.426 3.637 20 10 DHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCC3)cs1 ZINC000186868402 1020513326 /nfs/dbraw/zinc/51/33/26/1020513326.db2.gz QDDVMPQQRNRHBA-QGZVFWFLSA-N 1 1 314.454 3.983 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766046144 1020606680 /nfs/dbraw/zinc/60/66/80/1020606680.db2.gz XJNGEAZSNVTCGY-QAPCUYQASA-N 1 1 305.510 3.770 20 10 DHCDMO C[C@H]([NH2+][C@H]1CO[C@H](C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000858547050 1032941361 /nfs/dbraw/zinc/94/13/61/1032941361.db2.gz HYDXSNQTFNUPEY-FLBPPNCPSA-N 1 1 316.228 3.917 20 10 DHCDMO CSCC1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC000850356449 1021000715 /nfs/dbraw/zinc/00/07/15/1021000715.db2.gz SIASURLTIABBLW-UHFFFAOYSA-N 1 1 303.830 3.808 20 10 DHCDMO Oc1cccc(Br)c1CNc1[nH]c2ccccc2[nH+]1 ZINC001202329490 1021219434 /nfs/dbraw/zinc/21/94/34/1021219434.db2.gz TXSNTBLEOOXGTH-UHFFFAOYSA-N 1 1 318.174 3.643 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccc(C)cc1 ZINC000743839865 1021375120 /nfs/dbraw/zinc/37/51/20/1021375120.db2.gz FVKHILLQBOKYLJ-HXUWFJFHSA-N 1 1 312.457 3.617 20 10 DHCDMO CCSCC[N@@H+](CC)Cc1cc(Br)ccc1O ZINC000743870873 1021397078 /nfs/dbraw/zinc/39/70/78/1021397078.db2.gz FJNCPJBWUZYDCY-UHFFFAOYSA-N 1 1 318.280 3.730 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccnc2)cc1F ZINC000182032466 1021443965 /nfs/dbraw/zinc/44/39/65/1021443965.db2.gz QWGJJYQXRPKGJB-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1ccc(F)cc1O ZINC000850524614 1021578251 /nfs/dbraw/zinc/57/82/51/1021578251.db2.gz CTKWKGRABVJHTC-LZLYRXPVSA-N 1 1 301.361 3.750 20 10 DHCDMO C[C@@H]([NH2+]CC1CCC(O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000850551333 1021600231 /nfs/dbraw/zinc/60/02/31/1021600231.db2.gz GXKAJDIWXWSHOZ-KPPDAEKUSA-N 1 1 318.244 3.901 20 10 DHCDMO C[C@H]([NH2+]CC1CCC(O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000850551335 1021600716 /nfs/dbraw/zinc/60/07/16/1021600716.db2.gz GXKAJDIWXWSHOZ-WHXUTIOJSA-N 1 1 318.244 3.901 20 10 DHCDMO CCCN1CC[C@@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850557164 1021603984 /nfs/dbraw/zinc/60/39/84/1021603984.db2.gz UURPKTDMPDLDLL-VXGBXAGGSA-N 1 1 316.367 3.546 20 10 DHCDMO C[N@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccccc1O ZINC000109770929 1021746106 /nfs/dbraw/zinc/74/61/06/1021746106.db2.gz VGFQPFBJCKQATF-UHFFFAOYSA-N 1 1 320.392 3.616 20 10 DHCDMO C[N@@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccccc1O ZINC000109770929 1021746117 /nfs/dbraw/zinc/74/61/17/1021746117.db2.gz VGFQPFBJCKQATF-UHFFFAOYSA-N 1 1 320.392 3.616 20 10 DHCDMO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@@H+](C)Cc1ccccc1O ZINC000109770814 1021747457 /nfs/dbraw/zinc/74/74/57/1021747457.db2.gz AXCXRONJFAVRIK-LBPRGKRZSA-N 1 1 318.804 3.505 20 10 DHCDMO Cc1noc(C)c1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000109797463 1021749919 /nfs/dbraw/zinc/74/99/19/1021749919.db2.gz AIXGJXQKPWMSMN-UHFFFAOYSA-N 1 1 300.402 3.942 20 10 DHCDMO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)o1 ZINC000851732357 1021973876 /nfs/dbraw/zinc/97/38/76/1021973876.db2.gz OSJUASDETIYJLZ-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)o1 ZINC000851732357 1021973888 /nfs/dbraw/zinc/97/38/88/1021973888.db2.gz OSJUASDETIYJLZ-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO CC[N@H+](Cc1cc(C)cc(C(C)(C)C)c1O)C[C@@H]1CCCO1 ZINC000919945970 1021983766 /nfs/dbraw/zinc/98/37/66/1021983766.db2.gz VCCFBBPPVOQUAT-INIZCTEOSA-N 1 1 305.462 3.999 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1)C[C@H]1CCCO1 ZINC000070976153 1021997836 /nfs/dbraw/zinc/99/78/36/1021997836.db2.gz GXRDQLUDFPVHCQ-GOSISDBHSA-N 1 1 315.388 3.713 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000852084192 1022068736 /nfs/dbraw/zinc/06/87/36/1022068736.db2.gz QQRLVOVXRUXDQM-GOSISDBHSA-N 1 1 309.457 3.917 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)ccc1N(C)C ZINC000852083843 1022069310 /nfs/dbraw/zinc/06/93/10/1022069310.db2.gz MHVMSDNISFZKAG-GOSISDBHSA-N 1 1 309.457 3.836 20 10 DHCDMO COc1ccc(CNCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)cc1C ZINC000920181186 1022071339 /nfs/dbraw/zinc/07/13/39/1022071339.db2.gz GHGWRADTMOQIIN-OAHLLOKOSA-N 1 1 304.478 3.604 20 10 DHCDMO COc1ccc(CNCC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1C ZINC000920181186 1022071352 /nfs/dbraw/zinc/07/13/52/1022071352.db2.gz GHGWRADTMOQIIN-OAHLLOKOSA-N 1 1 304.478 3.604 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(OC)ccc2O)cc1 ZINC000183375922 1022121704 /nfs/dbraw/zinc/12/17/04/1022121704.db2.gz DAGALEUEWIEWFX-GOSISDBHSA-N 1 1 313.397 3.747 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[O-] ZINC000853241913 1022241353 /nfs/dbraw/zinc/24/13/53/1022241353.db2.gz YSFTWMVCEBYGTK-YJBOKZPZSA-N 1 1 320.452 3.694 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240650 1022242067 /nfs/dbraw/zinc/24/20/67/1022242067.db2.gz QDXZMNFFNPOUGO-ZFWWWQNUSA-N 1 1 322.880 3.818 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240650 1022242076 /nfs/dbraw/zinc/24/20/76/1022242076.db2.gz QDXZMNFFNPOUGO-ZFWWWQNUSA-N 1 1 322.880 3.818 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1O ZINC000853629400 1022302475 /nfs/dbraw/zinc/30/24/75/1022302475.db2.gz JMIFRGMGJMMUGV-LJQANCHMSA-N 1 1 324.424 3.831 20 10 DHCDMO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756425379 1022351930 /nfs/dbraw/zinc/35/19/30/1022351930.db2.gz ZTLOZOUFCDCOBW-NSHDSACASA-N 1 1 322.355 3.703 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1ccc(F)cc1O ZINC000756449014 1022382550 /nfs/dbraw/zinc/38/25/50/1022382550.db2.gz HFINRJFVIQZZTJ-KGLIPLIRSA-N 1 1 308.441 3.692 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CC(=O)OC(C)C)C2)cc1C ZINC000183799569 1022412640 /nfs/dbraw/zinc/41/26/40/1022412640.db2.gz IFYUYNKSFZVPEZ-INIZCTEOSA-N 1 1 319.445 3.563 20 10 DHCDMO C[C@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccc(F)cc1O ZINC000185151845 1022461999 /nfs/dbraw/zinc/46/19/99/1022461999.db2.gz HQKCRKQFMFGOHP-LBPRGKRZSA-N 1 1 313.376 3.691 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccnc(F)c1 ZINC000859059216 1033057761 /nfs/dbraw/zinc/05/77/61/1033057761.db2.gz DAVHUDPAXRZEEO-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000179672263 1022500365 /nfs/dbraw/zinc/50/03/65/1022500365.db2.gz OQETYPHCCZGEAL-KRWDZBQOSA-N 1 1 315.438 3.691 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000179884735 1022572572 /nfs/dbraw/zinc/57/25/72/1022572572.db2.gz WNEFDOVKAXGTSA-ROUUACIJSA-N 1 1 316.489 3.787 20 10 DHCDMO Cc1cccc(CN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884735 1022572577 /nfs/dbraw/zinc/57/25/77/1022572577.db2.gz WNEFDOVKAXGTSA-ROUUACIJSA-N 1 1 316.489 3.787 20 10 DHCDMO Cc1cccc(CN2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884735 1022572583 /nfs/dbraw/zinc/57/25/83/1022572583.db2.gz WNEFDOVKAXGTSA-ROUUACIJSA-N 1 1 316.489 3.787 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)c1O ZINC000180396225 1022719171 /nfs/dbraw/zinc/71/91/71/1022719171.db2.gz XVJGFOMCFXYUBV-KSSFIOAISA-N 1 1 315.388 3.802 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cncc(Cl)c2)C2CC2)cc1 ZINC000856722448 1022845065 /nfs/dbraw/zinc/84/50/65/1022845065.db2.gz YXWIVMBHNFPDPN-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@@H]2CC2(F)F)c1 ZINC000856802499 1022872504 /nfs/dbraw/zinc/87/25/04/1022872504.db2.gz IPEWLISTFOXESA-SNVBAGLBSA-N 1 1 320.177 3.598 20 10 DHCDMO CC1CCC([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000876548123 1033087648 /nfs/dbraw/zinc/08/76/48/1033087648.db2.gz UHXLMXVSQWFYJM-UHFFFAOYSA-N 1 1 316.489 3.658 20 10 DHCDMO COCC[N@@H+](Cc1ccccc1)Cc1ccc(N(C)C)c(F)c1 ZINC000768159899 1022907626 /nfs/dbraw/zinc/90/76/26/1022907626.db2.gz HJYBAHADPRLZBH-UHFFFAOYSA-N 1 1 316.420 3.540 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000768175731 1022912843 /nfs/dbraw/zinc/91/28/43/1022912843.db2.gz UUGOVRGCGBNOMV-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CCCC1 ZINC000768214825 1022927733 /nfs/dbraw/zinc/92/77/33/1022927733.db2.gz QSJXSSNDCBMKNR-UHFFFAOYSA-N 1 1 317.433 3.960 20 10 DHCDMO CCN1CCC([N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768232510 1022929842 /nfs/dbraw/zinc/92/98/42/1022929842.db2.gz CRLASCNCORVTRW-UHFFFAOYSA-N 1 1 324.468 3.975 20 10 DHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](O)C2)c(O)c(C(C)(C)C)c1 ZINC000768236282 1022934338 /nfs/dbraw/zinc/93/43/38/1022934338.db2.gz FWEQHRGYLKSSMC-OAHLLOKOSA-N 1 1 305.462 3.554 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCO[C@H]1C1CC1)c1cc(F)cc(F)c1O ZINC000768291753 1022940685 /nfs/dbraw/zinc/94/06/85/1022940685.db2.gz FPYHXXCGEKGEAM-PZDALLCQSA-N 1 1 311.372 3.526 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000768329878 1022948283 /nfs/dbraw/zinc/94/82/83/1022948283.db2.gz IWNQEQFFOVTZPP-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000768329886 1022948671 /nfs/dbraw/zinc/94/86/71/1022948671.db2.gz JTHWISSNDZLYGT-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(O)cc1C ZINC000768450099 1022967777 /nfs/dbraw/zinc/96/77/77/1022967777.db2.gz HQZJQZYKIWEOIY-HNNXBMFYSA-N 1 1 315.388 3.838 20 10 DHCDMO COC1CCC([N@@H+](C)Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444468 1022968124 /nfs/dbraw/zinc/96/81/24/1022968124.db2.gz BMSWAXZQYPEEPC-UHFFFAOYSA-N 1 1 303.446 3.660 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2CCC(C)C)cc1OC ZINC000768463421 1022972152 /nfs/dbraw/zinc/97/21/52/1022972152.db2.gz SRBNMZFOEGDFMU-OAHLLOKOSA-N 1 1 307.434 3.810 20 10 DHCDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768465746 1022973253 /nfs/dbraw/zinc/97/32/53/1022973253.db2.gz KFHZWGVEDIXTPE-HIFRSBDPSA-N 1 1 307.434 3.810 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCC3(CCOCC3)C1)CCCC2 ZINC000768466721 1022976023 /nfs/dbraw/zinc/97/60/23/1022976023.db2.gz VIPYGFAWYKBONK-UHFFFAOYSA-N 1 1 315.457 3.664 20 10 DHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1c(O)cccc1OC ZINC000768471277 1022976211 /nfs/dbraw/zinc/97/62/11/1022976211.db2.gz MBJSKVICTFVZPU-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)CCc2ccc(F)c(F)c2)cc1 ZINC000768532542 1022983036 /nfs/dbraw/zinc/98/30/36/1022983036.db2.gz AYCUDUMBIQWEEE-UHFFFAOYSA-N 1 1 304.384 3.705 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H](COC)C2)cc1 ZINC000768539675 1022986858 /nfs/dbraw/zinc/98/68/58/1022986858.db2.gz ARZKIBCHNJAZKI-SFHVURJKSA-N 1 1 304.478 3.781 20 10 DHCDMO Oc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCCC3)cc1)CC2 ZINC000768868672 1023043356 /nfs/dbraw/zinc/04/33/56/1023043356.db2.gz PPBMGZRGSKPJFH-UHFFFAOYSA-N 1 1 322.452 3.941 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)c1 ZINC000768917999 1023056402 /nfs/dbraw/zinc/05/64/02/1023056402.db2.gz DDCCDOWMUQIIOW-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)c1 ZINC000768917999 1023056411 /nfs/dbraw/zinc/05/64/11/1023056411.db2.gz DDCCDOWMUQIIOW-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3sccc3C)CC2)cc1 ZINC000768999071 1023074992 /nfs/dbraw/zinc/07/49/92/1023074992.db2.gz SUEDOINUOXQOJG-UHFFFAOYSA-N 1 1 316.470 3.777 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C)O1 ZINC000769103831 1023091013 /nfs/dbraw/zinc/09/10/13/1023091013.db2.gz CNOCGQKZJUFWPL-LPHOPBHVSA-N 1 1 302.462 3.676 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000769192868 1023091392 /nfs/dbraw/zinc/09/13/92/1023091392.db2.gz QZIPWPCYAGLXER-UHFFFAOYSA-N 1 1 310.441 3.870 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cc1 ZINC000769315191 1023119733 /nfs/dbraw/zinc/11/97/33/1023119733.db2.gz HGLHNOIXGQVFNA-FQEVSTJZSA-N 1 1 310.441 3.716 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1O ZINC000769339625 1023128183 /nfs/dbraw/zinc/12/81/83/1023128183.db2.gz UHXRAGIVMJFWSC-HNNXBMFYSA-N 1 1 315.388 3.920 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c1O ZINC000769339373 1023129442 /nfs/dbraw/zinc/12/94/42/1023129442.db2.gz WCXAIZRNBAMKCE-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769405388 1023142876 /nfs/dbraw/zinc/14/28/76/1023142876.db2.gz UXWZFDKRMFYNNR-POAQFYNOSA-N 1 1 314.473 3.676 20 10 DHCDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000769487093 1023152895 /nfs/dbraw/zinc/15/28/95/1023152895.db2.gz HOFLEZAHEXHFFM-INIZCTEOSA-N 1 1 313.397 3.574 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000769469732 1023160848 /nfs/dbraw/zinc/16/08/48/1023160848.db2.gz DMSSHEGBQUAJHI-QRVBRYPASA-N 1 1 316.489 3.778 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000769476205 1023165186 /nfs/dbraw/zinc/16/51/86/1023165186.db2.gz XGPFVDWQJAFVCE-OXQOHEQNSA-N 1 1 311.425 3.971 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1F ZINC000769509380 1023170832 /nfs/dbraw/zinc/17/08/32/1023170832.db2.gz XGBZPSDXCDJMEA-KRWDZBQOSA-N 1 1 302.368 3.978 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)cc1F ZINC000769509380 1023170834 /nfs/dbraw/zinc/17/08/34/1023170834.db2.gz XGBZPSDXCDJMEA-KRWDZBQOSA-N 1 1 302.368 3.978 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000769513564 1023172425 /nfs/dbraw/zinc/17/24/25/1023172425.db2.gz BQWFNCJLJWPRGI-RBUKOAKNSA-N 1 1 323.436 3.918 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC000769534175 1023173469 /nfs/dbraw/zinc/17/34/69/1023173469.db2.gz SLMZXIPAFUMAAA-UHFFFAOYSA-N 1 1 302.368 3.589 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC000769534175 1023173476 /nfs/dbraw/zinc/17/34/76/1023173476.db2.gz SLMZXIPAFUMAAA-UHFFFAOYSA-N 1 1 302.368 3.589 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC000769534539 1023176157 /nfs/dbraw/zinc/17/61/57/1023176157.db2.gz VRJCUMBNAAPXPJ-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC000769534539 1023176158 /nfs/dbraw/zinc/17/61/58/1023176158.db2.gz VRJCUMBNAAPXPJ-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCOCC12CCCC2 ZINC000769534730 1023176241 /nfs/dbraw/zinc/17/62/41/1023176241.db2.gz YVTIZDXRGNGHJP-UHFFFAOYSA-N 1 1 314.473 3.822 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000770286015 1023291817 /nfs/dbraw/zinc/29/18/17/1023291817.db2.gz NLTRIMPAFZFVSY-UYAOXDASSA-N 1 1 314.473 3.678 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cc(Cl)cn2C)cc1F ZINC000770303337 1023294557 /nfs/dbraw/zinc/29/45/57/1023294557.db2.gz FRKHLCAQPRUDSI-UHFFFAOYSA-N 1 1 309.816 3.516 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(Cl)cn2C)cc1F ZINC000770303337 1023294565 /nfs/dbraw/zinc/29/45/65/1023294565.db2.gz FRKHLCAQPRUDSI-UHFFFAOYSA-N 1 1 309.816 3.516 20 10 DHCDMO COc1cccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1O ZINC000770327974 1023296633 /nfs/dbraw/zinc/29/66/33/1023296633.db2.gz VLFMLTJZZOTRQE-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1O ZINC000770327974 1023296639 /nfs/dbraw/zinc/29/66/39/1023296639.db2.gz VLFMLTJZZOTRQE-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO COc1cccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1O ZINC000770327977 1023299101 /nfs/dbraw/zinc/29/91/01/1023299101.db2.gz VLFMLTJZZOTRQE-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1O ZINC000770327977 1023299107 /nfs/dbraw/zinc/29/91/07/1023299107.db2.gz VLFMLTJZZOTRQE-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC000770376150 1023300690 /nfs/dbraw/zinc/30/06/90/1023300690.db2.gz VDPRMTCLFPHKME-RBUKOAKNSA-N 1 1 316.489 3.781 20 10 DHCDMO CCOc1ccc(C[N@H+](C)[C@H]2C[C@@H](OCC)C23CCC3)c(O)c1 ZINC000770352458 1023304202 /nfs/dbraw/zinc/30/42/02/1023304202.db2.gz NWRKERXYBLFSIP-ZWKOTPCHSA-N 1 1 319.445 3.570 20 10 DHCDMO COCC[N@H+](Cc1ccccc1O)Cc1ccc(F)cc1Cl ZINC000770510869 1023316096 /nfs/dbraw/zinc/31/60/96/1023316096.db2.gz SZDXOFMOMWRAJK-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO COCC[N@@H+](Cc1ccccc1O)Cc1ccc(F)cc1Cl ZINC000770510869 1023316101 /nfs/dbraw/zinc/31/61/01/1023316101.db2.gz SZDXOFMOMWRAJK-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO Cc1cnc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000772175541 1023527945 /nfs/dbraw/zinc/52/79/45/1023527945.db2.gz QTCZNMLNXOBYMK-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO Cc1cnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000772175541 1023527953 /nfs/dbraw/zinc/52/79/53/1023527953.db2.gz QTCZNMLNXOBYMK-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO CC[C@@]1(C)C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000785985306 1023649228 /nfs/dbraw/zinc/64/92/28/1023649228.db2.gz UZVRDZWZTBZWLG-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)CN1CCC[C@@H](C)C1)c1ccc(F)cc1O ZINC000796703173 1023897832 /nfs/dbraw/zinc/89/78/32/1023897832.db2.gz FQULDICZRXIWQV-CPUCHLNUSA-N 1 1 308.441 3.692 20 10 DHCDMO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H](O)c1ccccc1 ZINC000788623031 1023914932 /nfs/dbraw/zinc/91/49/32/1023914932.db2.gz VCDMBOIRBKPQPB-FASAQXTFSA-N 1 1 317.404 3.940 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788695201 1023927497 /nfs/dbraw/zinc/92/74/97/1023927497.db2.gz ZEISVZNECLAQSW-GHMZBOCLSA-N 1 1 303.324 3.631 20 10 DHCDMO CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788808649 1023936164 /nfs/dbraw/zinc/93/61/64/1023936164.db2.gz YQCLBNLKADUDHJ-NEPJUHHUSA-N 1 1 318.383 3.792 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000165234711 1024141625 /nfs/dbraw/zinc/14/16/25/1024141625.db2.gz IGSHGEXTUKWFGR-KBXCAEBGSA-N 1 1 316.445 3.946 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000882915616 1024171583 /nfs/dbraw/zinc/17/15/83/1024171583.db2.gz VLRWDLCGHMBTFA-OAHLLOKOSA-N 1 1 323.314 3.813 20 10 DHCDMO CC(C)[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1cccnc1 ZINC000883032061 1024218218 /nfs/dbraw/zinc/21/82/18/1024218218.db2.gz VGDIFAAHLNTDLD-HNNXBMFYSA-N 1 1 306.356 3.595 20 10 DHCDMO Cc1c(C[N@@H+](C)Cc2cc(C)cc(C(C)(C)C)c2O)cnn1C ZINC000790416647 1024298588 /nfs/dbraw/zinc/29/85/88/1024298588.db2.gz AFMFEEXOKOLGGS-UHFFFAOYSA-N 1 1 315.461 3.672 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)CCOc2cccc(C)c2)c1O ZINC000216353568 1024307330 /nfs/dbraw/zinc/30/73/30/1024307330.db2.gz QQXFOPKKTHERNQ-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Cl)cc1O ZINC000883311854 1024363969 /nfs/dbraw/zinc/36/39/69/1024363969.db2.gz MODNVIALGCRQDK-NSHDSACASA-N 1 1 303.793 3.566 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCCNc1ccccc1 ZINC000790968060 1024408987 /nfs/dbraw/zinc/40/89/87/1024408987.db2.gz IAKFIQYBEDZAGK-UHFFFAOYSA-N 1 1 308.784 3.777 20 10 DHCDMO COC[C@@H](Cc1ccccc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790970606 1024410178 /nfs/dbraw/zinc/41/01/78/1024410178.db2.gz LZVKCIDJUDPZEQ-CYBMUJFWSA-N 1 1 323.795 3.532 20 10 DHCDMO Cc1c(C[NH2+]Cc2c(O)ccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000790998297 1024415174 /nfs/dbraw/zinc/41/51/74/1024415174.db2.gz IQNOORYJVDDVRL-UHFFFAOYSA-N 1 1 324.739 3.691 20 10 DHCDMO C[C@@](O)(C[NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790996981 1024415559 /nfs/dbraw/zinc/41/55/59/1024415559.db2.gz JWQZVUFXWPTFIL-MRXNPFEDSA-N 1 1 315.816 3.606 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1O ZINC000271158715 1024463950 /nfs/dbraw/zinc/46/39/50/1024463950.db2.gz DVSGVLPYEZNTFW-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO CC[N@H+](CCc1ccccn1)Cc1c(O)ccc(Cl)c1F ZINC000792166778 1024641701 /nfs/dbraw/zinc/64/17/01/1024641701.db2.gz GUNVXBLMMJIPNQ-UHFFFAOYSA-N 1 1 308.784 3.644 20 10 DHCDMO CC[N@@H+](CCc1ccccn1)Cc1c(O)ccc(Cl)c1F ZINC000792166778 1024641709 /nfs/dbraw/zinc/64/17/09/1024641709.db2.gz GUNVXBLMMJIPNQ-UHFFFAOYSA-N 1 1 308.784 3.644 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)cc1F ZINC000279114144 1024738283 /nfs/dbraw/zinc/73/82/83/1024738283.db2.gz KSSWFSRRRVJXOG-UHFFFAOYSA-N 1 1 321.465 3.936 20 10 DHCDMO COC(=O)C(C)(C)CC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000792790038 1024791731 /nfs/dbraw/zinc/79/17/31/1024791731.db2.gz OJSMUWAEGJJIRU-UHFFFAOYSA-N 1 1 320.477 3.552 20 10 DHCDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000793216383 1024936844 /nfs/dbraw/zinc/93/68/44/1024936844.db2.gz FLRUNDTVFOOFER-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000793232526 1024949111 /nfs/dbraw/zinc/94/91/11/1024949111.db2.gz XBIPCXPGDHDARO-KCJUWKMLSA-N 1 1 323.742 3.827 20 10 DHCDMO COc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)c(O)c1 ZINC000793386538 1025029575 /nfs/dbraw/zinc/02/95/75/1025029575.db2.gz VSHSJCAFDDZMJR-MRXNPFEDSA-N 1 1 321.367 3.757 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC000318944475 1025088362 /nfs/dbraw/zinc/08/83/62/1025088362.db2.gz ZVEWVMGTXMVOGH-CYBMUJFWSA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1cc(Br)ccc1C[NH2+]C1(C(F)F)CCCC1 ZINC000825943291 1033260975 /nfs/dbraw/zinc/26/09/75/1033260975.db2.gz BQGYEENNRHIHKL-UHFFFAOYSA-N 1 1 320.177 3.822 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1C[C@]12CCOC2)C1CCCC1 ZINC000886008524 1025437063 /nfs/dbraw/zinc/43/70/63/1025437063.db2.gz OPNDKYWPYOMSHL-LPHOPBHVSA-N 1 1 301.430 3.563 20 10 DHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877337017 1033285146 /nfs/dbraw/zinc/28/51/46/1033285146.db2.gz VXPWPLQLQYOAIP-SFHVURJKSA-N 1 1 316.489 3.802 20 10 DHCDMO Cc1n[nH]c(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1C ZINC000893864265 1025578261 /nfs/dbraw/zinc/57/82/61/1025578261.db2.gz WCPVDMASRJGPKF-UHFFFAOYSA-N 1 1 312.461 3.649 20 10 DHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886533141 1025680138 /nfs/dbraw/zinc/68/01/38/1025680138.db2.gz VTKXNEXZWSAXFD-ABAIWWIYSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1c(O)cccc1F ZINC000886639931 1025754948 /nfs/dbraw/zinc/75/49/48/1025754948.db2.gz NWJJACFDRZDIAA-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@@H](O)c1ccccc1 ZINC000886649429 1025759929 /nfs/dbraw/zinc/75/99/29/1025759929.db2.gz AKHYCKZWOQVXJG-MRAWALMUSA-N 1 1 303.377 3.694 20 10 DHCDMO CC(C)[C@@H](CO)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000806170034 1025797641 /nfs/dbraw/zinc/79/76/41/1025797641.db2.gz VTBJXOGRRDWUAV-NXEZZACHSA-N 1 1 306.233 3.614 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c(O)c1 ZINC000289660347 1026117114 /nfs/dbraw/zinc/11/71/14/1026117114.db2.gz YNONHPFYWRPZDV-QGZVFWFLSA-N 1 1 315.417 3.631 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c(O)c1 ZINC000289660347 1026117120 /nfs/dbraw/zinc/11/71/20/1026117120.db2.gz YNONHPFYWRPZDV-QGZVFWFLSA-N 1 1 315.417 3.631 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1C ZINC000122124132 1026171289 /nfs/dbraw/zinc/17/12/89/1026171289.db2.gz ZSPRRPJCYMICQE-QGZVFWFLSA-N 1 1 303.427 3.644 20 10 DHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000808236233 1026241203 /nfs/dbraw/zinc/24/12/03/1026241203.db2.gz YPVFRBHRUZGOTN-UHFFFAOYSA-N 1 1 310.441 3.579 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c1O ZINC000809711894 1026601867 /nfs/dbraw/zinc/60/18/67/1026601867.db2.gz SDYVPWVMNZIWQQ-UHFFFAOYSA-N 1 1 314.404 3.552 20 10 DHCDMO C[C@@H](C[N@@H+](Cc1cc(F)ccc1O)[C@@H](C)CO)c1ccccc1 ZINC000809773845 1026607782 /nfs/dbraw/zinc/60/77/82/1026607782.db2.gz ALXABLJTSXLPCX-GJZGRUSLSA-N 1 1 317.404 3.518 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@]2(C)CCCO)cc1F ZINC000809755621 1026616973 /nfs/dbraw/zinc/61/69/73/1026616973.db2.gz AFMVXISZTWPGRS-LJQANCHMSA-N 1 1 322.468 3.799 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1O ZINC000809758142 1026618309 /nfs/dbraw/zinc/61/83/09/1026618309.db2.gz DTTADWBHXQZOKO-HUUCEWRRSA-N 1 1 323.864 3.993 20 10 DHCDMO CC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccc(C)cc1O ZINC000280249606 1026623800 /nfs/dbraw/zinc/62/38/00/1026623800.db2.gz WNXNSPWNDMQEEL-GOSISDBHSA-N 1 1 304.478 3.862 20 10 DHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1c(O)cccc1Cl ZINC000809788379 1026626038 /nfs/dbraw/zinc/62/60/38/1026626038.db2.gz RLMFUWPVTUBWNJ-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO COc1cccc(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c1O ZINC000809789768 1026627610 /nfs/dbraw/zinc/62/76/10/1026627610.db2.gz DUWGZSVWSXAQON-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO C[N@@H+](Cc1cc(O)cc(C(F)(F)F)c1)Cc1ccccc1O ZINC000811458138 1027005980 /nfs/dbraw/zinc/00/59/80/1027005980.db2.gz UHHDUQZHHVJGGG-UHFFFAOYSA-N 1 1 311.303 3.749 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Br)ccc2O)CCC1(F)F ZINC000811512060 1027027467 /nfs/dbraw/zinc/02/74/67/1027027467.db2.gz DCWABOLGDCLZLF-VIFPVBQESA-N 1 1 320.177 3.632 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1C ZINC000811513121 1027029556 /nfs/dbraw/zinc/02/95/56/1027029556.db2.gz WNZVJTNZOPFHFD-NRFANRHFSA-N 1 1 323.436 3.979 20 10 DHCDMO Cc1cnn([C@H]2CC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)c1 ZINC000811799115 1027086448 /nfs/dbraw/zinc/08/64/48/1027086448.db2.gz QVKXRFCOPPUUBY-KRWDZBQOSA-N 1 1 313.445 3.776 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)c(F)cc1[O-] ZINC000295305985 1027190543 /nfs/dbraw/zinc/19/05/43/1027190543.db2.gz KEZAQUBSSXTXJL-UHFFFAOYSA-N 1 1 314.813 3.706 20 10 DHCDMO CC[N@H+](CCc1nccs1)Cc1cc(Cl)c(F)cc1O ZINC000295305985 1027190548 /nfs/dbraw/zinc/19/05/48/1027190548.db2.gz KEZAQUBSSXTXJL-UHFFFAOYSA-N 1 1 314.813 3.706 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)c(F)cc1O ZINC000295305985 1027190559 /nfs/dbraw/zinc/19/05/59/1027190559.db2.gz KEZAQUBSSXTXJL-UHFFFAOYSA-N 1 1 314.813 3.706 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C)[C@@H](C)C3)cc2)CC1 ZINC000828576521 1027205078 /nfs/dbraw/zinc/20/50/78/1027205078.db2.gz NCEYNBUMTVJLIQ-IRXDYDNUSA-N 1 1 316.489 3.780 20 10 DHCDMO C[N@@H+](CCOc1ccccc1Cl)Cc1cc(F)ccc1O ZINC000778993838 1027731333 /nfs/dbraw/zinc/73/13/33/1027731333.db2.gz AUZHDHLQCXEKKW-UHFFFAOYSA-N 1 1 309.768 3.696 20 10 DHCDMO C[C@H](CN[C@H](C)c1ccc(N2CCCCCC2)cc1)C[NH+](C)C ZINC000813877528 1027748155 /nfs/dbraw/zinc/74/81/55/1027748155.db2.gz YSYGEIZFKKYOMK-QZTJIDSGSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1)CN(C)C ZINC000813877528 1027748171 /nfs/dbraw/zinc/74/81/71/1027748171.db2.gz YSYGEIZFKKYOMK-QZTJIDSGSA-N 1 1 317.521 3.915 20 10 DHCDMO CN1CC[C@@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178114 1027913094 /nfs/dbraw/zinc/91/30/94/1027913094.db2.gz CGHOPBVLAGZMJM-OAQYLSRUSA-N 1 1 322.452 3.587 20 10 DHCDMO CN1CC[C@@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178114 1027913114 /nfs/dbraw/zinc/91/31/14/1027913114.db2.gz CGHOPBVLAGZMJM-OAQYLSRUSA-N 1 1 322.452 3.587 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1O ZINC000814169045 1027925275 /nfs/dbraw/zinc/92/52/75/1027925275.db2.gz CHKXDVAPCGPGPW-OCCSQVGLSA-N 1 1 301.764 3.831 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000527928217 1027963774 /nfs/dbraw/zinc/96/37/74/1027963774.db2.gz NTXQTMFLIVABGF-NWDGAFQWSA-N 1 1 317.351 3.878 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000366544076 1028095552 /nfs/dbraw/zinc/09/55/52/1028095552.db2.gz KNYCBRCAZHLMCY-UGSOOPFHSA-N 1 1 312.413 3.940 20 10 DHCDMO CC(C)[C@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000814630842 1028130669 /nfs/dbraw/zinc/13/06/69/1028130669.db2.gz ZESAXOBYEOKLPF-OXQOHEQNSA-N 1 1 313.441 3.972 20 10 DHCDMO Cc1noc(C)c1C[N@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000159783891 1028231318 /nfs/dbraw/zinc/23/13/18/1028231318.db2.gz WKLYWNUQLVEEPM-UHFFFAOYSA-N 1 1 300.402 3.508 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137222 1028311565 /nfs/dbraw/zinc/31/15/65/1028311565.db2.gz YGDHAAGYDYYVEV-WMZOPIPTSA-N 1 1 302.462 3.507 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137222 1028311584 /nfs/dbraw/zinc/31/15/84/1028311584.db2.gz YGDHAAGYDYYVEV-WMZOPIPTSA-N 1 1 302.462 3.507 20 10 DHCDMO CCc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)nc1 ZINC000815019525 1028329562 /nfs/dbraw/zinc/32/95/62/1028329562.db2.gz OUVDUNMMONGBIE-UHFFFAOYSA-N 1 1 309.457 3.875 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)ccc1N(C)C ZINC000815016013 1028329703 /nfs/dbraw/zinc/32/97/03/1028329703.db2.gz VEPWSXFSEDKYHG-HXUWFJFHSA-N 1 1 310.441 3.635 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccccc1O ZINC000368484443 1028362750 /nfs/dbraw/zinc/36/27/50/1028362750.db2.gz YIPIBUJRXOEHSA-XAUMDUMWSA-N 1 1 310.441 3.736 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)ccc1N(C)C ZINC000815118501 1028365586 /nfs/dbraw/zinc/36/55/86/1028365586.db2.gz WJGZWDXRRHULPL-SJLPKXTDSA-N 1 1 304.478 3.577 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)ccc1N(C)C ZINC000815095806 1028374693 /nfs/dbraw/zinc/37/46/93/1028374693.db2.gz YTYWKIIHARQJCT-NRFANRHFSA-N 1 1 322.452 3.692 20 10 DHCDMO C[C@H]([NH2+]Cc1nccs1)c1cccc(C(F)(F)F)c1O ZINC000815563066 1028544570 /nfs/dbraw/zinc/54/45/70/1028544570.db2.gz SRXMPBIRUQKQDB-QMMMGPOBSA-N 1 1 302.321 3.718 20 10 DHCDMO CCc1cc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)[nH]n1 ZINC000815580724 1028554342 /nfs/dbraw/zinc/55/43/42/1028554342.db2.gz PLSYREVKZNVBSX-SECBINFHSA-N 1 1 313.323 3.547 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCSC1)c1cccc(C(F)(F)F)c1O ZINC000815586105 1028555707 /nfs/dbraw/zinc/55/57/07/1028555707.db2.gz ZITPMQBDOVNKHL-ZJUUUORDSA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@H]([NH2+]CCOC(F)(F)F)c1cccc(C(F)(F)F)c1O ZINC000815619339 1028573141 /nfs/dbraw/zinc/57/31/41/1028573141.db2.gz KGWAKLFHCLBNEQ-ZETCQYMHSA-N 1 1 317.229 3.598 20 10 DHCDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816493292 1028897952 /nfs/dbraw/zinc/89/79/52/1028897952.db2.gz VZJQSMJRRXUXCB-MRXNPFEDSA-N 1 1 321.420 3.928 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)ccc2ccccc21 ZINC000816493370 1028899357 /nfs/dbraw/zinc/89/93/57/1028899357.db2.gz YNUAPHCXDYCGPY-HNNXBMFYSA-N 1 1 307.397 3.648 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)C1Cc2ccccc2C1 ZINC000816495665 1028899678 /nfs/dbraw/zinc/89/96/78/1028899678.db2.gz FMGTYCVKFKZSJO-UHFFFAOYSA-N 1 1 305.780 3.784 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C1Cc2ccccc2C1 ZINC000816495665 1028899690 /nfs/dbraw/zinc/89/96/90/1028899690.db2.gz FMGTYCVKFKZSJO-UHFFFAOYSA-N 1 1 305.780 3.784 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H]2CN2CCCC2)ccc2ccccc21 ZINC000816497856 1028906983 /nfs/dbraw/zinc/90/69/83/1028906983.db2.gz WHLQNLKRGPQVFC-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(CN2CCC[C@H]2C[NH+]2CCCC2)ccc2ccccc21 ZINC000816497856 1028907000 /nfs/dbraw/zinc/90/70/00/1028907000.db2.gz WHLQNLKRGPQVFC-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](n3ccnc3)C2)ccc2ccccc21 ZINC000816501934 1028909803 /nfs/dbraw/zinc/90/98/03/1028909803.db2.gz HLBDGABPPZXWAG-QGZVFWFLSA-N 1 1 307.397 3.579 20 10 DHCDMO CC1CC[NH+](CCC[NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000816530404 1028922736 /nfs/dbraw/zinc/92/27/36/1028922736.db2.gz HCUHCOCTWMNMMX-UHFFFAOYSA-N 1 1 312.457 3.757 20 10 DHCDMO C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)Oc1ccccc1 ZINC000816551409 1028934116 /nfs/dbraw/zinc/93/41/16/1028934116.db2.gz ARHCXZQZZMZEHS-LLVKDONJSA-N 1 1 309.768 3.742 20 10 DHCDMO CCCC(O)(CCC)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816552858 1028943226 /nfs/dbraw/zinc/94/32/26/1028943226.db2.gz ZLDBDAWGSSJXDB-UHFFFAOYSA-N 1 1 303.805 3.606 20 10 DHCDMO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816559660 1028943857 /nfs/dbraw/zinc/94/38/57/1028943857.db2.gz QURPPPZNGPWRTH-NHYWBVRUSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000816599386 1028956335 /nfs/dbraw/zinc/95/63/35/1028956335.db2.gz KXSIPQUQDGFAPY-LLVKDONJSA-N 1 1 306.768 3.569 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000816599386 1028956349 /nfs/dbraw/zinc/95/63/49/1028956349.db2.gz KXSIPQUQDGFAPY-LLVKDONJSA-N 1 1 306.768 3.569 20 10 DHCDMO Cc1cc(C)cc([C@H](O)C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816600552 1028956847 /nfs/dbraw/zinc/95/68/47/1028956847.db2.gz AXCZWUKZMUHQMX-QGZVFWFLSA-N 1 1 323.795 3.625 20 10 DHCDMO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816613223 1028965704 /nfs/dbraw/zinc/96/57/04/1028965704.db2.gz MTHKBPYTXOUSDN-XXFAHNHDSA-N 1 1 307.752 3.797 20 10 DHCDMO CC(F)(F)C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000816642560 1028969249 /nfs/dbraw/zinc/96/92/49/1028969249.db2.gz CRYLCBHYPVJSTD-UHFFFAOYSA-N 1 1 307.340 3.716 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(O)c1 ZINC000816621853 1028969619 /nfs/dbraw/zinc/96/96/19/1028969619.db2.gz QPDDUPBKSFAOCV-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO Oc1cc(F)c(Cl)cc1CN1CCOC[C@H]1CC1CCC1 ZINC000816667648 1028983797 /nfs/dbraw/zinc/98/37/97/1028983797.db2.gz STNRUZPPBFJBDN-CYBMUJFWSA-N 1 1 313.800 3.576 20 10 DHCDMO O[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C12CCCC2 ZINC000816630779 1028985973 /nfs/dbraw/zinc/98/59/73/1028985973.db2.gz RLJMRBYEWIQENT-LJQANCHMSA-N 1 1 314.473 3.556 20 10 DHCDMO CC[C@@H](NC1CC([NH+]2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000373524313 1029069073 /nfs/dbraw/zinc/06/90/73/1029069073.db2.gz RYQVXKCLXTXXRQ-LYBXBRPPSA-N 1 1 315.505 3.810 20 10 DHCDMO CC[C@@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000373524313 1029069091 /nfs/dbraw/zinc/06/90/91/1029069091.db2.gz RYQVXKCLXTXXRQ-LYBXBRPPSA-N 1 1 315.505 3.810 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](c3csc(C)c3)C2)c1O ZINC000373565514 1029079503 /nfs/dbraw/zinc/07/95/03/1029079503.db2.gz BYTTVAHKTIQUKN-ZDUSSCGKSA-N 1 1 303.427 3.760 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)C2CC(OC(C)(C)C)C2)c1O ZINC000817416007 1029154362 /nfs/dbraw/zinc/15/43/62/1029154362.db2.gz HJOJKMTUPQGTCH-UHFFFAOYSA-N 1 1 307.434 3.569 20 10 DHCDMO CCC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817941167 1029283981 /nfs/dbraw/zinc/28/39/81/1029283981.db2.gz JGUMAPNTGRGUMD-QZTJIDSGSA-N 1 1 317.502 3.945 20 10 DHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)s1 ZINC000817938783 1029284873 /nfs/dbraw/zinc/28/48/73/1029284873.db2.gz SIIWKQFJUXCEKF-RISCZKNCSA-N 1 1 323.893 3.818 20 10 DHCDMO CC(C)[NH2+]CCCN[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817953346 1029294463 /nfs/dbraw/zinc/29/44/63/1029294463.db2.gz KZJAXXFZGKIYHN-KRWDZBQOSA-N 1 1 303.494 3.716 20 10 DHCDMO C[C@@H](NCC1([NH3+])CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000817965170 1029304091 /nfs/dbraw/zinc/30/40/91/1029304091.db2.gz QMHLCPIXXCFAAV-MRXNPFEDSA-N 1 1 301.478 3.599 20 10 DHCDMO C[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000817971198 1029310653 /nfs/dbraw/zinc/31/06/53/1029310653.db2.gz KLBWDKKKEHTXCU-ABSDTBQOSA-N 1 1 315.505 3.716 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc2ccccc2c1[O-] ZINC000817975629 1029314994 /nfs/dbraw/zinc/31/49/94/1029314994.db2.gz PFPYUBVMRNMLGB-BZUAXINKSA-N 1 1 312.457 3.961 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCOC1CCC1)Cc1ccco1 ZINC000805745672 1029710829 /nfs/dbraw/zinc/71/08/29/1029710829.db2.gz DOZNZPHTXYZMKG-UHFFFAOYSA-N 1 1 301.386 3.557 20 10 DHCDMO CCOc1ccc(O)c(C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000865822636 1030040280 /nfs/dbraw/zinc/04/02/80/1030040280.db2.gz MPMSNQZSAGOBPJ-MRXNPFEDSA-N 1 1 307.340 3.730 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH+]2CC(CC(F)F)C2)c1 ZINC000822521136 1030041271 /nfs/dbraw/zinc/04/12/71/1030041271.db2.gz XCHIDHNWCLCPSD-UHFFFAOYSA-N 1 1 320.177 3.550 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822530384 1030045980 /nfs/dbraw/zinc/04/59/80/1030045980.db2.gz ZMVQXOABDSBUQP-KRWDZBQOSA-N 1 1 321.848 3.827 20 10 DHCDMO C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(Cl)ccc1[O-] ZINC000866516495 1030341805 /nfs/dbraw/zinc/34/18/05/1030341805.db2.gz ARYIJEWNABUHFY-MKQDKFQKSA-N 1 1 310.869 3.959 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1[N+](=O)[O-] ZINC000866540518 1030360687 /nfs/dbraw/zinc/36/06/87/1030360687.db2.gz PQPPRWAJYATTMW-NSHDSACASA-N 1 1 304.321 3.599 20 10 DHCDMO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000866632631 1030413178 /nfs/dbraw/zinc/41/31/78/1030413178.db2.gz AHRFTXSMBWTPNB-OUAUKWLOSA-N 1 1 305.340 3.611 20 10 DHCDMO CCC1([NH3+])CC[NH+]([C@H](C)c2ccc(Cl)c(Cl)c2[O-])CC1 ZINC000925761326 1030485527 /nfs/dbraw/zinc/48/55/27/1030485527.db2.gz ZMYPSXKIYSURQN-SNVBAGLBSA-N 1 1 317.260 3.963 20 10 DHCDMO C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc2ccccc2c1[O-] ZINC000925840308 1030517743 /nfs/dbraw/zinc/51/77/43/1030517743.db2.gz IBDCSOZYRIYJED-BOUXLOLZSA-N 1 1 310.441 3.728 20 10 DHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@H](F)C1 ZINC000824571650 1030585881 /nfs/dbraw/zinc/58/58/81/1030585881.db2.gz OYFOGSJZKMOJNR-INIZCTEOSA-N 1 1 301.361 3.515 20 10 DHCDMO CC(C)(C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccn1 ZINC000824590496 1030590296 /nfs/dbraw/zinc/59/02/96/1030590296.db2.gz NQBFIKWEZLPADU-UHFFFAOYSA-N 1 1 308.784 3.647 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1 ZINC000824716405 1030620254 /nfs/dbraw/zinc/62/02/54/1030620254.db2.gz UFPNFZRJMSDCQK-YPMHNXCESA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000824751052 1030638085 /nfs/dbraw/zinc/63/80/85/1030638085.db2.gz QUYGKCWDEBVPHS-NSHDSACASA-N 1 1 313.800 3.624 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H]1C ZINC000824815419 1030646602 /nfs/dbraw/zinc/64/66/02/1030646602.db2.gz OLKQTNRAVDMYQN-QRWLVFNGSA-N 1 1 311.425 3.916 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H]1C ZINC000824815417 1030647939 /nfs/dbraw/zinc/64/79/39/1030647939.db2.gz OLKQTNRAVDMYQN-FOIQADDNSA-N 1 1 311.425 3.916 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1C ZINC000824815418 1030648618 /nfs/dbraw/zinc/64/86/18/1030648618.db2.gz OLKQTNRAVDMYQN-MGPUTAFESA-N 1 1 311.425 3.916 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1Cl ZINC000824926812 1030674945 /nfs/dbraw/zinc/67/49/45/1030674945.db2.gz HKQBZJPCJVZJTC-LRDDRELGSA-N 1 1 319.836 3.634 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](Cc3ccncc3)C2)cc1Cl ZINC000825484273 1030840211 /nfs/dbraw/zinc/84/02/11/1030840211.db2.gz JNZPRMXVIJXLMZ-OAHLLOKOSA-N 1 1 316.832 3.814 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1c(O)cccc1F ZINC000926918971 1030991132 /nfs/dbraw/zinc/99/11/32/1030991132.db2.gz KPPHJTPELFKICE-NWDGAFQWSA-N 1 1 301.361 3.706 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCOC1)c1ccc(F)cc1O ZINC000927070455 1031069599 /nfs/dbraw/zinc/06/95/99/1031069599.db2.gz SDIXUFXESQFFOJ-OWQGQXMQSA-N 1 1 307.409 3.777 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)cc1 ZINC000123659600 1031229979 /nfs/dbraw/zinc/22/99/79/1031229979.db2.gz CJRXCVMHWZYILD-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CSC)C2)c1O ZINC000292882713 1031233581 /nfs/dbraw/zinc/23/35/81/1031233581.db2.gz XYGJNILOLCBGQV-NSHDSACASA-N 1 1 315.866 3.629 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccc(F)cc1O ZINC000844927370 1031404269 /nfs/dbraw/zinc/40/42/69/1031404269.db2.gz ZKJDLJLVOKJCFJ-CZUORRHYSA-N 1 1 314.404 3.999 20 10 DHCDMO C[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)[C@@H](C)C1 ZINC001144306479 1031453324 /nfs/dbraw/zinc/45/33/24/1031453324.db2.gz DARJJORCHWHBQL-ZJUUUORDSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@@H](C)C1 ZINC001144306479 1031453326 /nfs/dbraw/zinc/45/33/26/1031453326.db2.gz DARJJORCHWHBQL-ZJUUUORDSA-N 1 1 316.214 3.914 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872260039 1031563263 /nfs/dbraw/zinc/56/32/63/1031563263.db2.gz HBGJZKXPHXMYNK-KRWDZBQOSA-N 1 1 319.445 3.715 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1C ZINC000872261262 1031564403 /nfs/dbraw/zinc/56/44/03/1031564403.db2.gz BLTAMTGVNATUPS-GOSISDBHSA-N 1 1 303.446 3.933 20 10 DHCDMO Cc1nnsc1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000293751305 1031601331 /nfs/dbraw/zinc/60/13/31/1031601331.db2.gz RLDDVNIVHPEOCG-ZCFIWIBFSA-N 1 1 318.229 3.710 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cccnc1C(F)(F)F ZINC001144538300 1031685523 /nfs/dbraw/zinc/68/55/23/1031685523.db2.gz KTFRLPAPRWJUMO-UHFFFAOYSA-N 1 1 310.319 3.828 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nnc3ccccn32)cc1C ZINC000873009608 1031690173 /nfs/dbraw/zinc/69/01/73/1031690173.db2.gz PHQIBJDQFQBQEA-HNNXBMFYSA-N 1 1 324.428 3.677 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cn3ccsc3n2)cc1C ZINC000873024427 1031696117 /nfs/dbraw/zinc/69/61/17/1031696117.db2.gz QZNNOVMQWHMRJX-UHFFFAOYSA-N 1 1 315.442 3.783 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nccn2CC)cc1C ZINC000873130052 1031719801 /nfs/dbraw/zinc/71/98/01/1031719801.db2.gz WTBZHKPUXZMQHX-OAHLLOKOSA-N 1 1 301.434 3.851 20 10 DHCDMO C[C@@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)C[C@]1(F)Cl ZINC000846032071 1031820383 /nfs/dbraw/zinc/82/03/83/1031820383.db2.gz CQDKSWNNAPBOJC-CHWSQXEVSA-N 1 1 310.171 3.979 20 10 DHCDMO C[C@@]1(CC[NH2+]Cc2cc(Cl)c(F)cc2O)C[C@]1(F)Cl ZINC000846029272 1031821387 /nfs/dbraw/zinc/82/13/87/1031821387.db2.gz IJQODVQTIGZFTH-CHWSQXEVSA-N 1 1 310.171 3.979 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@](C)(O)c1ccccc1 ZINC000846043851 1031837416 /nfs/dbraw/zinc/83/74/16/1031837416.db2.gz LPYJRDLKKKOLFZ-GTNSWQLSSA-N 1 1 323.795 3.571 20 10 DHCDMO Cc1cc(C[N@@H+](C)CC2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000124647757 1031938390 /nfs/dbraw/zinc/93/83/90/1031938390.db2.gz XNTNGJZYZQVKIP-UHFFFAOYSA-N 1 1 305.462 3.857 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1Cc2ccc(OC)cc2C1 ZINC001168286849 1032047762 /nfs/dbraw/zinc/04/77/62/1032047762.db2.gz KTJZZPYPOWNVNA-FQEVSTJZSA-N 1 1 324.468 3.751 20 10 DHCDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877468856 1033311135 /nfs/dbraw/zinc/31/11/35/1033311135.db2.gz OEOJAPJEXLWOBD-ZACQAIPSSA-N 1 1 316.489 3.514 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(C)ccc2O)o1 ZINC000137065455 1033321377 /nfs/dbraw/zinc/32/13/77/1033321377.db2.gz NGYWSBVKXQACAL-MRXNPFEDSA-N 1 1 301.386 3.777 20 10 DHCDMO CCCC[N@@H+](Cc1ccc(Cl)nn1)Cc1ccccc1O ZINC000877503704 1033327860 /nfs/dbraw/zinc/32/78/60/1033327860.db2.gz UIYAZMZDIGNCLI-UHFFFAOYSA-N 1 1 305.809 3.638 20 10 DHCDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877508911 1033331266 /nfs/dbraw/zinc/33/12/66/1033331266.db2.gz FJZOKQHLMOCDNB-UZLBHIALSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](O)C[C@@H]1c1ccccc1 ZINC000877674333 1033406970 /nfs/dbraw/zinc/40/69/70/1033406970.db2.gz UBMLINZMECPMNT-LEWJYISDSA-N 1 1 324.468 3.759 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c1O ZINC000877811979 1033458823 /nfs/dbraw/zinc/45/88/23/1033458823.db2.gz DKDODSROOZDBEA-ZDUSSCGKSA-N 1 1 323.742 3.829 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cnc(C3CC3)o2)C2CC2)cc1 ZINC000862218458 1033782563 /nfs/dbraw/zinc/78/25/63/1033782563.db2.gz MCYJCJCFHWNUHD-UHFFFAOYSA-N 1 1 311.429 3.783 20 10 DHCDMO C[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CC1(C)C ZINC000862368866 1033830650 /nfs/dbraw/zinc/83/06/50/1033830650.db2.gz MXZMQGGQAGDFEP-LBPRGKRZSA-N 1 1 317.260 3.661 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCc3c(O)cccc3C2)cc1 ZINC000862530279 1033876324 /nfs/dbraw/zinc/87/63/24/1033876324.db2.gz YMEUJPURWQWDOS-SNAWJCMRSA-N 1 1 308.425 3.530 20 10 DHCDMO COc1cccc2c1C[N@H+](C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000862530203 1033876906 /nfs/dbraw/zinc/87/69/06/1033876906.db2.gz WSMADMOGBZOCBB-WAYWQWQTSA-N 1 1 308.425 3.790 20 10 DHCDMO COc1cccc2c1C[N@@H+](C/C=C\c1ccc(N(C)C)cc1)C2 ZINC000862530203 1033876923 /nfs/dbraw/zinc/87/69/23/1033876923.db2.gz WSMADMOGBZOCBB-WAYWQWQTSA-N 1 1 308.425 3.790 20 10 DHCDMO C/C=C/C[C@H]1CCC[N@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000862550476 1033886753 /nfs/dbraw/zinc/88/67/53/1033886753.db2.gz LVNMLDIQNDMNSQ-NNTXTVRGSA-N 1 1 305.418 3.588 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173863359 1033888195 /nfs/dbraw/zinc/88/81/95/1033888195.db2.gz NPRRBGNYYUFDAZ-ZDUSSCGKSA-N 1 1 315.417 3.982 20 10 DHCDMO Cc1cc(-c2nnc(C[NH2+][C@H](C)c3ccccc3O)o2)c(C)o1 ZINC000879650029 1034072029 /nfs/dbraw/zinc/07/20/29/1034072029.db2.gz YDOMAWSYQOYDJA-LLVKDONJSA-N 1 1 313.357 3.503 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000177280787 1034150018 /nfs/dbraw/zinc/15/00/18/1034150018.db2.gz NAEDIYGXLWOECV-LLVKDONJSA-N 1 1 317.360 3.633 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000177280787 1034150025 /nfs/dbraw/zinc/15/00/25/1034150025.db2.gz NAEDIYGXLWOECV-LLVKDONJSA-N 1 1 317.360 3.633 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)c1O ZINC000880000765 1034177769 /nfs/dbraw/zinc/17/77/69/1034177769.db2.gz KJZNCKRLQZOSKL-AWEZNQCLSA-N 1 1 319.298 3.508 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c1O ZINC000880000765 1034177778 /nfs/dbraw/zinc/17/77/78/1034177778.db2.gz KJZNCKRLQZOSKL-AWEZNQCLSA-N 1 1 319.298 3.508 20 10 DHCDMO Nc1ccc(N(c2ccc(N)cc2)c2ccc3[nH+]ccn3c2)cc1 ZINC001174280120 1034244505 /nfs/dbraw/zinc/24/45/05/1034244505.db2.gz QNXITCWSMVFCBD-UHFFFAOYSA-N 1 1 315.380 3.969 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)[C@H](C)c2ccncc2)c(O)c1 ZINC000183715105 1034413366 /nfs/dbraw/zinc/41/33/66/1034413366.db2.gz GCFRPEUEGKQYDK-CQSZACIVSA-N 1 1 300.402 3.769 20 10 DHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1OC ZINC000185009529 1034519370 /nfs/dbraw/zinc/51/93/70/1034519370.db2.gz OZMGPXIZOBTVSF-LBPRGKRZSA-N 1 1 319.376 3.789 20 10 DHCDMO C[C@@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccc(F)cc1O ZINC000185151864 1034532445 /nfs/dbraw/zinc/53/24/45/1034532445.db2.gz HQKCRKQFMFGOHP-GFCCVEGCSA-N 1 1 313.376 3.691 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1O ZINC000185232407 1034536545 /nfs/dbraw/zinc/53/65/45/1034536545.db2.gz ZAKLXSSSHMULOE-LLVKDONJSA-N 1 1 306.356 3.587 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185643504 1034562266 /nfs/dbraw/zinc/56/22/66/1034562266.db2.gz SEUCZYWTXMBBQH-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185643504 1034562274 /nfs/dbraw/zinc/56/22/74/1034562274.db2.gz SEUCZYWTXMBBQH-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)o1 ZINC000185676889 1034565073 /nfs/dbraw/zinc/56/50/73/1034565073.db2.gz IJGUFAPXRXAUFB-HNNXBMFYSA-N 1 1 305.349 3.608 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CC[C@H](O)C1)c1cc(Cl)c(Cl)cc1O ZINC000193348945 1034841893 /nfs/dbraw/zinc/84/18/93/1034841893.db2.gz OSGNWHIEIXSHPE-UTLUCORTSA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@@H]([NH2+]CC(C)(C)CCO)c1cc(Cl)c(Cl)cc1O ZINC000192916885 1034820410 /nfs/dbraw/zinc/82/04/10/1034820410.db2.gz QECZZKZKFDOTSK-SECBINFHSA-N 1 1 306.233 3.758 20 10 DHCDMO C[C@H]([NH2+]CCCCCCO)c1cc(Cl)c(Cl)cc1O ZINC000193070364 1034828598 /nfs/dbraw/zinc/82/85/98/1034828598.db2.gz ZXQHRBPOELAECB-JTQLQIEISA-N 1 1 306.233 3.902 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CC[C@H](O)C1)c1cc(Cl)c(Cl)cc1O ZINC000193348919 1034841605 /nfs/dbraw/zinc/84/16/05/1034841605.db2.gz OSGNWHIEIXSHPE-BBBLOLIVSA-N 1 1 304.217 3.511 20 10 DHCDMO C[N@@H+](CCNCc1ccc(N2CCCC2)cc1)C1CCCCC1 ZINC001177519381 1035375996 /nfs/dbraw/zinc/37/59/96/1035375996.db2.gz BJISVSGFCSOYPL-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO CN(CC[NH2+]Cc1ccc(N2CCCC2)cc1)C1CCCCC1 ZINC001177519381 1035376001 /nfs/dbraw/zinc/37/60/01/1035376001.db2.gz BJISVSGFCSOYPL-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC1Cc2ccccc2C1 ZINC001177858693 1035396227 /nfs/dbraw/zinc/39/62/27/1035396227.db2.gz CJIDNTPQFCPMSM-UHFFFAOYSA-N 1 1 305.780 3.689 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)c2ccccc21 ZINC001204239706 1035467817 /nfs/dbraw/zinc/46/78/17/1035467817.db2.gz DGVOZGHDLNNNNT-UHFFFAOYSA-N 1 1 310.441 3.707 20 10 DHCDMO CC(C)O[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204240291 1035468814 /nfs/dbraw/zinc/46/88/14/1035468814.db2.gz NOTMNTHLMDGMGI-KRWDZBQOSA-N 1 1 312.457 3.905 20 10 DHCDMO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(N(C)CC)cc1 ZINC001193211945 1035591412 /nfs/dbraw/zinc/59/14/12/1035591412.db2.gz ZRGDWMMKYUHUSV-UHFFFAOYSA-N 1 1 320.477 3.696 20 10 DHCDMO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(N(C)CC)cc1 ZINC001193211945 1035591424 /nfs/dbraw/zinc/59/14/24/1035591424.db2.gz ZRGDWMMKYUHUSV-UHFFFAOYSA-N 1 1 320.477 3.696 20 10 DHCDMO COc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247833 1035592714 /nfs/dbraw/zinc/59/27/14/1035592714.db2.gz AMLLGETVDJYYPA-AEFFLSMTSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC001193247833 1035592727 /nfs/dbraw/zinc/59/27/27/1035592727.db2.gz AMLLGETVDJYYPA-AEFFLSMTSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247833 1035592732 /nfs/dbraw/zinc/59/27/32/1035592732.db2.gz AMLLGETVDJYYPA-AEFFLSMTSA-N 1 1 316.489 3.746 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1O ZINC001180194366 1035627979 /nfs/dbraw/zinc/62/79/79/1035627979.db2.gz DDUSNKZEXYUHDB-UHFFFAOYSA-N 1 1 307.340 3.788 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1O ZINC001180194366 1035627987 /nfs/dbraw/zinc/62/79/87/1035627987.db2.gz DDUSNKZEXYUHDB-UHFFFAOYSA-N 1 1 307.340 3.788 20 10 DHCDMO CC[C@@H]1CO[C@@](C)(CCC(C)C)[N@@H+]1Cc1ccc(O)cc1O ZINC001204281098 1035768149 /nfs/dbraw/zinc/76/81/49/1035768149.db2.gz QMQGYMPZTVXJJK-QAPCUYQASA-N 1 1 307.434 3.861 20 10 DHCDMO CC[C@@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1ccc(O)cc1O ZINC001204281098 1035768164 /nfs/dbraw/zinc/76/81/64/1035768164.db2.gz QMQGYMPZTVXJJK-QAPCUYQASA-N 1 1 307.434 3.861 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180970701 1035800453 /nfs/dbraw/zinc/80/04/53/1035800453.db2.gz WBKRXVGVKNVVRO-GZMMTYOYSA-N 1 1 309.278 3.833 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001180970701 1035800466 /nfs/dbraw/zinc/80/04/66/1035800466.db2.gz WBKRXVGVKNVVRO-GZMMTYOYSA-N 1 1 309.278 3.833 20 10 DHCDMO CCC[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H](O)c1ccccc1 ZINC001181419305 1035905924 /nfs/dbraw/zinc/90/59/24/1035905924.db2.gz YVOBMYJTTBYGQK-WMZOPIPTSA-N 1 1 321.367 3.662 20 10 DHCDMO CCc1cccc(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1O ZINC001182161545 1036112129 /nfs/dbraw/zinc/11/21/29/1036112129.db2.gz QKBMBPVOWMFOOP-IBGZPJMESA-N 1 1 322.452 3.592 20 10 DHCDMO CCN1CCC[C@@H]1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774120863 1036178517 /nfs/dbraw/zinc/17/85/17/1036178517.db2.gz VXEOZKDJERRPGH-GHMZBOCLSA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774168244 1036211755 /nfs/dbraw/zinc/21/17/55/1036211755.db2.gz ZOKAZCUQMFGYHC-NXEZZACHSA-N 1 1 315.244 3.586 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1O ZINC000775650805 1036225461 /nfs/dbraw/zinc/22/54/61/1036225461.db2.gz GAEDFIZMOGWREB-UHFFFAOYSA-N 1 1 320.776 3.894 20 10 DHCDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775654538 1036249249 /nfs/dbraw/zinc/24/92/49/1036249249.db2.gz LJIIRWFYGAMPEU-OAHLLOKOSA-N 1 1 303.427 3.972 20 10 DHCDMO Cc1cccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)c1O ZINC000775658645 1036268998 /nfs/dbraw/zinc/26/89/98/1036268998.db2.gz QLEAKDFVUUJYGL-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)c1O ZINC000775658645 1036269014 /nfs/dbraw/zinc/26/90/14/1036269014.db2.gz QLEAKDFVUUJYGL-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](c3cccnc3)C2)ccc1N(C)C ZINC001195546835 1036280802 /nfs/dbraw/zinc/28/08/02/1036280802.db2.gz KCGWJMBRYBNKPQ-IBGZPJMESA-N 1 1 309.457 3.836 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@@H](O)C1(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774361000 1036297691 /nfs/dbraw/zinc/29/76/91/1036297691.db2.gz WJWNYCIHACPYBV-WCDAPOTHSA-N 1 1 304.217 3.509 20 10 DHCDMO C[C@@H]([NH2+]C1COC(C)(C)OC1)c1cc(Cl)c(Cl)cc1O ZINC000774349046 1036313636 /nfs/dbraw/zinc/31/36/36/1036313636.db2.gz SBBXWRPAKBZGRP-MRVPVSSYSA-N 1 1 320.216 3.501 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000774497380 1036359547 /nfs/dbraw/zinc/35/95/47/1036359547.db2.gz OFTLJKNLRNCVMS-LRDDRELGSA-N 1 1 318.436 3.544 20 10 DHCDMO Cc1cccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c1O ZINC000775678728 1036408885 /nfs/dbraw/zinc/40/88/85/1036408885.db2.gz JCMDBENDIZPCST-GOSISDBHSA-N 1 1 316.489 3.789 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775687562 1036453235 /nfs/dbraw/zinc/45/32/35/1036453235.db2.gz FIBWMNZCYBLDGZ-AWEZNQCLSA-N 1 1 315.816 3.966 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC001182960424 1036485712 /nfs/dbraw/zinc/48/57/12/1036485712.db2.gz RFHYELFRJPFSPS-KRWDZBQOSA-N 1 1 304.340 3.696 20 10 DHCDMO Cc1ccccc1CC1C[NH+](Cc2cc(F)cc(F)c2O)C1 ZINC001182989737 1036497124 /nfs/dbraw/zinc/49/71/24/1036497124.db2.gz KAGHNRQXRKSYGS-UHFFFAOYSA-N 1 1 303.352 3.653 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)CN(C)C)c1O ZINC001183065918 1036516407 /nfs/dbraw/zinc/51/64/07/1036516407.db2.gz ROOGWVNLMYNYPT-CRAIPNDOSA-N 1 1 304.478 3.507 20 10 DHCDMO CCc1cccc(C[N@H+]2CCCC[C@@H]2[C@H](C)CN(C)C)c1O ZINC001183065918 1036516427 /nfs/dbraw/zinc/51/64/27/1036516427.db2.gz ROOGWVNLMYNYPT-CRAIPNDOSA-N 1 1 304.478 3.507 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCCC[C@H]2[C@@H](C)CN(C)C)c1O ZINC001183065921 1036517197 /nfs/dbraw/zinc/51/71/97/1036517197.db2.gz ROOGWVNLMYNYPT-YJBOKZPZSA-N 1 1 304.478 3.507 20 10 DHCDMO CCc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](C)CN(C)C)c1O ZINC001183065921 1036517204 /nfs/dbraw/zinc/51/72/04/1036517204.db2.gz ROOGWVNLMYNYPT-YJBOKZPZSA-N 1 1 304.478 3.507 20 10 DHCDMO Cc1cc2c(CC[NH2+]Cc3cccc(F)c3O)c[nH]c2cc1F ZINC001183122674 1036520184 /nfs/dbraw/zinc/52/01/84/1036520184.db2.gz MFHFWTFZETWSCA-UHFFFAOYSA-N 1 1 316.351 3.792 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1O ZINC000775713735 1036525097 /nfs/dbraw/zinc/52/50/97/1036525097.db2.gz MBZLWCMWSHCZSV-QFBILLFUSA-N 1 1 311.425 3.971 20 10 DHCDMO Cc1cc(Cl)cc(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1O ZINC000775717277 1036536759 /nfs/dbraw/zinc/53/67/59/1036536759.db2.gz OCCQTGNNGCWCMP-SJORKVTESA-N 1 1 322.880 3.801 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@H](C3CC3)C2)c1O ZINC000775725676 1036561424 /nfs/dbraw/zinc/56/14/24/1036561424.db2.gz LHJBTVDYIFIMHQ-LBPRGKRZSA-N 1 1 310.235 3.695 20 10 DHCDMO CCc1cc(C[N@H+]2CCOCC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000774660854 1036648432 /nfs/dbraw/zinc/64/84/32/1036648432.db2.gz ROTREPRQZRHRFC-CQSZACIVSA-N 1 1 305.462 3.863 20 10 DHCDMO C[C@H]([NH2+]Cc1ncc(-c2cccs2)o1)c1ccccc1O ZINC001197003067 1036667139 /nfs/dbraw/zinc/66/71/39/1036667139.db2.gz FYIREJYKFRTDAF-NSHDSACASA-N 1 1 300.383 3.960 20 10 DHCDMO C[C@]1([NH2+]Cc2cc(Cl)c(F)cc2O)CCOc2ccccc21 ZINC001183957816 1036717111 /nfs/dbraw/zinc/71/71/11/1036717111.db2.gz DXILCJZGXUIAHS-KRWDZBQOSA-N 1 1 321.779 3.972 20 10 DHCDMO C[C@@]1([NH2+]Cc2cc(Cl)c(F)cc2O)CCOc2ccccc21 ZINC001183957818 1036717192 /nfs/dbraw/zinc/71/71/92/1036717192.db2.gz DXILCJZGXUIAHS-QGZVFWFLSA-N 1 1 321.779 3.972 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1Cl ZINC001184135338 1036748073 /nfs/dbraw/zinc/74/80/73/1036748073.db2.gz OFXOUEOWJUJXLW-UHFFFAOYSA-N 1 1 322.880 3.851 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@H]1c1ccccc1)OCO2 ZINC000762468865 1036775133 /nfs/dbraw/zinc/77/51/33/1036775133.db2.gz XRPGSZFYVGRUAH-INIZCTEOSA-N 1 1 311.381 3.848 20 10 DHCDMO Cn1c2ccccc2[nH+]c1NCc1ccc(N2CCCC2)cc1 ZINC000762523505 1036813119 /nfs/dbraw/zinc/81/31/19/1036813119.db2.gz MILOHYISSHBLHD-UHFFFAOYSA-N 1 1 306.413 3.786 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)c1cc(F)ccc1N(C)C ZINC001184417340 1036842024 /nfs/dbraw/zinc/84/20/24/1036842024.db2.gz BFJITIZFWJOHTB-SNVBAGLBSA-N 1 1 324.346 3.726 20 10 DHCDMO CC[C@@H](C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879603 1037153929 /nfs/dbraw/zinc/15/39/29/1037153929.db2.gz JGTMWLMJSBYCPW-NEPJUHHUSA-N 1 1 322.405 3.708 20 10 DHCDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879603 1037153934 /nfs/dbraw/zinc/15/39/34/1037153934.db2.gz JGTMWLMJSBYCPW-NEPJUHHUSA-N 1 1 322.405 3.708 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000774904877 1037196622 /nfs/dbraw/zinc/19/66/22/1037196622.db2.gz WVLWNEMOJRRSFL-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000774904877 1037196634 /nfs/dbraw/zinc/19/66/34/1037196634.db2.gz WVLWNEMOJRRSFL-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+](CC(C)C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774906883 1037199426 /nfs/dbraw/zinc/19/94/26/1037199426.db2.gz BISLILLBZOFNMP-UHFFFAOYSA-N 1 1 324.421 3.813 20 10 DHCDMO COc1c(O)c(C[N@@H+](CC(C)C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774906883 1037199432 /nfs/dbraw/zinc/19/94/32/1037199432.db2.gz BISLILLBZOFNMP-UHFFFAOYSA-N 1 1 324.421 3.813 20 10 DHCDMO CCC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCO1 ZINC000152475286 1037240770 /nfs/dbraw/zinc/24/07/70/1037240770.db2.gz RJPZIJNXCFXRTJ-MRXNPFEDSA-N 1 1 315.413 3.555 20 10 DHCDMO C[C@@H]1CCCC[C@@H]1OCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199275761 1037242069 /nfs/dbraw/zinc/24/20/69/1037242069.db2.gz MDLVDVIQOSLKNC-ABAIWWIYSA-N 1 1 315.816 3.870 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCOC1 ZINC000776001803 1037294361 /nfs/dbraw/zinc/29/43/61/1037294361.db2.gz BOJIDLZYHNUEFP-IRXDYDNUSA-N 1 1 311.425 3.992 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776015664 1037308085 /nfs/dbraw/zinc/30/80/85/1037308085.db2.gz XBHMRFYVJSAFRX-CMPLNLGQSA-N 1 1 303.324 3.564 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c(O)c1 ZINC000776011837 1037308654 /nfs/dbraw/zinc/30/86/54/1037308654.db2.gz BQKUTLYUACEXBR-FZMZJTMJSA-N 1 1 317.351 3.954 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000776015640 1037310518 /nfs/dbraw/zinc/31/05/18/1037310518.db2.gz WCKRZJFGNVTTQT-DGCLKSJQSA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1cc2c(cc1O)C[N@H+](Cc1sccc1Cl)CCC2 ZINC001205347173 1037331231 /nfs/dbraw/zinc/33/12/31/1037331231.db2.gz IKVGWIITHMKUPU-UHFFFAOYSA-N 1 1 309.818 3.761 20 10 DHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1sccc1Cl)CCC2 ZINC001205347173 1037331252 /nfs/dbraw/zinc/33/12/52/1037331252.db2.gz IKVGWIITHMKUPU-UHFFFAOYSA-N 1 1 309.818 3.761 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCC[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775014920 1037398241 /nfs/dbraw/zinc/39/82/41/1037398241.db2.gz XHWUCAFRTNLEMN-JSGCOSHPSA-N 1 1 322.405 3.613 20 10 DHCDMO COc1c(O)c(C[N@H+](C)[C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000775207354 1038008077 /nfs/dbraw/zinc/00/80/77/1038008077.db2.gz UYNDBJSBTKGIES-LBPRGKRZSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)[C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000775207354 1038008091 /nfs/dbraw/zinc/00/80/91/1038008091.db2.gz UYNDBJSBTKGIES-LBPRGKRZSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1ccccc1OCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000164192164 1038103695 /nfs/dbraw/zinc/10/36/95/1038103695.db2.gz SUNLZRGIKXHFJL-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](C/C=C/c3ccccc3)CC2)cc1 ZINC000917089672 1038187224 /nfs/dbraw/zinc/18/72/24/1038187224.db2.gz CSHXDVJSIFQIHR-WEVVVXLNSA-N 1 1 322.452 3.921 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(F)cc1F ZINC000170779208 1038959723 /nfs/dbraw/zinc/95/97/23/1038959723.db2.gz LYXHURNAOOBCTL-GOSISDBHSA-N 1 1 321.367 3.616 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccc(F)cc1O ZINC000170789456 1038965852 /nfs/dbraw/zinc/96/58/52/1038965852.db2.gz LMKJLRWJZBWQHU-QWHCGFSZSA-N 1 1 303.377 3.909 20 10 DHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000761226918 1040819380 /nfs/dbraw/zinc/81/93/80/1040819380.db2.gz XCJITTXNZOBBTM-HXUWFJFHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000091891423 193123616 /nfs/dbraw/zinc/12/36/16/193123616.db2.gz UOMRTWQXMMFPHH-RDJZCZTQSA-N 1 1 317.454 3.850 20 10 DHCDMO CCCOc1ccc(C[N@@H+](CC)Cc2ccccn2)c(O)c1 ZINC000093338869 193235243 /nfs/dbraw/zinc/23/52/43/193235243.db2.gz UMCJGFDOGDLWGH-UHFFFAOYSA-N 1 1 300.402 3.598 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc4c(c3)COC(C)(C)O4)ccc21 ZINC000274438778 130234979 /nfs/dbraw/zinc/23/49/79/130234979.db2.gz PNLNIVFSCZTUIC-UHFFFAOYSA-N 1 1 323.396 3.831 20 10 DHCDMO Cn1nccc1C1=CC[N@@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC000285201622 131147167 /nfs/dbraw/zinc/14/71/67/131147167.db2.gz WKTDCSGZBKCSPQ-UHFFFAOYSA-N 1 1 319.408 3.568 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1O ZINC000285541661 131179615 /nfs/dbraw/zinc/17/96/15/131179615.db2.gz CECXZJPFTROHQS-OAHLLOKOSA-N 1 1 304.321 3.680 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1O ZINC000286100618 131219720 /nfs/dbraw/zinc/21/97/20/131219720.db2.gz NGJZTQXPNPOTBZ-CQSZACIVSA-N 1 1 304.321 3.680 20 10 DHCDMO CC[C@H]([NH2+][C@H](CCOC)c1ccco1)c1ccc(F)cc1O ZINC000286302524 131228926 /nfs/dbraw/zinc/22/89/26/131228926.db2.gz XBKJXJPLSDPZFP-LSDHHAIUSA-N 1 1 307.365 3.943 20 10 DHCDMO CC(C)c1noc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000298735438 132075260 /nfs/dbraw/zinc/07/52/60/132075260.db2.gz UZEPURAUQKYMFA-UHFFFAOYSA-N 1 1 316.449 3.670 20 10 DHCDMO CC(C)c1noc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000298735438 132075262 /nfs/dbraw/zinc/07/52/62/132075262.db2.gz UZEPURAUQKYMFA-UHFFFAOYSA-N 1 1 316.449 3.670 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cn1 ZINC000185397842 333208113 /nfs/dbraw/zinc/20/81/13/333208113.db2.gz RIECYQSAHCNULB-GFCCVEGCSA-N 1 1 304.365 3.566 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1O ZINC000294986472 335129569 /nfs/dbraw/zinc/12/95/69/335129569.db2.gz KFFGXSSTJZIFCK-DGCLKSJQSA-N 1 1 317.351 3.954 20 10 DHCDMO C[C@@H](CCO)CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000297269540 335152373 /nfs/dbraw/zinc/15/23/73/335152373.db2.gz KQPFMRVRQYEKIF-NXEZZACHSA-N 1 1 306.233 3.758 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000271362391 334021318 /nfs/dbraw/zinc/02/13/18/334021318.db2.gz NPNMQTASPHGNMK-HOCLYGCPSA-N 1 1 303.427 3.542 20 10 DHCDMO C[C@H](CC[S@](C)=O)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278799738 334101479 /nfs/dbraw/zinc/10/14/79/334101479.db2.gz RBPLPGYBBUURGW-MGOSUKFUSA-N 1 1 324.273 3.507 20 10 DHCDMO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2c(F)cncc2F)c1O ZINC000289524039 334166054 /nfs/dbraw/zinc/16/60/54/334166054.db2.gz HFZVMMJSJFYPHT-VIFPVBQESA-N 1 1 312.747 3.878 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000292803921 334192622 /nfs/dbraw/zinc/19/26/22/334192622.db2.gz NWZZQDIRNIOAQX-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1 ZINC000292803918 334192678 /nfs/dbraw/zinc/19/26/78/334192678.db2.gz NWZZQDIRNIOAQX-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1COc2cccc(F)c21)c1ccc(F)cc1O ZINC000367620532 336826789 /nfs/dbraw/zinc/82/67/89/336826789.db2.gz YFCUKPDANWSEQX-KGLIPLIRSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CCC12CCOCC2 ZINC000375240875 337006354 /nfs/dbraw/zinc/00/63/54/337006354.db2.gz YLBAYRJYZMSTKQ-OAHLLOKOSA-N 1 1 311.425 3.936 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[C@@H](CO)c2ccccc21)c1ccc(F)cc1O ZINC000375897966 337022559 /nfs/dbraw/zinc/02/25/59/337022559.db2.gz NAEXNXCYDWZKKW-UYHISHBKSA-N 1 1 315.388 3.793 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H]2CCCc3cccnc32)c1 ZINC000377243124 337049271 /nfs/dbraw/zinc/04/92/71/337049271.db2.gz ILGPOUZXFGPIPO-KRWDZBQOSA-N 1 1 312.413 3.695 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000377839307 337062405 /nfs/dbraw/zinc/06/24/05/337062405.db2.gz IBQFGJZGQNMGAB-OAHLLOKOSA-N 1 1 311.381 3.717 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC(Nc2ccccc2F)CC1 ZINC000378491202 337074249 /nfs/dbraw/zinc/07/42/49/337074249.db2.gz FXEPSPZDBCCSQU-UHFFFAOYSA-N 1 1 318.367 3.747 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1nnc(C)[nH]1)c1ccccc1)c1ccccc1O ZINC000185210214 337203420 /nfs/dbraw/zinc/20/34/20/337203420.db2.gz DGHHCYUEFXBOBO-WMZOPIPTSA-N 1 1 322.412 3.649 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccc(F)cc1O ZINC000248526589 337564328 /nfs/dbraw/zinc/56/43/28/337564328.db2.gz VAVJYOITHPVARW-ASTDHERZSA-N 1 1 305.393 3.530 20 10 DHCDMO COc1ccc([C@H]([NH2+][C@H](C)c2ccc(F)cc2O)C2CC2)cn1 ZINC000528045456 337785913 /nfs/dbraw/zinc/78/59/13/337785913.db2.gz ZCWJJZYUHYOHPR-ADLMAVQZSA-N 1 1 316.376 3.737 20 10 DHCDMO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000170789532 520214555 /nfs/dbraw/zinc/21/45/55/520214555.db2.gz ARVGUAKTRUFTGO-CYBMUJFWSA-N 1 1 303.377 3.919 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000179951147 521337525 /nfs/dbraw/zinc/33/75/25/521337525.db2.gz KPYUYFDOUAJBJW-LBPRGKRZSA-N 1 1 303.324 3.565 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127478297 526340958 /nfs/dbraw/zinc/34/09/58/526340958.db2.gz WYLKWZUBPGNXDQ-AWEZNQCLSA-N 1 1 321.218 3.820 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(F)cc1O ZINC000286327553 535804362 /nfs/dbraw/zinc/80/43/62/535804362.db2.gz YGIVMCRBQFFDJF-MEBBXXQBSA-N 1 1 306.381 3.981 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(F)cc1O ZINC000286335620 535805500 /nfs/dbraw/zinc/80/55/00/535805500.db2.gz YPMDGJNCCKMMSW-MRXNPFEDSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[C@@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(C)cc1O ZINC000287748058 535809570 /nfs/dbraw/zinc/80/95/70/535809570.db2.gz ZEOSTKBREYOUPC-MRXNPFEDSA-N 1 1 300.402 3.848 20 10 DHCDMO COCCc1cc[nH+]c(N[C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000287457405 536832288 /nfs/dbraw/zinc/83/22/88/536832288.db2.gz LRHHVCYMRYWWMJ-CQSZACIVSA-N 1 1 300.402 3.766 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCOC(F)(F)F)C2CC2)cc1 ZINC001167107908 1013147694 /nfs/dbraw/zinc/14/76/94/1013147694.db2.gz KNUQWKZXRVBZCH-UHFFFAOYSA-N 1 1 316.367 3.644 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000729463645 1013440150 /nfs/dbraw/zinc/44/01/50/1013440150.db2.gz NZTDVPQJNRSPDZ-UHFFFAOYSA-N 1 1 322.408 3.624 20 10 DHCDMO CCc1cnc(C[N@H+](C)Cc2cc3c(cc2O)CCCC3)s1 ZINC000160348975 1013964550 /nfs/dbraw/zinc/96/45/50/1013964550.db2.gz WPJXIGPJJPQULN-UHFFFAOYSA-N 1 1 316.470 3.922 20 10 DHCDMO CCc1cnc(C[N@@H+](C)Cc2cc3c(cc2O)CCCC3)s1 ZINC000160348975 1013964553 /nfs/dbraw/zinc/96/45/53/1013964553.db2.gz WPJXIGPJJPQULN-UHFFFAOYSA-N 1 1 316.470 3.922 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c[nH]nc2c1 ZINC000156838264 1014589583 /nfs/dbraw/zinc/58/95/83/1014589583.db2.gz KBYZBFPSIPGZHB-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000896226130 1015510194 /nfs/dbraw/zinc/51/01/94/1015510194.db2.gz BFBLAVFMOJTROY-ZDUSSCGKSA-N 1 1 303.299 3.567 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000896639608 1015693370 /nfs/dbraw/zinc/69/33/70/1015693370.db2.gz XCSGCYRYUYUPSP-UKRRQHHQSA-N 1 1 300.377 3.742 20 10 DHCDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1ccc(F)c(F)c1[O-] ZINC000896661870 1015701150 /nfs/dbraw/zinc/70/11/50/1015701150.db2.gz YVCZLOJEUSRFOL-UHFFFAOYSA-N 1 1 306.356 3.724 20 10 DHCDMO C[C@H]1CCC[N@@H+]1C1CCN(Cc2c(O)ccc3ccccc32)CC1 ZINC000151633528 1016085565 /nfs/dbraw/zinc/08/55/65/1016085565.db2.gz APMWWKBVWJQILU-INIZCTEOSA-N 1 1 324.468 3.994 20 10 DHCDMO C[C@H]1CCC[N@H+]1C1CCN(Cc2c(O)ccc3ccccc32)CC1 ZINC000151633528 1016085570 /nfs/dbraw/zinc/08/55/70/1016085570.db2.gz APMWWKBVWJQILU-INIZCTEOSA-N 1 1 324.468 3.994 20 10 DHCDMO C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000185034256 1016524691 /nfs/dbraw/zinc/52/46/91/1016524691.db2.gz FNUKFEGWKZASNT-GJZGRUSLSA-N 1 1 308.441 3.694 20 10 DHCDMO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000185227903 1016770239 /nfs/dbraw/zinc/77/02/39/1016770239.db2.gz LAJGYRSYKBLWLK-XJKSGUPXSA-N 1 1 320.408 3.858 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccc(F)cc1O ZINC000185405000 1016895401 /nfs/dbraw/zinc/89/54/01/1016895401.db2.gz MXTWEEYFQQJJJQ-OLZOCXBDSA-N 1 1 301.361 3.748 20 10 DHCDMO Brc1cscc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000796282704 1032207893 /nfs/dbraw/zinc/20/78/93/1032207893.db2.gz HNCGGLAGNCFDQY-UHFFFAOYSA-N 1 1 324.243 3.735 20 10 DHCDMO CC(C)[N@@H+]1CCCC[C@H]1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773086076 1032554812 /nfs/dbraw/zinc/55/48/12/1032554812.db2.gz YCKALHCPDXYLRK-LPHOPBHVSA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773086076 1032554828 /nfs/dbraw/zinc/55/48/28/1032554828.db2.gz YCKALHCPDXYLRK-LPHOPBHVSA-N 1 1 303.494 3.666 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@@H]1CCc3c(F)cc(F)cc3C1)CC2 ZINC001171388999 1032566593 /nfs/dbraw/zinc/56/65/93/1032566593.db2.gz RXCSTDHFVIXRAY-OAHLLOKOSA-N 1 1 315.363 3.586 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@H]1CCc3c(F)cc(F)cc3C1)CC2 ZINC001171388997 1032567182 /nfs/dbraw/zinc/56/71/82/1032567182.db2.gz RXCSTDHFVIXRAY-HNNXBMFYSA-N 1 1 315.363 3.586 20 10 DHCDMO Cc1cc2c[nH+]c(NCc3cc4ccccc4cc3O)nc2[nH]1 ZINC001171399884 1032582152 /nfs/dbraw/zinc/58/21/52/1032582152.db2.gz OXHRDIFISPXNMJ-UHFFFAOYSA-N 1 1 304.353 3.689 20 10 DHCDMO CCOC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000160196530 1011993214 /nfs/dbraw/zinc/99/32/14/1011993214.db2.gz FZASETXSKSRDAU-OAHLLOKOSA-N 1 1 303.446 3.520 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)cc1OC ZINC000160202232 1012018342 /nfs/dbraw/zinc/01/83/42/1012018342.db2.gz MHMAILGNFQVOGL-IBGZPJMESA-N 1 1 317.429 3.732 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926904937 1032662684 /nfs/dbraw/zinc/66/26/84/1032662684.db2.gz KDZQUOWTIUDLKY-OUJBWJOFSA-N 1 1 321.314 3.682 20 10 DHCDMO CC1CCN(c2ccc(C[NH2+][C@@H]3CCCc4c[nH]nc43)cc2)CC1 ZINC000857854074 1032689930 /nfs/dbraw/zinc/68/99/30/1032689930.db2.gz IPCREHNVGWLDIJ-LJQANCHMSA-N 1 1 324.472 3.813 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2nc(C(C)C)ncc2C1 ZINC000857877671 1032700994 /nfs/dbraw/zinc/70/09/94/1032700994.db2.gz OALCBMCVYDTMSO-UHFFFAOYSA-N 1 1 324.472 3.533 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCc2nc(C(C)C)ncc2C1 ZINC000857877671 1032701011 /nfs/dbraw/zinc/70/10/11/1032701011.db2.gz OALCBMCVYDTMSO-UHFFFAOYSA-N 1 1 324.472 3.533 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000840941612 1017522231 /nfs/dbraw/zinc/52/22/31/1017522231.db2.gz DJPIJDJQXWBBMN-CYBMUJFWSA-N 1 1 300.368 3.835 20 10 DHCDMO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(N2CCCCC2)cc1 ZINC000764433572 1018280934 /nfs/dbraw/zinc/28/09/34/1018280934.db2.gz SNDRJJFWOKYHFY-QGZVFWFLSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@@H](NCC(C)(C)C[NH+](C)C)c1ccc(N2CCCCC2)cc1 ZINC000764433572 1018280949 /nfs/dbraw/zinc/28/09/49/1018280949.db2.gz SNDRJJFWOKYHFY-QGZVFWFLSA-N 1 1 317.521 3.915 20 10 DHCDMO CC[NH+](CC)CCN[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764541458 1018310998 /nfs/dbraw/zinc/31/09/98/1018310998.db2.gz MNQIXNDOYLHYHQ-KRWDZBQOSA-N 1 1 303.494 3.669 20 10 DHCDMO CCN(CC)c1ccc(CN[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1F ZINC000858133383 1032778158 /nfs/dbraw/zinc/77/81/58/1032778158.db2.gz UQDAQQALKHIIAC-INIZCTEOSA-N 1 1 321.484 3.634 20 10 DHCDMO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1ccccc1O ZINC000171937074 1018845260 /nfs/dbraw/zinc/84/52/60/1018845260.db2.gz VSBTWYAIPMXGQZ-UHFFFAOYSA-N 1 1 313.397 3.626 20 10 DHCDMO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1ccccc1O ZINC000171937074 1018845282 /nfs/dbraw/zinc/84/52/82/1018845282.db2.gz VSBTWYAIPMXGQZ-UHFFFAOYSA-N 1 1 313.397 3.626 20 10 DHCDMO c1csc(SC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC000278577561 1018864034 /nfs/dbraw/zinc/86/40/34/1018864034.db2.gz OLLSUQMVIRKZHF-HNNXBMFYSA-N 1 1 320.483 3.526 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCc3ccc(O)cc32)cc1F ZINC000858193502 1032799043 /nfs/dbraw/zinc/79/90/43/1032799043.db2.gz WSEHMJZBFJOWJV-QGZVFWFLSA-N 1 1 318.367 3.514 20 10 DHCDMO Cc1cc(C[NH2+]Cc2nc(C)c(C)[nH]2)c(C)n1-c1ccccc1 ZINC000858295332 1032836461 /nfs/dbraw/zinc/83/64/61/1032836461.db2.gz ZLYXTGIRKKEOKN-UHFFFAOYSA-N 1 1 308.429 3.724 20 10 DHCDMO C[C@H]1CCCN(c2ccc(C[NH2+]Cc3cc[nH]n3)cc2Cl)C1 ZINC000282165898 1019538228 /nfs/dbraw/zinc/53/82/28/1019538228.db2.gz YCTBLPYSJTUFQE-ZDUSSCGKSA-N 1 1 318.852 3.589 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2cc(C)cc(C)c2)cc1 ZINC001171729092 1032847526 /nfs/dbraw/zinc/84/75/26/1032847526.db2.gz GZDKIQWDBPTDIU-UHFFFAOYSA-N 1 1 312.457 3.880 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)cc1C ZINC000727432100 1019713300 /nfs/dbraw/zinc/71/33/00/1019713300.db2.gz ZWGJIADZDHOLNW-JXFKEZNVSA-N 1 1 311.425 3.971 20 10 DHCDMO CC(C)c1noc(C[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000731846110 1020158067 /nfs/dbraw/zinc/15/80/67/1020158067.db2.gz RYTFCOVXYWFCDI-UHFFFAOYSA-N 1 1 315.417 3.843 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NCC[N@H+](C)C2CCCC2)cc1 ZINC000765802052 1020253664 /nfs/dbraw/zinc/25/36/64/1020253664.db2.gz RRFDWHMMHHJDHI-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NCC[N@@H+](C)C2CCCC2)cc1 ZINC000765802052 1020253670 /nfs/dbraw/zinc/25/36/70/1020253670.db2.gz RRFDWHMMHHJDHI-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO COc1ccc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000310077283 1020316277 /nfs/dbraw/zinc/31/62/77/1020316277.db2.gz GZOIOGRGQIPGAD-HXUWFJFHSA-N 1 1 324.468 3.615 20 10 DHCDMO COc1ccc(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC000310077283 1020316289 /nfs/dbraw/zinc/31/62/89/1020316289.db2.gz GZOIOGRGQIPGAD-HXUWFJFHSA-N 1 1 324.468 3.615 20 10 DHCDMO COc1ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310077283 1020316301 /nfs/dbraw/zinc/31/63/01/1020316301.db2.gz GZOIOGRGQIPGAD-HXUWFJFHSA-N 1 1 324.468 3.615 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310343174 1020365650 /nfs/dbraw/zinc/36/56/50/1020365650.db2.gz DOXPGVGMLIKNDB-HKUYNNGSSA-N 1 1 324.468 3.955 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310343174 1020365658 /nfs/dbraw/zinc/36/56/58/1020365658.db2.gz DOXPGVGMLIKNDB-HKUYNNGSSA-N 1 1 324.468 3.955 20 10 DHCDMO CC(C)(C)OC(=O)CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613325 1020418666 /nfs/dbraw/zinc/41/86/66/1020418666.db2.gz MVLXSDOCCRZJGX-UHFFFAOYSA-N 1 1 319.445 3.869 20 10 DHCDMO CN(C)c1ccc(CNc2cc[nH+]c3ccc(Cl)cc23)cc1 ZINC000734141244 1020566668 /nfs/dbraw/zinc/56/66/68/1020566668.db2.gz FWJSROMOIVOAOA-UHFFFAOYSA-N 1 1 311.816 3.988 20 10 DHCDMO CC[C@@H]1COCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000738082446 1020859565 /nfs/dbraw/zinc/85/95/65/1020859565.db2.gz ABUXXITZQSHARS-CYBMUJFWSA-N 1 1 315.413 3.628 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@@H](C)CO1 ZINC000917428771 1021266063 /nfs/dbraw/zinc/26/60/63/1021266063.db2.gz XKNSMJPPPRAJBV-STQMWFEESA-N 1 1 315.413 3.626 20 10 DHCDMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000917454805 1021270947 /nfs/dbraw/zinc/27/09/47/1021270947.db2.gz MUXHSDPYVAPCMX-AWEZNQCLSA-N 1 1 313.397 3.922 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H](CO)C2)cc1 ZINC000154582497 1021407042 /nfs/dbraw/zinc/40/70/42/1021407042.db2.gz OHKUOOBENCUSEF-SFHVURJKSA-N 1 1 304.478 3.517 20 10 DHCDMO Oc1ccc2c(c1)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)CC2 ZINC000850386991 1021502322 /nfs/dbraw/zinc/50/23/22/1021502322.db2.gz OCOLIHZUXKESOD-CQSZACIVSA-N 1 1 307.752 3.667 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1(CO)CC1 ZINC000850516538 1021573387 /nfs/dbraw/zinc/57/33/87/1021573387.db2.gz WYHMJPQTLFGPBB-DTWKUNHWSA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1O ZINC000850523699 1021577418 /nfs/dbraw/zinc/57/74/18/1021577418.db2.gz NWKSDKBUTWQPHQ-GHMZBOCLSA-N 1 1 315.335 3.773 20 10 DHCDMO CCCN1CC[C@@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850557158 1021604327 /nfs/dbraw/zinc/60/43/27/1021604327.db2.gz UURPKTDMPDLDLL-NWDGAFQWSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]CCC1SCCS1)c1cc(F)cc(F)c1O ZINC000850571058 1021615049 /nfs/dbraw/zinc/61/50/49/1021615049.db2.gz PZWXQYQSUREWQX-MRVPVSSYSA-N 1 1 305.415 3.517 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](O)[C@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000850573407 1021616008 /nfs/dbraw/zinc/61/60/08/1021616008.db2.gz LOWKPNNLQUMWQH-XVGQJIODSA-N 1 1 317.404 3.737 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](O)[C@@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000850573405 1021617224 /nfs/dbraw/zinc/61/72/24/1021617224.db2.gz LOWKPNNLQUMWQH-IXDGSTSKSA-N 1 1 317.404 3.737 20 10 DHCDMO CC(C)OCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000728688776 1021617520 /nfs/dbraw/zinc/61/75/20/1021617520.db2.gz VTWBWTGSCHZCNZ-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000850581817 1021621773 /nfs/dbraw/zinc/62/17/73/1021621773.db2.gz GVPZOVUWSUHYNG-CYBMUJFWSA-N 1 1 322.880 3.818 20 10 DHCDMO C[N@@H+](CCc1ccc(F)cc1)Cc1c(O)ccc2ccncc21 ZINC000919948493 1021983512 /nfs/dbraw/zinc/98/35/12/1021983512.db2.gz MFJULRNCAVZIPL-UHFFFAOYSA-N 1 1 310.372 3.754 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1CCCCO1 ZINC000070975727 1021994900 /nfs/dbraw/zinc/99/49/00/1021994900.db2.gz KAXMRJYRLQCRHG-MRXNPFEDSA-N 1 1 301.386 3.557 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]nc2-c2ccccc2)cc1 ZINC000155181798 1022042331 /nfs/dbraw/zinc/04/23/31/1022042331.db2.gz ZPEXTWGBODLBNF-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092692 1022218721 /nfs/dbraw/zinc/21/87/21/1022218721.db2.gz IXBBBJSOTVFYOT-HNNXBMFYSA-N 1 1 322.880 3.566 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H]2CCC[N@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092692 1022218733 /nfs/dbraw/zinc/21/87/33/1022218733.db2.gz IXBBBJSOTVFYOT-HNNXBMFYSA-N 1 1 322.880 3.566 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092692 1022218745 /nfs/dbraw/zinc/21/87/45/1022218745.db2.gz IXBBBJSOTVFYOT-HNNXBMFYSA-N 1 1 322.880 3.566 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240648 1022242882 /nfs/dbraw/zinc/24/28/82/1022242882.db2.gz QDXZMNFFNPOUGO-HIFRSBDPSA-N 1 1 322.880 3.818 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240648 1022242886 /nfs/dbraw/zinc/24/28/86/1022242886.db2.gz QDXZMNFFNPOUGO-HIFRSBDPSA-N 1 1 322.880 3.818 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC000853594414 1022297408 /nfs/dbraw/zinc/29/74/08/1022297408.db2.gz QLYPXAJYFSJKPO-QGZVFWFLSA-N 1 1 320.392 3.594 20 10 DHCDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000756454685 1022392869 /nfs/dbraw/zinc/39/28/69/1022392869.db2.gz NJLFJRKXWDXBFF-BARDWOONSA-N 1 1 308.441 3.548 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000179623370 1022483616 /nfs/dbraw/zinc/48/36/16/1022483616.db2.gz KGOJBOTZKOESGJ-GFCCVEGCSA-N 1 1 303.324 3.565 20 10 DHCDMO COc1cc(C)c(C[N@@H+](C)Cc2cccc(C)c2O)cc1OC ZINC000179605337 1022485689 /nfs/dbraw/zinc/48/56/89/1022485689.db2.gz YFDDGDYBNBAIPK-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000179688727 1022508604 /nfs/dbraw/zinc/50/86/04/1022508604.db2.gz DTECSZZQQFKMME-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000179884433 1022574563 /nfs/dbraw/zinc/57/45/63/1022574563.db2.gz LEBWWXJRHRPJCH-SFHVURJKSA-N 1 1 316.489 3.645 20 10 DHCDMO CN(CC[C@H]1CCC[N@@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357903 1022695686 /nfs/dbraw/zinc/69/56/86/1022695686.db2.gz BXKQLHOJTSCFRV-LJQANCHMSA-N 1 1 315.505 3.593 20 10 DHCDMO CN(CC[C@H]1CCC[N@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357903 1022695691 /nfs/dbraw/zinc/69/56/91/1022695691.db2.gz BXKQLHOJTSCFRV-LJQANCHMSA-N 1 1 315.505 3.593 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000689882366 1022703575 /nfs/dbraw/zinc/70/35/75/1022703575.db2.gz OIVGIHIWLXCXTM-NSHDSACASA-N 1 1 316.214 3.726 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000689882366 1022703587 /nfs/dbraw/zinc/70/35/87/1022703587.db2.gz OIVGIHIWLXCXTM-NSHDSACASA-N 1 1 316.214 3.726 20 10 DHCDMO Cc1ccc(O)c(C[NH2+]C[C@]2(C)CCN(Cc3ccccc3)C2)c1 ZINC000310064376 1022747227 /nfs/dbraw/zinc/74/72/27/1022747227.db2.gz AVIFGOQPUXUFRU-NRFANRHFSA-N 1 1 324.468 3.702 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 ZINC000768139210 1022903414 /nfs/dbraw/zinc/90/34/14/1022903414.db2.gz XQLFRRXJXXPLSL-UHFFFAOYSA-N 1 1 320.452 3.817 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@H]1CC=CCC1 ZINC000768162064 1022906836 /nfs/dbraw/zinc/90/68/36/1022906836.db2.gz KGVAPDDWDAUUQL-WMZOPIPTSA-N 1 1 301.430 3.730 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnn(C(C)C)c2)cc1 ZINC000768207309 1022915184 /nfs/dbraw/zinc/91/51/84/1022915184.db2.gz BRTSGIDJQKEWBJ-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1cc(Cl)ccc1O ZINC000768196366 1022925912 /nfs/dbraw/zinc/92/59/12/1022925912.db2.gz BUJVVFRVPZASBY-UHFFFAOYSA-N 1 1 311.834 3.756 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C2CC2)C2CCCCC2)cc1OC ZINC000768439925 1022965464 /nfs/dbraw/zinc/96/54/64/1022965464.db2.gz QBXLLLWWEUSNTL-UHFFFAOYSA-N 1 1 305.418 3.707 20 10 DHCDMO COc1cc(C[N@@H+](C)CCOc2cccc(C)c2)c(O)cc1C ZINC000768445606 1022967040 /nfs/dbraw/zinc/96/70/40/1022967040.db2.gz ROXJFFSLGDTGTG-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)C[C@H](C)c2ccccc2)cc1OC ZINC000768452042 1022967757 /nfs/dbraw/zinc/96/77/57/1022967757.db2.gz NOHBLXXVDOMIGT-AWEZNQCLSA-N 1 1 315.413 3.645 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCCC3)on1 ZINC000768439336 1022968366 /nfs/dbraw/zinc/96/83/66/1022968366.db2.gz KJXKIODIDXZJCB-KRWDZBQOSA-N 1 1 312.413 3.905 20 10 DHCDMO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000768464369 1022974558 /nfs/dbraw/zinc/97/45/58/1022974558.db2.gz QCLAAQPBRLTMJI-UHFFFAOYSA-N 1 1 318.848 3.895 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1c(O)cccc1OC ZINC000768470903 1022976680 /nfs/dbraw/zinc/97/66/80/1022976680.db2.gz MLLZBHINRWLWII-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cccc(OC)c1O ZINC000768467867 1022976955 /nfs/dbraw/zinc/97/69/55/1022976955.db2.gz LHJGHOKYHVBDMM-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO C[C@@H](C1CC1)[N@@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000768532869 1022984383 /nfs/dbraw/zinc/98/43/83/1022984383.db2.gz PNBOAMUTNPTZGR-JTQLQIEISA-N 1 1 310.235 3.918 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H](COC)C2)cc1 ZINC000768539672 1022986728 /nfs/dbraw/zinc/98/67/28/1022986728.db2.gz ARZKIBCHNJAZKI-GOSISDBHSA-N 1 1 304.478 3.781 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000768765308 1023014345 /nfs/dbraw/zinc/01/43/45/1023014345.db2.gz CZDCUUCMLPHDCN-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000768765308 1023014360 /nfs/dbraw/zinc/01/43/60/1023014360.db2.gz CZDCUUCMLPHDCN-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876572471 1033094820 /nfs/dbraw/zinc/09/48/20/1033094820.db2.gz DUIKUAITTULBCV-QFBILLFUSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000768919067 1023055633 /nfs/dbraw/zinc/05/56/33/1023055633.db2.gz PDGQMODEWOICJI-SFHVURJKSA-N 1 1 321.424 3.924 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCOc3ccccc3[C@H]2C)c(O)c1 ZINC000768932008 1023059247 /nfs/dbraw/zinc/05/92/47/1023059247.db2.gz YQQFSRFZBXPYTA-CQSZACIVSA-N 1 1 313.397 3.747 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C)CC(C)(C)C)c1O ZINC000768937236 1023060153 /nfs/dbraw/zinc/06/01/53/1023060153.db2.gz MCYZCMWJJNHPPB-UHFFFAOYSA-N 1 1 316.239 3.641 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000278833731 1023078408 /nfs/dbraw/zinc/07/84/08/1023078408.db2.gz JBKLQKOBXQWFPJ-AWEZNQCLSA-N 1 1 316.357 3.550 20 10 DHCDMO COCC[N@@H+](CCCc1ccccc1)Cc1cc(C)ccc1O ZINC000769145132 1023088661 /nfs/dbraw/zinc/08/86/61/1023088661.db2.gz CJANZUVTAOLYHW-UHFFFAOYSA-N 1 1 313.441 3.782 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000769192468 1023090283 /nfs/dbraw/zinc/09/02/83/1023090283.db2.gz LDIUHYJOQKPAAS-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO Cc1cc(O)c(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1C ZINC000769329523 1023125616 /nfs/dbraw/zinc/12/56/16/1023125616.db2.gz SYFWRAFGXBCRBC-UHFFFAOYSA-N 1 1 321.424 3.935 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1C ZINC000769329523 1023125621 /nfs/dbraw/zinc/12/56/21/1023125621.db2.gz SYFWRAFGXBCRBC-UHFFFAOYSA-N 1 1 321.424 3.935 20 10 DHCDMO CC(C)(C)C[N@@H+](CCO)Cc1cc(-c2ccccc2)ccc1O ZINC000769338624 1023129094 /nfs/dbraw/zinc/12/90/94/1023129094.db2.gz RRKVFLFTESFWKB-UHFFFAOYSA-N 1 1 313.441 3.900 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000769380361 1023136345 /nfs/dbraw/zinc/13/63/45/1023136345.db2.gz UYSMWIKAABNTHT-AWEZNQCLSA-N 1 1 315.388 3.920 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000769380362 1023136563 /nfs/dbraw/zinc/13/65/63/1023136563.db2.gz UYSMWIKAABNTHT-CQSZACIVSA-N 1 1 315.388 3.920 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(OCC)cc2O)CC1 ZINC000769384284 1023137416 /nfs/dbraw/zinc/13/74/16/1023137416.db2.gz NETDYFNEWBWBRW-INIZCTEOSA-N 1 1 307.434 3.572 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000769469731 1023161326 /nfs/dbraw/zinc/16/13/26/1023161326.db2.gz DMSSHEGBQUAJHI-OTWHNJEPSA-N 1 1 316.489 3.778 20 10 DHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000769499463 1023167234 /nfs/dbraw/zinc/16/72/34/1023167234.db2.gz WCZGISHTWAISBU-FQEVSTJZSA-N 1 1 312.457 3.526 20 10 DHCDMO CCOc1ccc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)c(O)c1 ZINC000769527443 1023174419 /nfs/dbraw/zinc/17/44/19/1023174419.db2.gz HNLCHMVLKFMBGY-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCc3c(F)ccc(F)c3C2)c(O)c1 ZINC000769527443 1023174422 /nfs/dbraw/zinc/17/44/22/1023174422.db2.gz HNLCHMVLKFMBGY-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)c(O)c1 ZINC000769537191 1023175646 /nfs/dbraw/zinc/17/56/46/1023175646.db2.gz IOKVIPNBQJFAMO-SFHVURJKSA-N 1 1 314.429 3.857 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@H](C)C(C)C ZINC000876644049 1033112367 /nfs/dbraw/zinc/11/23/67/1033112367.db2.gz UXTSMHASGCRFGQ-MRXNPFEDSA-N 1 1 304.478 3.514 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCO[C@@H]2CCCCO2)cc1 ZINC000769695483 1023195339 /nfs/dbraw/zinc/19/53/39/1023195339.db2.gz GHJUTUCSQCSUBR-LJQANCHMSA-N 1 1 320.477 3.508 20 10 DHCDMO CC(C)[N@@H+](CCO[C@@H]1CCCCO1)Cc1ccc(N(C)C)cc1 ZINC000769712274 1023198728 /nfs/dbraw/zinc/19/87/28/1023198728.db2.gz ZNKJKFGMNMQVBN-LJQANCHMSA-N 1 1 320.477 3.506 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2C[C@@H](OCC)C23CCC3)c1 ZINC000770353844 1023303779 /nfs/dbraw/zinc/30/37/79/1023303779.db2.gz VIQRLSVGCPIBJS-QZTJIDSGSA-N 1 1 319.445 3.570 20 10 DHCDMO CCOc1ccc(C[N@H+](C)[C@@H]2C[C@@H](OCC)C23CCC3)c(O)c1 ZINC000770352454 1023305031 /nfs/dbraw/zinc/30/50/31/1023305031.db2.gz NWRKERXYBLFSIP-QZTJIDSGSA-N 1 1 319.445 3.570 20 10 DHCDMO Cn1c(-c2ccccc2)cnc1SCC[C@H]1CCC[N@H+]1C ZINC000770463381 1023314552 /nfs/dbraw/zinc/31/45/52/1023314552.db2.gz SEQRIZKHABZJJZ-OAHLLOKOSA-N 1 1 301.459 3.664 20 10 DHCDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3ccccc3O)C2)cc1 ZINC000770511035 1023315999 /nfs/dbraw/zinc/31/59/99/1023315999.db2.gz WBAXNYAFLRAFNU-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1ccc(Cl)cc1 ZINC000772199233 1023532037 /nfs/dbraw/zinc/53/20/37/1023532037.db2.gz MVHAIQUASZYYNK-SFHVURJKSA-N 1 1 319.832 3.991 20 10 DHCDMO COc1ncccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000785662341 1023606837 /nfs/dbraw/zinc/60/68/37/1023606837.db2.gz WYRNXDHMIBTTJZ-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO CC(C)CCC[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001170061604 1023714218 /nfs/dbraw/zinc/71/42/18/1023714218.db2.gz WMHLDUWNJZUAIY-SFHVURJKSA-N 1 1 317.521 3.743 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(F)cc1C ZINC000746667149 1023781146 /nfs/dbraw/zinc/78/11/46/1023781146.db2.gz VYLFOESSODUTEQ-LJQANCHMSA-N 1 1 317.404 3.785 20 10 DHCDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccccc1O ZINC000787332773 1023784492 /nfs/dbraw/zinc/78/44/92/1023784492.db2.gz ORIKMIVFXHGVQJ-INIZCTEOSA-N 1 1 305.805 3.865 20 10 DHCDMO C[C@@H]([NH2+]CCCC(C)(C)CO)c1cccc(C(F)(F)F)c1O ZINC000788605271 1023912683 /nfs/dbraw/zinc/91/26/83/1023912683.db2.gz WMLBEWJIMKZWRA-LLVKDONJSA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@@H]([NH2+]CCN1CCC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788612439 1023914296 /nfs/dbraw/zinc/91/42/96/1023914296.db2.gz MGHRXHMVLNFFEW-VXGBXAGGSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1cnn(C)c1 ZINC000278858269 1023968934 /nfs/dbraw/zinc/96/89/34/1023968934.db2.gz WEQGJDITEOVYHY-IUCAKERBSA-N 1 1 314.216 3.844 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)c1cnn(C)c1 ZINC000278858271 1023970476 /nfs/dbraw/zinc/97/04/76/1023970476.db2.gz WEQGJDITEOVYHY-RKDXNWHRSA-N 1 1 314.216 3.844 20 10 DHCDMO C[N@@H+](CCC1CCOCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000129623292 1024029781 /nfs/dbraw/zinc/02/97/81/1024029781.db2.gz HEAJLJLFOCSCCQ-UHFFFAOYSA-N 1 1 316.489 3.925 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nc(C(C)C)c[nH]2)cc1 ZINC000882902689 1024164028 /nfs/dbraw/zinc/16/40/28/1024164028.db2.gz LUDFBGMSDPLQHO-UHFFFAOYSA-N 1 1 300.450 3.669 20 10 DHCDMO CCn1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)cn1 ZINC000278864825 1024177397 /nfs/dbraw/zinc/17/73/97/1024177397.db2.gz WOCHZPTXSQMORQ-SECBINFHSA-N 1 1 314.216 3.766 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000882937208 1024178873 /nfs/dbraw/zinc/17/88/73/1024178873.db2.gz KXQLLKPMXMVOCO-IRXDYDNUSA-N 1 1 319.351 3.680 20 10 DHCDMO Cc1csc([C@@H]([NH2+]Cc2cc(F)cc(F)c2O)C2CC2)n1 ZINC000883018613 1024213024 /nfs/dbraw/zinc/21/30/24/1024213024.db2.gz JNLABMZAOOCPEK-ZDUSSCGKSA-N 1 1 310.369 3.676 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1[N+](=O)[O-] ZINC000883029602 1024215049 /nfs/dbraw/zinc/21/50/49/1024215049.db2.gz ZURWIANDGHPWNS-SNVBAGLBSA-N 1 1 322.311 3.738 20 10 DHCDMO CCCCCn1cc(C[NH2+]Cc2cc(F)cc(F)c2O)c(C)n1 ZINC000883079768 1024231795 /nfs/dbraw/zinc/23/17/95/1024231795.db2.gz DDQJNGYUDVMBFM-UHFFFAOYSA-N 1 1 323.387 3.655 20 10 DHCDMO CSCc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000883118800 1024249035 /nfs/dbraw/zinc/24/90/35/1024249035.db2.gz GLENQWHTAAIIOU-UHFFFAOYSA-N 1 1 309.381 3.823 20 10 DHCDMO CC(C)[C@@H](O)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883180038 1024271862 /nfs/dbraw/zinc/27/18/62/1024271862.db2.gz QVZHZUVROAPACA-IAGOWNOFSA-N 1 1 321.367 3.518 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccns1)c1cccc(C(F)(F)F)c1O ZINC000883247306 1024317138 /nfs/dbraw/zinc/31/71/38/1024317138.db2.gz GCDGJEDMGZWSOM-SECBINFHSA-N 1 1 316.348 3.761 20 10 DHCDMO CC(C)=CC[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000790698667 1024357671 /nfs/dbraw/zinc/35/76/71/1024357671.db2.gz QVFWLBPLWVNSDT-VIFPVBQESA-N 1 1 302.187 3.911 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)c(Cl)n1 ZINC000883301907 1024358552 /nfs/dbraw/zinc/35/85/52/1024358552.db2.gz LNOXQXMLWCPJKX-VIFPVBQESA-N 1 1 312.747 3.878 20 10 DHCDMO COc1cccc(CC[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790948649 1024401633 /nfs/dbraw/zinc/40/16/33/1024401633.db2.gz GUMJCPYAZJPRCG-UHFFFAOYSA-N 1 1 309.768 3.526 20 10 DHCDMO C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)N1CCCC[C@@H]1C ZINC000790948850 1024402813 /nfs/dbraw/zinc/40/28/13/1024402813.db2.gz ISLXJMGWCUOIHU-NWDGAFQWSA-N 1 1 314.832 3.537 20 10 DHCDMO CN(C)c1cccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790959466 1024405096 /nfs/dbraw/zinc/40/50/96/1024405096.db2.gz FUEBPFBKJGFFOE-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000790977702 1024422195 /nfs/dbraw/zinc/42/21/95/1024422195.db2.gz PCDIXVAUVFAYHA-PBFPGSCMSA-N 1 1 317.791 3.860 20 10 DHCDMO COCC[N@@H+](Cc1cccc(OC)c1O)[C@H](C)c1ccccc1 ZINC000271080757 1024453997 /nfs/dbraw/zinc/45/39/97/1024453997.db2.gz VRXIKBMTEZPZNM-OAHLLOKOSA-N 1 1 315.413 3.610 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(N(C)C)cc1 ZINC000271599147 1024547055 /nfs/dbraw/zinc/54/70/55/1024547055.db2.gz ZKZBJDZLZCVTCV-XJKSGUPXSA-N 1 1 315.465 3.796 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000792164749 1024638918 /nfs/dbraw/zinc/63/89/18/1024638918.db2.gz DKOYUDMZKNYUGR-INIZCTEOSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000792164749 1024638925 /nfs/dbraw/zinc/63/89/25/1024638925.db2.gz DKOYUDMZKNYUGR-INIZCTEOSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000792164749 1024638930 /nfs/dbraw/zinc/63/89/30/1024638930.db2.gz DKOYUDMZKNYUGR-INIZCTEOSA-N 1 1 313.800 3.577 20 10 DHCDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792166638 1024640513 /nfs/dbraw/zinc/64/05/13/1024640513.db2.gz FDFPGOPBFZBDDL-LBPRGKRZSA-N 1 1 323.795 3.568 20 10 DHCDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792166638 1024640516 /nfs/dbraw/zinc/64/05/16/1024640516.db2.gz FDFPGOPBFZBDDL-LBPRGKRZSA-N 1 1 323.795 3.568 20 10 DHCDMO CN(C)c1cccc(C[N@H+](C)Cc2c(O)ccc(Cl)c2F)c1 ZINC000792169947 1024641414 /nfs/dbraw/zinc/64/14/14/1024641414.db2.gz NSSFYTLKRPVDAY-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2c(O)ccc(Cl)c2F)c1 ZINC000792169947 1024641418 /nfs/dbraw/zinc/64/14/18/1024641418.db2.gz NSSFYTLKRPVDAY-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CCn1ccc(C[N@@H+](C)Cc2cccc(Br)c2[O-])c1 ZINC000792183557 1024643727 /nfs/dbraw/zinc/64/37/27/1024643727.db2.gz PSEXUJJUEKHQJF-UHFFFAOYSA-N 1 1 323.234 3.608 20 10 DHCDMO CCn1ccc(C[N@H+](C)Cc2cccc(Br)c2O)c1 ZINC000792183557 1024643736 /nfs/dbraw/zinc/64/37/36/1024643736.db2.gz PSEXUJJUEKHQJF-UHFFFAOYSA-N 1 1 323.234 3.608 20 10 DHCDMO CCn1ccc(C[N@@H+](C)Cc2cccc(Br)c2O)c1 ZINC000792183557 1024643743 /nfs/dbraw/zinc/64/37/43/1024643743.db2.gz PSEXUJJUEKHQJF-UHFFFAOYSA-N 1 1 323.234 3.608 20 10 DHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3cc(C)ccc3O)CCO2)cc1 ZINC000792191388 1024646729 /nfs/dbraw/zinc/64/67/29/1024646729.db2.gz ZNAYRFFCXCAOFF-FQEVSTJZSA-N 1 1 311.425 3.837 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CCF)C2)c1O ZINC000689885868 1024696976 /nfs/dbraw/zinc/69/69/76/1024696976.db2.gz LHWGULRSGVPNGH-LLVKDONJSA-N 1 1 301.789 3.626 20 10 DHCDMO C[C@H]1COCCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000772821549 1024792585 /nfs/dbraw/zinc/79/25/85/1024792585.db2.gz BAYIMJTYTUAIFI-ZDUSSCGKSA-N 1 1 311.381 3.902 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1 ZINC000792900120 1024825527 /nfs/dbraw/zinc/82/55/27/1024825527.db2.gz DSIIBWCTLDCKAB-CABCVRRESA-N 1 1 313.272 3.768 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000793230320 1024945806 /nfs/dbraw/zinc/94/58/06/1024945806.db2.gz FWRFTDCKBHHVJN-GXFFZTMASA-N 1 1 303.324 3.564 20 10 DHCDMO c1cc(N2CCOCC2)ccc1C[N@@H+](CC1CC1)CC1CCC1 ZINC000793390906 1025031527 /nfs/dbraw/zinc/03/15/27/1025031527.db2.gz USOQXHJWPINLIH-UHFFFAOYSA-N 1 1 314.473 3.535 20 10 DHCDMO Oc1ccc(Br)cc1C[N@@H+](CC1CC1)C1CCC1 ZINC000793395820 1025033992 /nfs/dbraw/zinc/03/39/92/1025033992.db2.gz UDXYWLCIHBJWEK-UHFFFAOYSA-N 1 1 310.235 3.919 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)cc1 ZINC000793610304 1025130034 /nfs/dbraw/zinc/13/00/34/1025130034.db2.gz STRFTKNFONXLLW-OALUTQOASA-N 1 1 302.462 3.676 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](CC1=NOCC1)Cc1ccccc1O ZINC001168244938 1025386068 /nfs/dbraw/zinc/38/60/68/1025386068.db2.gz VKYAHPDXWFDQFI-OAHLLOKOSA-N 1 1 310.397 3.732 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1c(O)cccc1F ZINC000886496659 1025652647 /nfs/dbraw/zinc/65/26/47/1025652647.db2.gz BYFYFVZMDIFWAE-RISCZKNCSA-N 1 1 308.422 3.546 20 10 DHCDMO Cc1cccc2oc(CC[NH2+][C@H](C)c3c(O)cccc3F)nc21 ZINC000886534706 1025684567 /nfs/dbraw/zinc/68/45/67/1025684567.db2.gz MYKMUJZCLYOMBR-GFCCVEGCSA-N 1 1 314.360 3.874 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1c(O)cccc1F ZINC000886577970 1025715392 /nfs/dbraw/zinc/71/53/92/1025715392.db2.gz DUUURXVRILKYRV-IYVPYFHTSA-N 1 1 305.393 3.530 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1c(O)cccc1F ZINC000886577971 1025716148 /nfs/dbraw/zinc/71/61/48/1025716148.db2.gz DUUURXVRILKYRV-JQHQGBHXSA-N 1 1 305.393 3.530 20 10 DHCDMO CC(C)n1ncc2c1C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)CC2 ZINC000886598520 1025730155 /nfs/dbraw/zinc/73/01/55/1025730155.db2.gz CKVKCNIQKVFJEU-OCCSQVGLSA-N 1 1 317.408 3.517 20 10 DHCDMO CC[C@H](COCC(F)(F)F)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886615631 1025740783 /nfs/dbraw/zinc/74/07/83/1025740783.db2.gz KLMSOXUDPJZIGY-NXEZZACHSA-N 1 1 309.303 3.539 20 10 DHCDMO COc1cc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)cc1OC ZINC000245855498 1025744600 /nfs/dbraw/zinc/74/46/00/1025744600.db2.gz NKECJRYOZVQJFS-UMVBOHGHSA-N 1 1 305.418 3.562 20 10 DHCDMO COc1cccc([C@H](C[NH2+][C@H](C)c2c(O)cccc2F)OC)c1 ZINC000886641659 1025753264 /nfs/dbraw/zinc/75/32/64/1025753264.db2.gz OTTIDDYWEMAZHZ-PXAZEXFGSA-N 1 1 319.376 3.578 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2c(O)cccc2F)nc1 ZINC000886641131 1025753720 /nfs/dbraw/zinc/75/37/20/1025753720.db2.gz AHCXMARXIDGBCE-CYBMUJFWSA-N 1 1 302.393 3.863 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1c(O)cccc1F ZINC000886644927 1025758428 /nfs/dbraw/zinc/75/84/28/1025758428.db2.gz OHOPSYYJCQRWBH-DWQUBVKVSA-N 1 1 301.361 3.712 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)on1 ZINC000729682796 1025941211 /nfs/dbraw/zinc/94/12/11/1025941211.db2.gz MHAORXJIEOXGBN-UHFFFAOYSA-N 1 1 309.413 3.989 20 10 DHCDMO C[C@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@@H+]1C ZINC000093644408 1026121472 /nfs/dbraw/zinc/12/14/72/1026121472.db2.gz VIZPDUHPMOWJOV-GWCFXTLKSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@H+]1C ZINC000093644408 1026121479 /nfs/dbraw/zinc/12/14/79/1026121479.db2.gz VIZPDUHPMOWJOV-GWCFXTLKSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644408 1026121484 /nfs/dbraw/zinc/12/14/84/1026121484.db2.gz VIZPDUHPMOWJOV-GWCFXTLKSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644408 1026121491 /nfs/dbraw/zinc/12/14/91/1026121491.db2.gz VIZPDUHPMOWJOV-GWCFXTLKSA-N 1 1 317.260 3.614 20 10 DHCDMO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@@H]1CCOC(C)(C)C1 ZINC000289669649 1026121788 /nfs/dbraw/zinc/12/17/88/1026121788.db2.gz FVKPTJIGQYMERW-OAHLLOKOSA-N 1 1 323.408 3.513 20 10 DHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@@H]1CCOC(C)(C)C1 ZINC000289669649 1026121795 /nfs/dbraw/zinc/12/17/95/1026121795.db2.gz FVKPTJIGQYMERW-OAHLLOKOSA-N 1 1 323.408 3.513 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c(O)c1 ZINC000289914947 1026230142 /nfs/dbraw/zinc/23/01/42/1026230142.db2.gz VGDPVULMWOTHLK-GOSISDBHSA-N 1 1 312.413 3.913 20 10 DHCDMO CC(C)n1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)nn1 ZINC000809574439 1026553311 /nfs/dbraw/zinc/55/33/11/1026553311.db2.gz MHAGDLZGKSTHGE-UHFFFAOYSA-N 1 1 314.433 3.509 20 10 DHCDMO CC[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(C)cc1O ZINC000280034731 1026574813 /nfs/dbraw/zinc/57/48/13/1026574813.db2.gz IJGIGDSOVGARTH-GOSISDBHSA-N 1 1 302.462 3.616 20 10 DHCDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc(N(C)C)c(F)c1 ZINC000809734494 1026597703 /nfs/dbraw/zinc/59/77/03/1026597703.db2.gz HQANONKRONCKFK-UHFFFAOYSA-N 1 1 315.436 3.741 20 10 DHCDMO Cc1ccc(CN(CC[NH+](C)C)Cc2cccc(Cl)c2O)o1 ZINC000809735756 1026609543 /nfs/dbraw/zinc/60/95/43/1026609543.db2.gz RJNZUOPROQIQLE-UHFFFAOYSA-N 1 1 322.836 3.511 20 10 DHCDMO C[NH+](C)CCN(Cc1cccs1)Cc1cccc(Cl)c1O ZINC000809745579 1026613113 /nfs/dbraw/zinc/61/31/13/1026613113.db2.gz CLVOWYRQTNHXBO-UHFFFAOYSA-N 1 1 324.877 3.671 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@H](C)c1cccnc1 ZINC000809765319 1026620035 /nfs/dbraw/zinc/62/00/35/1026620035.db2.gz MQIYIUUUNVYKIR-CQSZACIVSA-N 1 1 301.409 3.870 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000809971605 1026647168 /nfs/dbraw/zinc/64/71/68/1026647168.db2.gz IFRUVHFAPUDWOP-LLVKDONJSA-N 1 1 304.390 3.537 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3cc(O)cc(C(F)(F)F)c3)ccc21 ZINC000810149941 1026695694 /nfs/dbraw/zinc/69/56/94/1026695694.db2.gz HQVIZCKWQVRRQM-UHFFFAOYSA-N 1 1 321.302 3.910 20 10 DHCDMO CCC[N@H+](CC)C[C@H](C)N[C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810263067 1026722167 /nfs/dbraw/zinc/72/21/67/1026722167.db2.gz KSCKOWYKBGVYQH-IPYPFGDCSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@H](C)N[C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810263067 1026722179 /nfs/dbraw/zinc/72/21/79/1026722179.db2.gz KSCKOWYKBGVYQH-IPYPFGDCSA-N 1 1 308.441 3.790 20 10 DHCDMO COc1cc(Cl)cc(CNc2cc(C3CC3)cc[nH+]2)c1O ZINC000811518462 1027018700 /nfs/dbraw/zinc/01/87/00/1027018700.db2.gz LGQFHXZPLORQNS-UHFFFAOYSA-N 1 1 304.777 3.939 20 10 DHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(F)ccc1O)C2 ZINC000811518837 1027019967 /nfs/dbraw/zinc/01/99/67/1027019967.db2.gz PWRVHPSYOTVIRE-UHFFFAOYSA-N 1 1 313.372 3.587 20 10 DHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000811520256 1027020236 /nfs/dbraw/zinc/02/02/36/1027020236.db2.gz MNFPSKMDCVAKPM-OAHLLOKOSA-N 1 1 308.441 3.673 20 10 DHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(C)ccc1O)C2 ZINC000811519676 1027020610 /nfs/dbraw/zinc/02/06/10/1027020610.db2.gz ZXDCZOKIZDWPOY-UHFFFAOYSA-N 1 1 309.409 3.757 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)[C@H]1[C@H]1CCCO1 ZINC000811510690 1027026640 /nfs/dbraw/zinc/02/66/40/1027026640.db2.gz MZJJXZZXTYKHIM-MOPGFXCFSA-N 1 1 311.425 3.935 20 10 DHCDMO Cc1cnn([C@@H]2CC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)c1 ZINC000811799117 1027085218 /nfs/dbraw/zinc/08/52/18/1027085218.db2.gz QVKXRFCOPPUUBY-QGZVFWFLSA-N 1 1 313.445 3.776 20 10 DHCDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000295195787 1027140786 /nfs/dbraw/zinc/14/07/86/1027140786.db2.gz XXRQWDQBKCXVNU-IBGZPJMESA-N 1 1 302.462 3.535 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000780789748 1027192400 /nfs/dbraw/zinc/19/24/00/1027192400.db2.gz OVCVFWCWYPXPKL-CQSZACIVSA-N 1 1 317.816 3.947 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C)[C@H](C)C3)cc2)CC1 ZINC000828576520 1027203749 /nfs/dbraw/zinc/20/37/49/1027203749.db2.gz NCEYNBUMTVJLIQ-IAGOWNOFSA-N 1 1 316.489 3.780 20 10 DHCDMO CC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)[C@H]1CCOC1 ZINC000812297304 1027247276 /nfs/dbraw/zinc/24/72/76/1027247276.db2.gz ZGPUECZIQHVBSX-AWEZNQCLSA-N 1 1 311.381 3.902 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1Cc1cccc(F)c1O ZINC000809757813 1027438686 /nfs/dbraw/zinc/43/86/86/1027438686.db2.gz SUPSEIUQMQWDCP-MRXNPFEDSA-N 1 1 317.408 3.989 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1cccc(F)c1O ZINC000809757813 1027438692 /nfs/dbraw/zinc/43/86/92/1027438692.db2.gz SUPSEIUQMQWDCP-MRXNPFEDSA-N 1 1 317.408 3.989 20 10 DHCDMO Cc1ccc(N2CCC[N@@H+](Cc3cc(F)ccc3O)CC2)cc1 ZINC000778985456 1027718502 /nfs/dbraw/zinc/71/85/02/1027718502.db2.gz USSONRYOTDVQPH-UHFFFAOYSA-N 1 1 314.404 3.552 20 10 DHCDMO C[C@H]1C[C@H](C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCO1 ZINC000778995681 1027732924 /nfs/dbraw/zinc/73/29/24/1027732924.db2.gz FRSJEOZTMHZCNS-DOTOQJQBSA-N 1 1 302.462 3.532 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@H](c2ccc(C)o2)C1 ZINC000364621025 1027857025 /nfs/dbraw/zinc/85/70/25/1027857025.db2.gz GIDXNIKYJMJJQV-QAPCUYQASA-N 1 1 301.386 3.818 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)c1 ZINC000814177525 1027913554 /nfs/dbraw/zinc/91/35/54/1027913554.db2.gz FUHQKAHEQNOEKB-AWEZNQCLSA-N 1 1 313.397 3.574 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1O ZINC000814230448 1027964580 /nfs/dbraw/zinc/96/45/80/1027964580.db2.gz QSDKLKFIYVOWFK-SFHVURJKSA-N 1 1 312.413 3.687 20 10 DHCDMO Cc1cc(N(C)C)ccc1CNc1[nH+]c2ccc(F)cc2n1C ZINC000814256626 1027970487 /nfs/dbraw/zinc/97/04/87/1027970487.db2.gz KDVNKWUPDPJNGB-UHFFFAOYSA-N 1 1 312.392 3.699 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc(F)cc1O ZINC000528000665 1028023958 /nfs/dbraw/zinc/02/39/58/1028023958.db2.gz KLGUUWDOGLADAT-DOTOQJQBSA-N 1 1 306.425 3.589 20 10 DHCDMO CC(C)[N@@H+](CCC1CCOCC1)Cc1ccc(N(C)C)cc1 ZINC000814619952 1028125242 /nfs/dbraw/zinc/12/52/42/1028125242.db2.gz WPPKOCXEOACCRA-UHFFFAOYSA-N 1 1 304.478 3.780 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2C2CCCC2)cc1OC ZINC000159915071 1028315336 /nfs/dbraw/zinc/31/53/36/1028315336.db2.gz AODBFQJHIJDEJX-OAHLLOKOSA-N 1 1 305.418 3.564 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)cc1 ZINC000815117454 1028366500 /nfs/dbraw/zinc/36/65/00/1028366500.db2.gz NITSSIQXFSECEP-LPHOPBHVSA-N 1 1 304.478 3.658 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccnn2C)ccc1N(C)C ZINC000815106996 1028379606 /nfs/dbraw/zinc/37/96/06/1028379606.db2.gz ISHOELSGHHVOAG-IBGZPJMESA-N 1 1 312.461 3.522 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)ccc1N(C)C ZINC000815108802 1028384564 /nfs/dbraw/zinc/38/45/64/1028384564.db2.gz ODSZWXMTTRXXQS-OCCSQVGLSA-N 1 1 300.368 3.834 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000369878254 1028540871 /nfs/dbraw/zinc/54/08/71/1028540871.db2.gz OWVHLWKADCBOTI-MJGOQNOKSA-N 1 1 315.388 3.576 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)cn1 ZINC000815560786 1028544035 /nfs/dbraw/zinc/54/40/35/1028544035.db2.gz QDCWGHUUXXMLGL-NSHDSACASA-N 1 1 310.319 3.965 20 10 DHCDMO CCC[C@](C)(O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815579685 1028551840 /nfs/dbraw/zinc/55/18/40/1028551840.db2.gz SHOQTFANWFTKDS-HZMBPMFUSA-N 1 1 305.340 3.613 20 10 DHCDMO CCN(CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815573855 1028566160 /nfs/dbraw/zinc/56/61/60/1028566160.db2.gz WBENPSGVXWRJIH-LLVKDONJSA-N 1 1 316.367 3.546 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CCC(C)(C)C2CC2)c1 ZINC000815657256 1028584420 /nfs/dbraw/zinc/58/44/20/1028584420.db2.gz UETMWJDZBFDUHQ-GFCCVEGCSA-N 1 1 305.418 3.656 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1 ZINC000815643145 1028589650 /nfs/dbraw/zinc/58/96/50/1028589650.db2.gz VEPMOTHMEMFLPQ-LMWSTFAQSA-N 1 1 305.418 3.654 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)ccc2ccccc21 ZINC000816493371 1028898001 /nfs/dbraw/zinc/89/80/01/1028898001.db2.gz YNUAPHCXDYCGPY-OAHLLOKOSA-N 1 1 307.397 3.648 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)ccc2ccccc21 ZINC000816494031 1028898853 /nfs/dbraw/zinc/89/88/53/1028898853.db2.gz WHUNXKXVILYCGX-MRXNPFEDSA-N 1 1 307.397 3.648 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H]2CN2CCCCC2)ccc2ccccc21 ZINC000816494482 1028900235 /nfs/dbraw/zinc/90/02/35/1028900235.db2.gz NFIFDHBPFFAOBZ-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(CN2CCC[C@@H]2C[NH+]2CCCCC2)ccc2ccccc21 ZINC000816494482 1028900249 /nfs/dbraw/zinc/90/02/49/1028900249.db2.gz NFIFDHBPFFAOBZ-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816508311 1028915491 /nfs/dbraw/zinc/91/54/91/1028915491.db2.gz IRRBPKGPTOMBLH-NSHDSACASA-N 1 1 323.795 3.953 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816508311 1028915503 /nfs/dbraw/zinc/91/55/03/1028915503.db2.gz IRRBPKGPTOMBLH-NSHDSACASA-N 1 1 323.795 3.953 20 10 DHCDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H]1O ZINC000816560437 1028946186 /nfs/dbraw/zinc/94/61/86/1028946186.db2.gz OYDZUZWKHIPSQV-ROUUACIJSA-N 1 1 313.441 3.774 20 10 DHCDMO CC(C)c1nccn1[C@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC000373144214 1028960536 /nfs/dbraw/zinc/96/05/36/1028960536.db2.gz ZDYNCFMHEGKPGQ-HNNXBMFYSA-N 1 1 317.408 3.688 20 10 DHCDMO CC(C)c1nccn1[C@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000373144214 1028960541 /nfs/dbraw/zinc/96/05/41/1028960541.db2.gz ZDYNCFMHEGKPGQ-HNNXBMFYSA-N 1 1 317.408 3.688 20 10 DHCDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816662386 1028981085 /nfs/dbraw/zinc/98/10/85/1028981085.db2.gz OEHZVPICVWQTLR-HXUWFJFHSA-N 1 1 313.441 3.776 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)cc1 ZINC000816662656 1028982487 /nfs/dbraw/zinc/98/24/87/1028982487.db2.gz UUSQKHQOERTBLV-FQEVSTJZSA-N 1 1 318.505 3.763 20 10 DHCDMO Oc1cc(F)c(Cl)cc1CN1CCOC[C@@H]1CC1CCC1 ZINC000816667649 1028986137 /nfs/dbraw/zinc/98/61/37/1028986137.db2.gz STNRUZPPBFJBDN-ZDUSSCGKSA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1csc(Cl)c1 ZINC000817940736 1029281379 /nfs/dbraw/zinc/28/13/79/1029281379.db2.gz HPEHQGPMOKYBKI-ABAIWWIYSA-N 1 1 323.893 3.818 20 10 DHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(C2CC2)c1 ZINC000817943829 1029287962 /nfs/dbraw/zinc/28/79/62/1029287962.db2.gz VTWCVFTZOYJZRV-QVKFZJNVSA-N 1 1 323.484 3.981 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C(F)(F)F)c1O ZINC000817956801 1029297675 /nfs/dbraw/zinc/29/76/75/1029297675.db2.gz DDUIOMMWNKPWBW-LLVKDONJSA-N 1 1 324.346 3.887 20 10 DHCDMO NC1(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CCC1 ZINC000817965095 1029305605 /nfs/dbraw/zinc/30/56/05/1029305605.db2.gz PEPCJJFTPNFQAV-SFHVURJKSA-N 1 1 310.441 3.537 20 10 DHCDMO C[C@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817971640 1029311180 /nfs/dbraw/zinc/31/11/80/1029311180.db2.gz ONUDMFOJSGISKE-AOIWGVFYSA-N 1 1 315.505 3.858 20 10 DHCDMO CCN[C@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817972932 1029311451 /nfs/dbraw/zinc/31/14/51/1029311451.db2.gz QCWDXWJBNQWZJN-VQIMIIECSA-N 1 1 312.457 3.654 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000374882879 1029488343 /nfs/dbraw/zinc/48/83/43/1029488343.db2.gz RCHKOYZOCYUQBV-UHFFFAOYSA-N 1 1 313.372 3.553 20 10 DHCDMO Cc1cnc([C@@H]2CCC[N@H+](Cc3cccc(F)c3O)C2)s1 ZINC000374894053 1029490260 /nfs/dbraw/zinc/49/02/60/1029490260.db2.gz KCYCDQZYCBHUFW-CYBMUJFWSA-N 1 1 306.406 3.676 20 10 DHCDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3cccc(F)c3O)C2)s1 ZINC000374894053 1029490264 /nfs/dbraw/zinc/49/02/64/1029490264.db2.gz KCYCDQZYCBHUFW-CYBMUJFWSA-N 1 1 306.406 3.676 20 10 DHCDMO COc1ccc(N2CC[C@@H](CNc3[nH]c4ccccc4[nH+]3)C2)cc1 ZINC000819934269 1029630142 /nfs/dbraw/zinc/63/01/42/1029630142.db2.gz DNIXHGNEVIHHGW-AWEZNQCLSA-N 1 1 322.412 3.510 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000373822016 1029824730 /nfs/dbraw/zinc/82/47/30/1029824730.db2.gz WLXNYRPXQDWFMH-MRXNPFEDSA-N 1 1 321.779 3.624 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](CC)c2ccncc2)c1O ZINC000290519884 1030087691 /nfs/dbraw/zinc/08/76/91/1030087691.db2.gz PZWHPZPJLHYWJE-INIZCTEOSA-N 1 1 300.402 3.769 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1O ZINC000245873365 1030167231 /nfs/dbraw/zinc/16/72/31/1030167231.db2.gz SDUUSYYHSNGAAM-HZPDHXFCSA-N 1 1 317.454 3.850 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3oc(C)nc32)cc1 ZINC000924711634 1030168876 /nfs/dbraw/zinc/16/88/76/1030168876.db2.gz VEPCTDCBODTLIY-KRWDZBQOSA-N 1 1 313.445 3.996 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1C ZINC000291012013 1030286995 /nfs/dbraw/zinc/28/69/95/1030286995.db2.gz WXKDBDPPGYYPJR-ZWKOTPCHSA-N 1 1 301.430 3.543 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccc(F)cc1O ZINC000866529466 1030348190 /nfs/dbraw/zinc/34/81/90/1030348190.db2.gz GMJDJXSZNPRPKX-CJNGLKHVSA-N 1 1 307.409 3.779 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1[N+](=O)[O-] ZINC000866540517 1030358422 /nfs/dbraw/zinc/35/84/22/1030358422.db2.gz PQPPRWAJYATTMW-LLVKDONJSA-N 1 1 304.321 3.599 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)c1ccc(Cl)cc1O ZINC000866538560 1030360962 /nfs/dbraw/zinc/36/09/62/1030360962.db2.gz CBBCQUCFFFTTHX-FFSVYQOJSA-N 1 1 309.837 3.759 20 10 DHCDMO COc1cccc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000866596125 1030390060 /nfs/dbraw/zinc/39/00/60/1030390060.db2.gz BFGSRMKDYKNFHZ-ABAIWWIYSA-N 1 1 307.340 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1cc(Cl)c(Cl)cc1O ZINC000866615237 1030404763 /nfs/dbraw/zinc/40/47/63/1030404763.db2.gz SILSYOJHINVLGE-BDAKNGLRSA-N 1 1 314.216 3.844 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccnn1C ZINC000866615240 1030404782 /nfs/dbraw/zinc/40/47/82/1030404782.db2.gz SILSYOJHINVLGE-RKDXNWHRSA-N 1 1 314.216 3.844 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[N@H+]2CCOc3ccc(N)cc3C2)c(O)c1 ZINC000925755462 1030482140 /nfs/dbraw/zinc/48/21/40/1030482140.db2.gz WBZWXRKWIRWHJU-CQSZACIVSA-N 1 1 312.413 3.547 20 10 DHCDMO COc1cccc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c1O ZINC000121867235 1030490746 /nfs/dbraw/zinc/49/07/46/1030490746.db2.gz KDFJCJNQGGSUFM-UHFFFAOYSA-N 1 1 313.372 3.829 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)cc1 ZINC000824691126 1030613820 /nfs/dbraw/zinc/61/38/20/1030613820.db2.gz UJYHJNPSSLXWBZ-GOSISDBHSA-N 1 1 318.848 3.571 20 10 DHCDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000824715528 1030619351 /nfs/dbraw/zinc/61/93/51/1030619351.db2.gz LFZPAEJHACPSKR-GXTWGEPZSA-N 1 1 300.368 3.915 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1 ZINC000824716440 1030620233 /nfs/dbraw/zinc/62/02/33/1030620233.db2.gz VCCGSLFWPGWNIQ-XUVXKRRUSA-N 1 1 316.489 3.658 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000824815589 1030647922 /nfs/dbraw/zinc/64/79/22/1030647922.db2.gz UGQAJOSFRGDURJ-VQIMIIECSA-N 1 1 302.462 3.534 20 10 DHCDMO [O-]c1c(Br)cccc1C[N@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000824941762 1030677517 /nfs/dbraw/zinc/67/75/17/1030677517.db2.gz QLTDLKKPQKNMQP-UKRRQHHQSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000824941762 1030677524 /nfs/dbraw/zinc/67/75/24/1030677524.db2.gz QLTDLKKPQKNMQP-UKRRQHHQSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000824941762 1030677534 /nfs/dbraw/zinc/67/75/34/1030677534.db2.gz QLTDLKKPQKNMQP-UKRRQHHQSA-N 1 1 322.246 3.775 20 10 DHCDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825500799 1030828584 /nfs/dbraw/zinc/82/85/84/1030828584.db2.gz ICRIZNRUCOSPHY-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1O ZINC000292222396 1030888505 /nfs/dbraw/zinc/88/85/05/1030888505.db2.gz AGXJXIXCVXCCOE-OCCSQVGLSA-N 1 1 317.763 3.531 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1c(O)cccc1F ZINC000926918970 1030992311 /nfs/dbraw/zinc/99/23/11/1030992311.db2.gz KPPHJTPELFKICE-NEPJUHHUSA-N 1 1 301.361 3.706 20 10 DHCDMO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(F)cc1O ZINC000926917847 1030992735 /nfs/dbraw/zinc/99/27/35/1030992735.db2.gz DNBWENNSJXRQRG-SNVBAGLBSA-N 1 1 306.406 3.717 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3c(Cl)cccc3C2)c1O ZINC000123828239 1031351742 /nfs/dbraw/zinc/35/17/42/1031351742.db2.gz PKIMVPKAGXCCHF-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO C[C@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)[C@H]1C ZINC001144299930 1031439202 /nfs/dbraw/zinc/43/92/02/1031439202.db2.gz MSAOKQJMXDQYFT-UWVGGRQHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@H]1C ZINC001144299930 1031439208 /nfs/dbraw/zinc/43/92/08/1031439208.db2.gz MSAOKQJMXDQYFT-UWVGGRQHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306867 1031456671 /nfs/dbraw/zinc/45/66/71/1031456671.db2.gz UYMWXVJTCHNBLY-AOOOYVTPSA-N 1 1 316.214 3.772 20 10 DHCDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306867 1031456674 /nfs/dbraw/zinc/45/66/74/1031456674.db2.gz UYMWXVJTCHNBLY-AOOOYVTPSA-N 1 1 316.214 3.772 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](n3ccnc3C(C)C)C2)c1O ZINC000360792047 1031564166 /nfs/dbraw/zinc/56/41/66/1031564166.db2.gz SNIYYJFOEVATFH-QGZVFWFLSA-N 1 1 313.445 3.858 20 10 DHCDMO Cc1noc(C)c1[C@@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293689846 1031572698 /nfs/dbraw/zinc/57/26/98/1031572698.db2.gz SDYTXXRELGDGQY-QMMMGPOBSA-N 1 1 312.772 3.683 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000293734772 1031592371 /nfs/dbraw/zinc/59/23/71/1031592371.db2.gz WSKDIWKKCURQMB-LBPRGKRZSA-N 1 1 313.800 3.766 20 10 DHCDMO CC[C@@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144514854 1031671366 /nfs/dbraw/zinc/67/13/66/1031671366.db2.gz VDDYMVKKLDOSKN-ACJLOTCBSA-N 1 1 323.433 3.567 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000873235794 1031767197 /nfs/dbraw/zinc/76/71/97/1031767197.db2.gz QZPYPHNWYLERLV-GFCCVEGCSA-N 1 1 316.832 3.542 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000877437203 1033299328 /nfs/dbraw/zinc/29/93/28/1033299328.db2.gz ZCFGFCYYCNPXST-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000877437203 1033299336 /nfs/dbraw/zinc/29/93/36/1033299336.db2.gz ZCFGFCYYCNPXST-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877459520 1033308683 /nfs/dbraw/zinc/30/86/83/1033308683.db2.gz IASNPYBDSXOYGT-SFHVURJKSA-N 1 1 316.489 3.516 20 10 DHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1(C)C ZINC000877548681 1033349876 /nfs/dbraw/zinc/34/98/76/1033349876.db2.gz QXEJSEZVDGRQLN-IBGZPJMESA-N 1 1 316.489 3.514 20 10 DHCDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c(O)c1 ZINC000877634463 1033390983 /nfs/dbraw/zinc/39/09/83/1033390983.db2.gz QAFHQMJOILXROK-SFHVURJKSA-N 1 1 313.397 3.647 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)c1O ZINC000877770794 1033445924 /nfs/dbraw/zinc/44/59/24/1033445924.db2.gz XVTJAZNCWMHJRK-UHFFFAOYSA-N 1 1 310.397 3.904 20 10 DHCDMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000877834952 1033482454 /nfs/dbraw/zinc/48/24/54/1033482454.db2.gz BSBCWGLWIAGFJD-GOSISDBHSA-N 1 1 311.425 3.652 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(F)c2)n1 ZINC000127002402 1033643157 /nfs/dbraw/zinc/64/31/57/1033643157.db2.gz ICAVNUDLDFZSOS-IBGZPJMESA-N 1 1 313.420 3.932 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl ZINC000826049739 1033750389 /nfs/dbraw/zinc/75/03/89/1033750389.db2.gz YJJYOJTZWURZMP-USXIJHARSA-N 1 1 323.864 3.870 20 10 DHCDMO COc1cc(Cn2c[nH+]c3c2CCCC3)c(O)c(C(C)(C)C)c1 ZINC000862431803 1033851657 /nfs/dbraw/zinc/85/16/57/1033851657.db2.gz MTBYCTAPPFNQDU-UHFFFAOYSA-N 1 1 314.429 3.822 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000826120466 1034119182 /nfs/dbraw/zinc/11/91/82/1034119182.db2.gz DQFDUNOOXGACKG-NVXWUHKLSA-N 1 1 317.816 3.662 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[C@@H](C)[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000863547995 1034126600 /nfs/dbraw/zinc/12/66/00/1034126600.db2.gz SZDVOEKJWHVARL-BREBYQMCSA-N 1 1 317.260 3.880 20 10 DHCDMO C[N@@H+](Cc1c(C2CC2)nc2sccn12)Cc1ccccc1O ZINC000179770374 1034334050 /nfs/dbraw/zinc/33/40/50/1034334050.db2.gz FOLYTQAURAUUOO-UHFFFAOYSA-N 1 1 313.426 3.611 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)[C@H](C)c2cccnc2)c(O)c1 ZINC000183730548 1034417914 /nfs/dbraw/zinc/41/79/14/1034417914.db2.gz VQBICVSPAUUKCP-CQSZACIVSA-N 1 1 300.402 3.769 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cc1O ZINC000185004963 1034518480 /nfs/dbraw/zinc/51/84/80/1034518480.db2.gz NUNMPMTZPAFYMI-AWEZNQCLSA-N 1 1 314.404 3.982 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000211406757 1034546104 /nfs/dbraw/zinc/54/61/04/1034546104.db2.gz MNVOLRLYCCQEOP-FZMZJTMJSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000211406757 1034546112 /nfs/dbraw/zinc/54/61/12/1034546112.db2.gz MNVOLRLYCCQEOP-FZMZJTMJSA-N 1 1 310.235 3.919 20 10 DHCDMO CCOc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)ccc1OC ZINC000185452687 1034548266 /nfs/dbraw/zinc/54/82/66/1034548266.db2.gz NJVZPINIOYLVFU-GFCCVEGCSA-N 1 1 319.376 3.789 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cc(F)ccc1O ZINC000185459746 1034549391 /nfs/dbraw/zinc/54/93/91/1034549391.db2.gz YALITJHRTITPHI-LBPRGKRZSA-N 1 1 320.383 3.583 20 10 DHCDMO COC1(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)CCC(C)CC1 ZINC000794836072 1034591241 /nfs/dbraw/zinc/59/12/41/1034591241.db2.gz RUDGYNJJVSCOOD-VMBJYNEYSA-N 1 1 313.388 3.916 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(F)cc1O ZINC000186620958 1034650990 /nfs/dbraw/zinc/65/09/90/1034650990.db2.gz QPJPTJVDRSFCNU-GFCCVEGCSA-N 1 1 303.377 3.610 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000191856254 1034767523 /nfs/dbraw/zinc/76/75/23/1034767523.db2.gz QTKKRSYVMZSIPV-WTANOLMUSA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@@H]([NH2+]CC1CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000192790304 1034819263 /nfs/dbraw/zinc/81/92/63/1034819263.db2.gz WXOOPBSSXBTYEM-SECBINFHSA-N 1 1 304.217 3.776 20 10 DHCDMO CC(C)(CNCc1ccc(N2CCCC2)cc1)[NH+]1CCCCC1 ZINC001177087372 1035349319 /nfs/dbraw/zinc/34/93/19/1035349319.db2.gz ZKOATGBDLDCFNP-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO Cc1c2ccccc2n(C)c1CNC1CC[NH+](CC(C)C)CC1 ZINC001177199099 1035353967 /nfs/dbraw/zinc/35/39/67/1035353967.db2.gz CZCRKJUYMOTVBG-UHFFFAOYSA-N 1 1 313.489 3.697 20 10 DHCDMO CC(C)[NH+](CCCNC/C=C\c1ccc(N(C)C)cc1)C(C)C ZINC001177948023 1035402297 /nfs/dbraw/zinc/40/22/97/1035402297.db2.gz DJFHCVRAWPZPLZ-CLFYSBASSA-N 1 1 317.521 3.864 20 10 DHCDMO CC1(c2ccccc2)CC([NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001178590042 1035436328 /nfs/dbraw/zinc/43/63/28/1035436328.db2.gz WTTHUDJBGAPKAW-UHFFFAOYSA-N 1 1 303.352 3.880 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@@H+](Cc2ccccc2)[C@H](C)CO)c1 ZINC001179874331 1035529258 /nfs/dbraw/zinc/52/92/58/1035529258.db2.gz XHNLVGVOGDINSV-MRXNPFEDSA-N 1 1 313.441 3.899 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001180052867 1035576507 /nfs/dbraw/zinc/57/65/07/1035576507.db2.gz WEIGVBXWAGLEDE-DOTOQJQBSA-N 1 1 307.459 3.569 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)Cc2ccsc2)c1O ZINC001180057507 1035578956 /nfs/dbraw/zinc/57/89/56/1035578956.db2.gz GXCCMAQRYOATOX-ZDUSSCGKSA-N 1 1 305.443 3.834 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000905677704 1035612654 /nfs/dbraw/zinc/61/26/54/1035612654.db2.gz JPYDGHHYXKTXJK-CQSZACIVSA-N 1 1 317.326 3.875 20 10 DHCDMO Oc1cccc(Cl)c1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000129023439 1035691191 /nfs/dbraw/zinc/69/11/91/1035691191.db2.gz PZJMOMMMHCKWGQ-UHFFFAOYSA-N 1 1 305.809 3.647 20 10 DHCDMO COCCC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCCC1 ZINC000816556311 1035811391 /nfs/dbraw/zinc/81/13/91/1035811391.db2.gz FUCXOMAGVCYFDC-UHFFFAOYSA-N 1 1 315.816 3.871 20 10 DHCDMO CCCOC1(C[NH2+]Cc2cc(F)c(F)cc2O)CCCCC1 ZINC001181514991 1035925987 /nfs/dbraw/zinc/92/59/87/1035925987.db2.gz OOCRVYZFRSDGKX-UHFFFAOYSA-N 1 1 313.388 3.890 20 10 DHCDMO CSCc1ccc(C[NH2+]Cc2cc(F)c(F)cc2O)cc1 ZINC001181622244 1035952859 /nfs/dbraw/zinc/95/28/59/1035952859.db2.gz SHDFWUQRKGKXHG-UHFFFAOYSA-N 1 1 309.381 3.823 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C[C@@H](C)OC ZINC001194551389 1035960198 /nfs/dbraw/zinc/96/01/98/1035960198.db2.gz GSXLIYNYZGGMOU-QGZVFWFLSA-N 1 1 304.478 3.842 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(CN2CCC([NH3+])CC2)cc1 ZINC000032086685 1036111577 /nfs/dbraw/zinc/11/15/77/1036111577.db2.gz YCUAKMUHNOVNMG-UHFFFAOYSA-N 1 1 323.484 3.636 20 10 DHCDMO CC[N@H+](CCN1CCCCC1)Cc1ccc(N2CCCC2)cc1 ZINC001204321133 1036113058 /nfs/dbraw/zinc/11/30/58/1036113058.db2.gz GYEFEJMPIQWIET-UHFFFAOYSA-N 1 1 315.505 3.595 20 10 DHCDMO CC[N@@H+](CCN1CCCCC1)Cc1ccc(N2CCCC2)cc1 ZINC001204321133 1036113067 /nfs/dbraw/zinc/11/30/67/1036113067.db2.gz GYEFEJMPIQWIET-UHFFFAOYSA-N 1 1 315.505 3.595 20 10 DHCDMO CCN1CCC[C@H]1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774120877 1036178708 /nfs/dbraw/zinc/17/87/08/1036178708.db2.gz VXEOZKDJERRPGH-QWRGUYRKSA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@@H]([NH2+]C[C@@](C)(O)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774184968 1036235824 /nfs/dbraw/zinc/23/58/24/1036235824.db2.gz TZCSOLRXHIKJEI-XLKFXECMSA-N 1 1 304.217 3.511 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)c1 ZINC000775658362 1036246107 /nfs/dbraw/zinc/24/61/07/1036246107.db2.gz LIYPRYOYQBPVIY-KRWDZBQOSA-N 1 1 315.388 3.747 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1O ZINC000775676297 1036400370 /nfs/dbraw/zinc/40/03/70/1036400370.db2.gz PQIWMDBTJDQOPQ-MRXNPFEDSA-N 1 1 311.381 3.766 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000775686021 1036433090 /nfs/dbraw/zinc/43/30/90/1036433090.db2.gz BOQNBQORWQYEKN-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000774658563 1036640830 /nfs/dbraw/zinc/64/08/30/1036640830.db2.gz NSBCJRLIPIMDBA-UHFFFAOYSA-N 1 1 311.425 3.938 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)Cc2cccc(OC)c2)c1O ZINC001203613708 1037089427 /nfs/dbraw/zinc/08/94/27/1037089427.db2.gz FYDYLJLZLMYTGM-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccccc3)CC2)cc1 ZINC001198706108 1037115324 /nfs/dbraw/zinc/11/53/24/1037115324.db2.gz NXJSMZZEAYNMFX-FQEVSTJZSA-N 1 1 310.441 3.716 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774886886 1037168047 /nfs/dbraw/zinc/16/80/47/1037168047.db2.gz XZHYYLVVNCKWEG-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774886886 1037168053 /nfs/dbraw/zinc/16/80/53/1037168053.db2.gz XZHYYLVVNCKWEG-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO CCC[C@@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774906289 1037199011 /nfs/dbraw/zinc/19/90/11/1037199011.db2.gz WZRHRWGDWKSFIB-KRWDZBQOSA-N 1 1 322.405 3.711 20 10 DHCDMO CCC[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774906289 1037199020 /nfs/dbraw/zinc/19/90/20/1037199020.db2.gz WZRHRWGDWKSFIB-KRWDZBQOSA-N 1 1 322.405 3.711 20 10 DHCDMO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911341 1037206748 /nfs/dbraw/zinc/20/67/48/1037206748.db2.gz YYSFZFKMVLZCNE-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911341 1037206768 /nfs/dbraw/zinc/20/67/68/1037206768.db2.gz YYSFZFKMVLZCNE-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO C[C@H]1CCCC[C@H]1OCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199275764 1037241353 /nfs/dbraw/zinc/24/13/53/1037241353.db2.gz MDLVDVIQOSLKNC-XHDPSFHLSA-N 1 1 315.816 3.870 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c(O)c1 ZINC000775992872 1037292436 /nfs/dbraw/zinc/29/24/36/1037292436.db2.gz ZRMFDCJUSNFXNI-MRXNPFEDSA-N 1 1 318.442 3.893 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000776014805 1037297019 /nfs/dbraw/zinc/29/70/19/1037297019.db2.gz QNZSIFISLYBBKV-LJQANCHMSA-N 1 1 313.372 3.553 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776015641 1037308449 /nfs/dbraw/zinc/30/84/49/1037308449.db2.gz WCKRZJFGNVTTQT-WCQYABFASA-N 1 1 317.351 3.954 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000776015575 1037309382 /nfs/dbraw/zinc/30/93/82/1037309382.db2.gz WIQNNVIFMUJHHC-NRFANRHFSA-N 1 1 322.452 3.774 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c(O)c1 ZINC000776011841 1037310053 /nfs/dbraw/zinc/31/00/53/1037310053.db2.gz BQKUTLYUACEXBR-SMDDNHRTSA-N 1 1 317.351 3.954 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CCCCC1 ZINC000774990346 1037346107 /nfs/dbraw/zinc/34/61/07/1037346107.db2.gz SNBIIGWZLWRJLY-CQSZACIVSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775012022 1037383729 /nfs/dbraw/zinc/38/37/29/1037383729.db2.gz OURVQGBHROKICF-OLZOCXBDSA-N 1 1 322.405 3.615 20 10 DHCDMO CC(C)(C)c1csc(C[NH2+]Cc2ccc3c(c2)CCO3)n1 ZINC000105498267 1037415501 /nfs/dbraw/zinc/41/55/01/1037415501.db2.gz RZMOCAJQGMIMNE-UHFFFAOYSA-N 1 1 302.443 3.665 20 10 DHCDMO CN1CCC([N@H+](Cc2cc(Cl)ccc2O)C2CCCC2)CC1 ZINC001203665603 1037684752 /nfs/dbraw/zinc/68/47/52/1037684752.db2.gz PBELYSLIAMEVOU-UHFFFAOYSA-N 1 1 322.880 3.884 20 10 DHCDMO CN1CCC([N@@H+](Cc2cc(Cl)ccc2O)C2CCCC2)CC1 ZINC001203665603 1037684769 /nfs/dbraw/zinc/68/47/69/1037684769.db2.gz PBELYSLIAMEVOU-UHFFFAOYSA-N 1 1 322.880 3.884 20 10 DHCDMO Cc1ccn2cc(C[N@H+](C)Cc3cc(Cl)ccc3O)nc2c1 ZINC001203665841 1037686159 /nfs/dbraw/zinc/68/61/59/1037686159.db2.gz XUJCCABGCBJXQH-UHFFFAOYSA-N 1 1 315.804 3.634 20 10 DHCDMO COc1ccc(O)c(C[N@H+](C)Cc2cc(Cl)ccc2F)c1 ZINC000775150473 1037742329 /nfs/dbraw/zinc/74/23/29/1037742329.db2.gz KHTPYVFTRXAENB-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc(Cl)ccc2F)c1 ZINC000775150473 1037742348 /nfs/dbraw/zinc/74/23/48/1037742348.db2.gz KHTPYVFTRXAENB-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CCOC[C@H]1CC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000164449325 1038191792 /nfs/dbraw/zinc/19/17/92/1038191792.db2.gz XHAVONWXRNRGLJ-AWEZNQCLSA-N 1 1 321.461 3.557 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1O ZINC000164473598 1038202897 /nfs/dbraw/zinc/20/28/97/1038202897.db2.gz MIKWNZJYNUCDAF-GOEBONIOSA-N 1 1 307.459 3.569 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCC[C@@H]1O ZINC001190436885 1038315660 /nfs/dbraw/zinc/31/56/60/1038315660.db2.gz NIQOAEUWZRVWCP-HKUYNNGSSA-N 1 1 304.478 3.514 20 10 DHCDMO Cc1cc(C[N@H+]2CCN(C)c3ccccc3C2)ccc1N(C)C ZINC001190801610 1038385854 /nfs/dbraw/zinc/38/58/54/1038385854.db2.gz KBUHDEKDPDFHFO-UHFFFAOYSA-N 1 1 309.457 3.513 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccccc1O ZINC000775487349 1038557579 /nfs/dbraw/zinc/55/75/79/1038557579.db2.gz LYQPETDPFYDVAY-PKOBYXMFSA-N 1 1 321.424 3.956 20 10 DHCDMO CCc1cc(C[N@@H+](C)Cc2cnn(C)c2)c(O)c(C(C)(C)C)c1 ZINC000057086378 1038558272 /nfs/dbraw/zinc/55/82/72/1038558272.db2.gz PKRNKAAEVMEEDJ-UHFFFAOYSA-N 1 1 315.461 3.618 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000760882435 1038958913 /nfs/dbraw/zinc/95/89/13/1038958913.db2.gz WUSIGGSHSDKSRL-DKCNOQQISA-N 1 1 307.394 3.590 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000760881010 1038960363 /nfs/dbraw/zinc/96/03/63/1038960363.db2.gz LAGUCBZKLAGBLR-VXGBXAGGSA-N 1 1 304.463 3.714 20 10 DHCDMO CCC[N@H+](C)C[C@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450074 1040290536 /nfs/dbraw/zinc/29/05/36/1040290536.db2.gz VAZNHQWUSJSBSD-QGZVFWFLSA-N 1 1 318.505 3.988 20 10 DHCDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450074 1040290552 /nfs/dbraw/zinc/29/05/52/1040290552.db2.gz VAZNHQWUSJSBSD-QGZVFWFLSA-N 1 1 318.505 3.988 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCc3c(F)cccc3C2)c1O ZINC000761198412 1040563073 /nfs/dbraw/zinc/56/30/73/1040563073.db2.gz JFJNOFIVNRXPDG-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3c(F)cccc3C2)c1O ZINC000761198412 1040563081 /nfs/dbraw/zinc/56/30/81/1040563081.db2.gz JFJNOFIVNRXPDG-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO CCC[N@@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1O ZINC000174373941 1040623992 /nfs/dbraw/zinc/62/39/92/1040623992.db2.gz HXIPQUXEMCPNDC-UHFFFAOYSA-N 1 1 309.413 3.761 20 10 DHCDMO COc1cccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)c1O ZINC000092670774 185333195 /nfs/dbraw/zinc/33/31/95/185333195.db2.gz RAHLRMHNAKSYED-UHFFFAOYSA-N 1 1 313.397 3.519 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2ccccc2O)c1OC(F)F ZINC000091974426 193135400 /nfs/dbraw/zinc/13/54/00/193135400.db2.gz XGXHCIWOILISKG-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000093315652 193230433 /nfs/dbraw/zinc/23/04/33/193230433.db2.gz TYYZUKYYSNVFAJ-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@@H]2c2cn[nH]c2)c(O)c1 ZINC000093438335 193251803 /nfs/dbraw/zinc/25/18/03/193251803.db2.gz LWIBWNCJEOFFAB-QGZVFWFLSA-N 1 1 315.417 3.631 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000273414834 130118680 /nfs/dbraw/zinc/11/86/80/130118680.db2.gz QOXRQYYZCOFPQI-NHYWBVRUSA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOC[C@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000278831201 130721497 /nfs/dbraw/zinc/72/14/97/130721497.db2.gz UARREXZZHFUZLW-VYUIOLGVSA-N 1 1 304.217 3.775 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(OC(C)C)nc1)c1ccc(F)cc1O ZINC000285600013 131185315 /nfs/dbraw/zinc/18/53/15/131185315.db2.gz JSNHDLNIZVHQAS-INIZCTEOSA-N 1 1 318.392 3.954 20 10 DHCDMO COc1ccc(C[NH2+]C2(c3nc(C)cs3)CCC2)cc1C ZINC000299604887 132113280 /nfs/dbraw/zinc/11/32/80/132113280.db2.gz MBJQFGOJZZTWOO-UHFFFAOYSA-N 1 1 302.443 3.938 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000294986468 335129609 /nfs/dbraw/zinc/12/96/09/335129609.db2.gz KFFGXSSTJZIFCK-AAEUAGOBSA-N 1 1 317.351 3.954 20 10 DHCDMO COc1cccc(-c2cnc(C[N@H+](C)Cc3ccccc3O)o2)c1 ZINC000376778252 337040899 /nfs/dbraw/zinc/04/08/99/337040899.db2.gz KTOBAQUJCACMJD-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO COc1cccc(-c2cnc(C[N@@H+](C)Cc3ccccc3O)o2)c1 ZINC000376778252 337040900 /nfs/dbraw/zinc/04/09/00/337040900.db2.gz KTOBAQUJCACMJD-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@H](O)C[C@@H]1c1cccc(F)c1 ZINC000377695794 337058741 /nfs/dbraw/zinc/05/87/41/337058741.db2.gz IJNLBZSDBITIPL-KBAYOESNSA-N 1 1 315.388 3.790 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1O ZINC000378439665 337072742 /nfs/dbraw/zinc/07/27/42/337072742.db2.gz STQDMIKJAFAPLH-ZDUSSCGKSA-N 1 1 317.820 3.524 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000186175979 337254159 /nfs/dbraw/zinc/25/41/59/337254159.db2.gz ZEQJXJZMLBHJRW-MKBNYLNASA-N 1 1 301.361 3.747 20 10 DHCDMO CCSc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)ccn1 ZINC000187799530 521734002 /nfs/dbraw/zinc/73/40/02/521734002.db2.gz OQSVKMUSFDCUMH-NSHDSACASA-N 1 1 306.406 3.889 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)c1 ZINC000180231772 524734656 /nfs/dbraw/zinc/73/46/56/524734656.db2.gz DFTLZOJLEMKZNL-OAHLLOKOSA-N 1 1 318.442 3.675 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000365664663 526346050 /nfs/dbraw/zinc/34/60/50/526346050.db2.gz WJJFBCCQXBZUJX-JKSUJKDBSA-N 1 1 307.821 3.579 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000365664662 526346333 /nfs/dbraw/zinc/34/63/33/526346333.db2.gz WJJFBCCQXBZUJX-HZPDHXFCSA-N 1 1 307.821 3.579 20 10 DHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2[O-])C1 ZINC000287753851 534946193 /nfs/dbraw/zinc/94/61/93/534946193.db2.gz QMGBDPASPOCDSI-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1c(O)ccc3ccccc31)C2 ZINC000285172113 535397074 /nfs/dbraw/zinc/39/70/74/535397074.db2.gz QJVOTHUZUAORKZ-UHFFFAOYSA-N 1 1 311.425 3.936 20 10 DHCDMO CCOC1CC(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000285869074 535752470 /nfs/dbraw/zinc/75/24/70/535752470.db2.gz DWLROGLHQFNLDX-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1[O-] ZINC000286880206 535913667 /nfs/dbraw/zinc/91/36/67/535913667.db2.gz CIXNXORSGOMYKY-DOMZBBRYSA-N 1 1 319.836 3.545 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccc(OC)c1OC)c1ccc(F)cc1O ZINC000285989050 535920375 /nfs/dbraw/zinc/92/03/75/535920375.db2.gz IAELLDKUYKPZOO-HNNXBMFYSA-N 1 1 319.376 3.789 20 10 DHCDMO COCC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc(C)o1 ZINC000273478303 536817940 /nfs/dbraw/zinc/81/79/40/536817940.db2.gz TZDSSGKSFYJQQY-DOMZBBRYSA-N 1 1 307.365 3.861 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccc(F)cc1 ZINC000042411677 1013188874 /nfs/dbraw/zinc/18/88/74/1013188874.db2.gz PHQOXITWRHNKKL-UHFFFAOYSA-N 1 1 310.166 3.584 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000894491205 1013387993 /nfs/dbraw/zinc/38/79/93/1013387993.db2.gz LESNXOYQGBYNSA-AAEUAGOBSA-N 1 1 317.351 3.872 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]C2CCN(CCC(C)C)CC2)c1 ZINC000894502063 1013396437 /nfs/dbraw/zinc/39/64/37/1013396437.db2.gz KLZNBEKFVQWBSR-OAHLLOKOSA-N 1 1 320.477 3.562 20 10 DHCDMO CCOC[C@@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000177635316 1013828158 /nfs/dbraw/zinc/82/81/58/1013828158.db2.gz RDVUWPSOAMDBNZ-OAHLLOKOSA-N 1 1 305.462 3.857 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCc3nc[nH]c3C23CCC3)cc1Cl ZINC000895068810 1014232768 /nfs/dbraw/zinc/23/27/68/1014232768.db2.gz MFVAZVJMNRMIAD-UHFFFAOYSA-N 1 1 317.820 3.515 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCc3nc[nH]c3C23CCC3)cc1Cl ZINC000895068810 1014232773 /nfs/dbraw/zinc/23/27/73/1014232773.db2.gz MFVAZVJMNRMIAD-UHFFFAOYSA-N 1 1 317.820 3.515 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CC[C@H](O)CC1 ZINC000275945456 1014328844 /nfs/dbraw/zinc/32/88/44/1014328844.db2.gz IRQNJGPDBNXZLW-WGSAOQKQSA-N 1 1 311.425 3.795 20 10 DHCDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000157824216 1015071547 /nfs/dbraw/zinc/07/15/47/1015071547.db2.gz HTNCZTGPCOVZOT-OAHLLOKOSA-N 1 1 316.470 3.778 20 10 DHCDMO CC[C@@H]1COCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000738081765 1015159110 /nfs/dbraw/zinc/15/91/10/1015159110.db2.gz ODWDICSDGCSKOW-CQSZACIVSA-N 1 1 311.381 3.902 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)c(O)c1OC ZINC000891498657 1015327968 /nfs/dbraw/zinc/32/79/68/1015327968.db2.gz KRSRJIVLVMAHRL-CYBMUJFWSA-N 1 1 319.426 3.808 20 10 DHCDMO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccccc3O)n2)cc1 ZINC000276711577 1015541489 /nfs/dbraw/zinc/54/14/89/1015541489.db2.gz CWAJAMALVPGBKM-CYBMUJFWSA-N 1 1 323.396 3.855 20 10 DHCDMO COc1ccc(C[N@@H+](C)C[C@@H](C)c2ccccc2)c(O)c1OC ZINC000891916753 1015755861 /nfs/dbraw/zinc/75/58/61/1015755861.db2.gz OLNMNULLHSUMME-CQSZACIVSA-N 1 1 315.413 3.645 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c(O)c1OC ZINC000892049870 1016156794 /nfs/dbraw/zinc/15/67/94/1016156794.db2.gz NUMMYPRBCCBYIK-LJQANCHMSA-N 1 1 317.429 3.732 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c(O)c1OC ZINC000892049869 1016156885 /nfs/dbraw/zinc/15/68/85/1016156885.db2.gz NUMMYPRBCCBYIK-IBGZPJMESA-N 1 1 317.429 3.732 20 10 DHCDMO C[NH+](C)[C@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000277329131 1016206873 /nfs/dbraw/zinc/20/68/73/1016206873.db2.gz CNQWGUKYTDGPGN-IBGZPJMESA-N 1 1 315.505 3.593 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1ccc(F)cc1O ZINC000184834935 1016389388 /nfs/dbraw/zinc/38/93/88/1016389388.db2.gz CADGJCCHSCHTBU-YVEFUNNKSA-N 1 1 320.383 3.624 20 10 DHCDMO C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000185033868 1016524167 /nfs/dbraw/zinc/52/41/67/1016524167.db2.gz SFEYHNRYNCQKNB-GJZGRUSLSA-N 1 1 308.441 3.837 20 10 DHCDMO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3ncc[nH]3)cc2Cl)C1 ZINC000281959362 1016836110 /nfs/dbraw/zinc/83/61/10/1016836110.db2.gz JHKLSDFCWPJTDH-CYBMUJFWSA-N 1 1 318.852 3.589 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C3CCCC3)C2)c1O ZINC001171330430 1032391071 /nfs/dbraw/zinc/39/10/71/1032391071.db2.gz BZPVPQGPRJCLSE-CQSZACIVSA-N 1 1 305.393 3.746 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171382777 1032558265 /nfs/dbraw/zinc/55/82/65/1032558265.db2.gz DYMSXDUEMIYBQN-HNNXBMFYSA-N 1 1 303.352 3.660 20 10 DHCDMO COc1cc2[nH+]ccn2cc1NCc1cc2ccccc2cc1O ZINC001171407695 1032602492 /nfs/dbraw/zinc/60/24/92/1032602492.db2.gz UEDMYWNCXDVJGQ-UHFFFAOYSA-N 1 1 319.364 3.814 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](C[C@H]3CCOC3)C1)CCC2 ZINC000773260615 1032665414 /nfs/dbraw/zinc/66/54/14/1032665414.db2.gz YLSXOGYRNSIUGQ-HZPDHXFCSA-N 1 1 315.457 3.520 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCc3c(F)cccc3C2)cc1 ZINC001171440436 1032686013 /nfs/dbraw/zinc/68/60/13/1032686013.db2.gz JCFXSTOVZJIQAW-GOSISDBHSA-N 1 1 312.432 3.881 20 10 DHCDMO CC1CCN(c2ccc(C[NH2+][C@H]3CCCc4c[nH]nc43)cc2)CC1 ZINC000857854073 1032690516 /nfs/dbraw/zinc/69/05/16/1032690516.db2.gz IPCREHNVGWLDIJ-IBGZPJMESA-N 1 1 324.472 3.813 20 10 DHCDMO Cc1ccc(C[N@@H+](CCO)Cc2cc(Cl)cc(C)c2O)cc1 ZINC000783603676 1017518483 /nfs/dbraw/zinc/51/84/83/1017518483.db2.gz VRMUWAYANCFBAU-UHFFFAOYSA-N 1 1 319.832 3.657 20 10 DHCDMO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1O ZINC000796843948 1017540930 /nfs/dbraw/zinc/54/09/30/1017540930.db2.gz BMSPOCQMRDUBNT-MRXNPFEDSA-N 1 1 318.348 3.723 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c(O)c1 ZINC000125750078 1032718086 /nfs/dbraw/zinc/71/80/86/1032718086.db2.gz TXUOSRXFBBHYIY-UHFFFAOYSA-N 1 1 320.820 3.861 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1O ZINC000363533853 1018011506 /nfs/dbraw/zinc/01/15/06/1018011506.db2.gz JWUKISVENJHYTK-USXIJHARSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533853 1018011518 /nfs/dbraw/zinc/01/15/18/1018011518.db2.gz JWUKISVENJHYTK-USXIJHARSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533853 1018011534 /nfs/dbraw/zinc/01/15/34/1018011534.db2.gz JWUKISVENJHYTK-USXIJHARSA-N 1 1 310.441 3.823 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000021995163 1018047064 /nfs/dbraw/zinc/04/70/64/1018047064.db2.gz UUQLSMQERQMLRK-UHFFFAOYSA-N 1 1 321.424 3.638 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858016633 1032747737 /nfs/dbraw/zinc/74/77/37/1032747737.db2.gz NVSLNORWMCOFBJ-GOSISDBHSA-N 1 1 324.424 3.626 20 10 DHCDMO C[C@H](Cn1ccnc1)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278257989 1018469091 /nfs/dbraw/zinc/46/90/91/1018469091.db2.gz NKLUOLZNMMTCGA-NXEZZACHSA-N 1 1 314.216 3.635 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)c1 ZINC000178885872 1018481186 /nfs/dbraw/zinc/48/11/86/1018481186.db2.gz ZTTOQWJNDMBUOF-SFHVURJKSA-N 1 1 315.388 3.722 20 10 DHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cccc(Br)c1[O-] ZINC000131096255 1018506795 /nfs/dbraw/zinc/50/67/95/1018506795.db2.gz KOJWVBOMXDGJHN-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO C[C@@H](c1ccco1)[N@H+](C)Cc1cccc(Br)c1O ZINC000131096255 1018506805 /nfs/dbraw/zinc/50/68/05/1018506805.db2.gz KOJWVBOMXDGJHN-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cccc(Br)c1O ZINC000131096255 1018506814 /nfs/dbraw/zinc/50/68/14/1018506814.db2.gz KOJWVBOMXDGJHN-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1F ZINC001137837673 1018659600 /nfs/dbraw/zinc/65/96/00/1018659600.db2.gz QNBHXQSPLZRVMP-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(O)cccc1F ZINC001137837673 1018659603 /nfs/dbraw/zinc/65/96/03/1018659603.db2.gz QNBHXQSPLZRVMP-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO CCc1ccc(C[NH2+]Cc2cccc(Br)c2O)o1 ZINC000278452314 1018707574 /nfs/dbraw/zinc/70/75/74/1018707574.db2.gz YARMNNAOXCLKDP-UHFFFAOYSA-N 1 1 310.191 3.600 20 10 DHCDMO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1cc2c(cc1O)CCC2 ZINC001116781053 1018857567 /nfs/dbraw/zinc/85/75/67/1018857567.db2.gz PUXZCILHWPNOGQ-UHFFFAOYSA-N 1 1 303.352 3.791 20 10 DHCDMO [O-]c1cccc(F)c1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001137841912 1018859030 /nfs/dbraw/zinc/85/90/30/1018859030.db2.gz ZJNBWMIVRHFYMO-OAHLLOKOSA-N 1 1 303.352 3.878 20 10 DHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001137841912 1018859058 /nfs/dbraw/zinc/85/90/58/1018859058.db2.gz ZJNBWMIVRHFYMO-OAHLLOKOSA-N 1 1 303.352 3.878 20 10 DHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001137841912 1018859075 /nfs/dbraw/zinc/85/90/75/1018859075.db2.gz ZJNBWMIVRHFYMO-OAHLLOKOSA-N 1 1 303.352 3.878 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](c3ccccn3)C2)cc1Cl ZINC000825768616 1032798195 /nfs/dbraw/zinc/79/81/95/1032798195.db2.gz SMOPBSZSDQOOSD-ZDUSSCGKSA-N 1 1 302.805 3.739 20 10 DHCDMO C[C@@H]([NH2+]CCC[C@H](C)CO)c1cc(Cl)c(Cl)cc1O ZINC000278657886 1019002930 /nfs/dbraw/zinc/00/29/30/1019002930.db2.gz ILPPRTBRSZVMJP-VHSXEESVSA-N 1 1 306.233 3.758 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC3(C[C@@H]2C)CCOCC3)c1O ZINC000843431850 1019040290 /nfs/dbraw/zinc/04/02/90/1019040290.db2.gz KKRWMGZNHRBCRV-ZDUSSCGKSA-N 1 1 309.837 3.745 20 10 DHCDMO Cc1c[nH]nc1C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C ZINC000858294205 1032832538 /nfs/dbraw/zinc/83/25/38/1032832538.db2.gz VPLGJFYFNFWTQT-UHFFFAOYSA-N 1 1 308.429 3.724 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1ccc(F)cc1O ZINC000170788884 1019435404 /nfs/dbraw/zinc/43/54/04/1019435404.db2.gz YMZGSZXGCSCMAD-XJKSGUPXSA-N 1 1 318.392 3.612 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cc1F ZINC000363532259 1019737646 /nfs/dbraw/zinc/73/76/46/1019737646.db2.gz HWRQAANJYVCRAO-MRXNPFEDSA-N 1 1 316.424 3.562 20 10 DHCDMO CCC[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccccc1O ZINC000727830785 1019817724 /nfs/dbraw/zinc/81/77/24/1019817724.db2.gz OFMGOALGRPLJIC-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO CCCC[N@@H+](CCOC)Cc1c(O)ccc2ccc(OC)cc21 ZINC000731661013 1020131252 /nfs/dbraw/zinc/13/12/52/1020131252.db2.gz RXUHMHWSMJEKSY-UHFFFAOYSA-N 1 1 317.429 3.803 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1nc(C2CC2)no1)C1CCCC1 ZINC000731848115 1020157780 /nfs/dbraw/zinc/15/77/80/1020157780.db2.gz SMVUFYBRNRUMGJ-UHFFFAOYSA-N 1 1 313.401 3.597 20 10 DHCDMO Cn1cc(CCC[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000732204706 1020211636 /nfs/dbraw/zinc/21/16/36/1020211636.db2.gz BDSSINYJQKDITM-UHFFFAOYSA-N 1 1 313.445 3.503 20 10 DHCDMO Nc1ccc(CCc2ccc(Nc3ccc[nH+]c3N)cc2)cc1 ZINC001212402320 1020332380 /nfs/dbraw/zinc/33/23/80/1020332380.db2.gz ZAIXLZIQTDJBGH-UHFFFAOYSA-N 1 1 304.397 3.775 20 10 DHCDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000179496097 1020360242 /nfs/dbraw/zinc/36/02/42/1020360242.db2.gz ZHJOEMZRPAOAPE-MRXNPFEDSA-N 1 1 302.462 3.532 20 10 DHCDMO C[NH+](C)[C@@H](CNCc1c(O)cccc1Cl)C1CCCCC1 ZINC000733324411 1020371571 /nfs/dbraw/zinc/37/15/71/1020371571.db2.gz ACMNQMIWHBHYRS-INIZCTEOSA-N 1 1 310.869 3.646 20 10 DHCDMO CCc1cnc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)s1 ZINC000177173573 1020500002 /nfs/dbraw/zinc/50/00/02/1020500002.db2.gz HNWUVARCSGVJSM-UHFFFAOYSA-N 1 1 302.443 3.532 20 10 DHCDMO CCc1cnc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)s1 ZINC000177173573 1020500010 /nfs/dbraw/zinc/50/00/10/1020500010.db2.gz HNWUVARCSGVJSM-UHFFFAOYSA-N 1 1 302.443 3.532 20 10 DHCDMO CCCC[N@H+](Cc1nnc(C)n1CCC)Cc1ccccc1O ZINC000282495917 1020617626 /nfs/dbraw/zinc/61/76/26/1020617626.db2.gz QIYGPXZPQFUUDE-UHFFFAOYSA-N 1 1 316.449 3.504 20 10 DHCDMO CCCC[N@@H+](Cc1nnc(C)n1CCC)Cc1ccccc1O ZINC000282495917 1020617632 /nfs/dbraw/zinc/61/76/32/1020617632.db2.gz QIYGPXZPQFUUDE-UHFFFAOYSA-N 1 1 316.449 3.504 20 10 DHCDMO CCC(F)(F)C[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000858508194 1032926464 /nfs/dbraw/zinc/92/64/64/1032926464.db2.gz UDGWLEYCSQDBTH-QMMMGPOBSA-N 1 1 308.166 3.851 20 10 DHCDMO C[C@@H]1CSCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000738276413 1020867242 /nfs/dbraw/zinc/86/72/42/1020867242.db2.gz HZNPGGFSJSAHSP-GFCCVEGCSA-N 1 1 317.454 3.955 20 10 DHCDMO COC[C@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000739871979 1020918930 /nfs/dbraw/zinc/91/89/30/1020918930.db2.gz XFPQUWGCVZPTRV-ZDUSSCGKSA-N 1 1 311.381 3.760 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](N(C)C)[C@H]2C)ccc1N1CCCCC1 ZINC001171942403 1032948246 /nfs/dbraw/zinc/94/82/46/1032948246.db2.gz IKHOENBYLOZJTQ-YLJYHZDGSA-N 1 1 315.505 3.510 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](N(C)C)[C@H]2C)ccc1N1CCCCC1 ZINC001171942403 1032948259 /nfs/dbraw/zinc/94/82/59/1032948259.db2.gz IKHOENBYLOZJTQ-YLJYHZDGSA-N 1 1 315.505 3.510 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](Cc3ccccc3)C1)CCC2 ZINC000742152998 1021096667 /nfs/dbraw/zinc/09/66/67/1021096667.db2.gz PVNCFDYIYLKYBF-KRWDZBQOSA-N 1 1 307.437 3.946 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)cc1 ZINC000742374848 1021114025 /nfs/dbraw/zinc/11/40/25/1021114025.db2.gz IBRRLGJRAYCAFI-IEBWSBKVSA-N 1 1 317.521 3.885 20 10 DHCDMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000917454806 1021270321 /nfs/dbraw/zinc/27/03/21/1021270321.db2.gz MUXHSDPYVAPCMX-CQSZACIVSA-N 1 1 313.397 3.922 20 10 DHCDMO CCN(CC)[C@@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743396326 1021281219 /nfs/dbraw/zinc/28/12/19/1021281219.db2.gz ZCPCIWOUHOEPEI-QGZVFWFLSA-N 1 1 318.505 3.914 20 10 DHCDMO CCN(CC)[C@@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743396326 1021281226 /nfs/dbraw/zinc/28/12/26/1021281226.db2.gz ZCPCIWOUHOEPEI-QGZVFWFLSA-N 1 1 318.505 3.914 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000850487314 1021560744 /nfs/dbraw/zinc/56/07/44/1021560744.db2.gz HJXGGKKARLAYEJ-SDBXPKJASA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000850487309 1021560924 /nfs/dbraw/zinc/56/09/24/1021560924.db2.gz HJXGGKKARLAYEJ-ISVAXAHUSA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1O ZINC000850523704 1021577966 /nfs/dbraw/zinc/57/79/66/1021577966.db2.gz NWKSDKBUTWQPHQ-QWRGUYRKSA-N 1 1 315.335 3.773 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(COC)cs1)c1ccc(F)cc1O ZINC000850533260 1021586720 /nfs/dbraw/zinc/58/67/20/1021586720.db2.gz UGNCUOCQBMVDNF-HNNXBMFYSA-N 1 1 309.406 3.980 20 10 DHCDMO CC(F)(F)C(C)(C)C[NH2+]Cc1cccc(Br)c1O ZINC000699971143 1021616484 /nfs/dbraw/zinc/61/64/84/1021616484.db2.gz RBFHAUFRBVFJDP-UHFFFAOYSA-N 1 1 322.193 3.926 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC000850538569 1021593485 /nfs/dbraw/zinc/59/34/85/1021593485.db2.gz IBQHCBHLEAAMGO-HZPDHXFCSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC000850538569 1021593498 /nfs/dbraw/zinc/59/34/98/1021593498.db2.gz IBQHCBHLEAAMGO-HZPDHXFCSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1cc(F)cc(F)c1O ZINC000850549781 1021597857 /nfs/dbraw/zinc/59/78/57/1021597857.db2.gz JWEZJPLQZCOALN-JTQLQIEISA-N 1 1 321.371 3.522 20 10 DHCDMO C[C@@H]([NH2+]CC1SCCS1)c1cccc(C(F)(F)F)c1O ZINC000850561552 1021605951 /nfs/dbraw/zinc/60/59/51/1021605951.db2.gz PACCXNLMRJDWHV-MRVPVSSYSA-N 1 1 323.405 3.868 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1O ZINC000314033476 1021697573 /nfs/dbraw/zinc/69/75/73/1021697573.db2.gz ONNTWQRAFRAFIB-LBPRGKRZSA-N 1 1 303.324 3.564 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1cc2c(cc1O)CCCC2)c1nccs1 ZINC000182837111 1021819079 /nfs/dbraw/zinc/81/90/79/1021819079.db2.gz UDMBNWQETZNGRH-CYBMUJFWSA-N 1 1 316.470 3.963 20 10 DHCDMO CC(C)[N@H+](Cc1cc2c(cc1O)OCO2)Cc1ccccc1F ZINC000746032691 1021832590 /nfs/dbraw/zinc/83/25/90/1021832590.db2.gz GISJQOPPYSFPFV-UHFFFAOYSA-N 1 1 317.360 3.671 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccccc1F)C[C@H]1CCCO1 ZINC000070976070 1021995325 /nfs/dbraw/zinc/99/53/25/1021995325.db2.gz OPBLRBKIZABCHM-QGZVFWFLSA-N 1 1 315.388 3.713 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(C3CC3)s2)cc1 ZINC000155193960 1022059508 /nfs/dbraw/zinc/05/95/08/1022059508.db2.gz UJOKAHRAKQIYSM-UHFFFAOYSA-N 1 1 301.459 3.719 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)ccc1N(C)C ZINC000852596352 1022148318 /nfs/dbraw/zinc/14/83/18/1022148318.db2.gz LFCJBAFWWOUNDB-AZUAARDMSA-N 1 1 316.489 3.842 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1[O-] ZINC000853239125 1022239595 /nfs/dbraw/zinc/23/95/95/1022239595.db2.gz AKDOHSUEZDQAOY-UKRRQHHQSA-N 1 1 322.880 3.818 20 10 DHCDMO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(F)cc1O ZINC000853242965 1022242404 /nfs/dbraw/zinc/24/24/04/1022242404.db2.gz URXUPNOFNZIQEC-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@]12COC[C@@H]1C[N@@H+](Cc1cc3oc4ccccc4c3cc1O)C2 ZINC000853565736 1022294808 /nfs/dbraw/zinc/29/48/08/1022294808.db2.gz JKCUOXVKCTUULR-XOBRGWDASA-N 1 1 323.392 3.760 20 10 DHCDMO CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000185227920 1022468806 /nfs/dbraw/zinc/46/88/06/1022468806.db2.gz LAJGYRSYKBLWLK-CJNGLKHVSA-N 1 1 320.408 3.858 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2ccccc2N2CCCC2)c1O ZINC000179615497 1022493186 /nfs/dbraw/zinc/49/31/86/1022493186.db2.gz MVPSVSFVOVUFEM-UHFFFAOYSA-N 1 1 310.441 3.933 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC001169753950 1022530571 /nfs/dbraw/zinc/53/05/71/1022530571.db2.gz DZEPVAMZFZZSPS-AYBZRNKSSA-N 1 1 303.446 3.952 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c([O-])ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022782 1022564295 /nfs/dbraw/zinc/56/42/95/1022564295.db2.gz CTEDRHYTSAZBIT-MNOVXSKESA-N 1 1 317.260 3.506 20 10 DHCDMO Cc1cccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1O ZINC000180197005 1022659548 /nfs/dbraw/zinc/65/95/48/1022659548.db2.gz COPWKSNBCSFFEG-LJQANCHMSA-N 1 1 324.468 3.655 20 10 DHCDMO Cc1cccc(C[N@H+](C)C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000180197005 1022659567 /nfs/dbraw/zinc/65/95/67/1022659567.db2.gz COPWKSNBCSFFEG-LJQANCHMSA-N 1 1 324.468 3.655 20 10 DHCDMO Cc1cccc(C[N@@H+](C)C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000180197005 1022659572 /nfs/dbraw/zinc/65/95/72/1022659572.db2.gz COPWKSNBCSFFEG-LJQANCHMSA-N 1 1 324.468 3.655 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC[C@H]2CC2(F)F)c1 ZINC000856802497 1022872872 /nfs/dbraw/zinc/87/28/72/1022872872.db2.gz IPEWLISTFOXESA-JTQLQIEISA-N 1 1 320.177 3.598 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cscn1 ZINC000768098594 1022882906 /nfs/dbraw/zinc/88/29/06/1022882906.db2.gz KTHZINKVQGKWJP-CQSZACIVSA-N 1 1 301.459 3.984 20 10 DHCDMO Nc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)s1 ZINC000768134891 1022902108 /nfs/dbraw/zinc/90/21/08/1022902108.db2.gz XBBUBJHMLSNKFE-UHFFFAOYSA-N 1 1 317.458 3.766 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(OCC)cc2O)cc1 ZINC000768163879 1022907092 /nfs/dbraw/zinc/90/70/92/1022907092.db2.gz SQAPSRHOAAVJFL-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCc3sccc3[C@@H]2C)c(O)c1 ZINC000768211441 1022924613 /nfs/dbraw/zinc/92/46/13/1022924613.db2.gz YFZZYNPZHBDLRX-LBPRGKRZSA-N 1 1 303.427 3.972 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000768235644 1022931150 /nfs/dbraw/zinc/93/11/50/1022931150.db2.gz BUQNUWFKTWSZCO-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000768235644 1022931156 /nfs/dbraw/zinc/93/11/56/1022931156.db2.gz BUQNUWFKTWSZCO-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc3c[nH]nc3c2)C2CC2)cc1 ZINC000768258138 1022935352 /nfs/dbraw/zinc/93/53/52/1022935352.db2.gz QASJOLMBFPYLKL-UHFFFAOYSA-N 1 1 320.440 3.794 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCC=CO1 ZINC000191057044 1022945702 /nfs/dbraw/zinc/94/57/02/1022945702.db2.gz MTWNMULGWMSVNS-LJQANCHMSA-N 1 1 300.446 3.801 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](CC)Cc2ccc(OC)cc2)c1 ZINC000768333652 1022947663 /nfs/dbraw/zinc/94/76/63/1022947663.db2.gz FSCGYYCUPQJGCW-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000768317130 1022950449 /nfs/dbraw/zinc/95/04/49/1022950449.db2.gz FFEUOQXZUOIFEJ-QGZVFWFLSA-N 1 1 320.452 3.673 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2)c(O)cc1C ZINC000768437829 1022965258 /nfs/dbraw/zinc/96/52/58/1022965258.db2.gz JZKYKXSXOTVVFA-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1cc(C[N@H+]2CCc3sccc3[C@H]2C)c(O)cc1C ZINC000768441459 1022967926 /nfs/dbraw/zinc/96/79/26/1022967926.db2.gz IZSUPZPFLJBGCS-GFCCVEGCSA-N 1 1 303.427 3.890 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2CC(C)(C)C)cc1OC ZINC000768446477 1022968703 /nfs/dbraw/zinc/96/87/03/1022968703.db2.gz YBAUGSLTNMETBD-CQSZACIVSA-N 1 1 307.434 3.810 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@]3(CCCOC3)C1)CCCC2 ZINC000768463366 1022973006 /nfs/dbraw/zinc/97/30/06/1022973006.db2.gz HNEIMFCGJFXHSA-FQEVSTJZSA-N 1 1 315.457 3.664 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCS1 ZINC000191671412 1022977591 /nfs/dbraw/zinc/97/75/91/1022977591.db2.gz WBZZYFCNHOYKNB-GFCCVEGCSA-N 1 1 309.475 3.723 20 10 DHCDMO COCC[N@@H+](Cc1c(O)cccc1OC)[C@@H](C)c1ccccc1 ZINC000768595947 1022997365 /nfs/dbraw/zinc/99/73/65/1022997365.db2.gz JNLWDRBHKUQPAT-HNNXBMFYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000768772335 1023024380 /nfs/dbraw/zinc/02/43/80/1023024380.db2.gz ZHCDHUFNHFDCJQ-SNVBAGLBSA-N 1 1 316.239 3.641 20 10 DHCDMO C[N@@H+](Cc1cnc(-c2ccncc2)s1)Cc1ccccc1O ZINC000768872952 1023045583 /nfs/dbraw/zinc/04/55/83/1023045583.db2.gz MPKQDMGRFZTRKG-UHFFFAOYSA-N 1 1 311.410 3.543 20 10 DHCDMO CC(C)[N@H+](C)CC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000768927152 1023058389 /nfs/dbraw/zinc/05/83/89/1023058389.db2.gz QGWNFJZJYGEKSU-UHFFFAOYSA-N 1 1 310.869 3.598 20 10 DHCDMO CC(C)[N@@H+](C)CC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000768927152 1023058392 /nfs/dbraw/zinc/05/83/92/1023058392.db2.gz QGWNFJZJYGEKSU-UHFFFAOYSA-N 1 1 310.869 3.598 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCOc3ccccc3[C@H]2C)c1O ZINC000768929703 1023060093 /nfs/dbraw/zinc/06/00/93/1023060093.db2.gz JYGDGMWTCWPDOE-CQSZACIVSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C[C@@H]2CCOC2)C2CC2)cc1C(C)C ZINC000123776515 1023067464 /nfs/dbraw/zinc/06/74/64/1023067464.db2.gz SUWOUUDLYAUACA-HNNXBMFYSA-N 1 1 303.446 3.825 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c1O ZINC000768993016 1023067508 /nfs/dbraw/zinc/06/75/08/1023067508.db2.gz TYTSVACTNRQQON-KRWDZBQOSA-N 1 1 315.388 3.747 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1F ZINC000769106721 1023084856 /nfs/dbraw/zinc/08/48/56/1023084856.db2.gz WOTQPJILHBKRTH-GOSISDBHSA-N 1 1 314.404 3.934 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)C[C@@H](c2ccccc2)O1 ZINC000769102997 1023090844 /nfs/dbraw/zinc/09/08/44/1023090844.db2.gz RNSFRKPJWHFSKN-UZLBHIALSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3)C2)cc1 ZINC000769244246 1023107024 /nfs/dbraw/zinc/10/70/24/1023107024.db2.gz MPKLCYJFFWCQGR-SFHVURJKSA-N 1 1 310.441 3.751 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000769327931 1023122948 /nfs/dbraw/zinc/12/29/48/1023122948.db2.gz OHXAGXMSJPWQPU-UHFFFAOYSA-N 1 1 307.397 3.626 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000769327931 1023122955 /nfs/dbraw/zinc/12/29/55/1023122955.db2.gz OHXAGXMSJPWQPU-UHFFFAOYSA-N 1 1 307.397 3.626 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1O ZINC000769379229 1023135438 /nfs/dbraw/zinc/13/54/38/1023135438.db2.gz LHUKSGBIDYBCLM-CQSZACIVSA-N 1 1 315.388 3.920 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000769403923 1023140763 /nfs/dbraw/zinc/14/07/63/1023140763.db2.gz KBWWJGICMXVNCG-CQSZACIVSA-N 1 1 318.442 3.675 20 10 DHCDMO CC[N@H+](Cc1cc(Cl)ccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000769481965 1023152100 /nfs/dbraw/zinc/15/21/00/1023152100.db2.gz DHSACEVCRIOZME-GOSISDBHSA-N 1 1 319.832 3.910 20 10 DHCDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000769487095 1023152337 /nfs/dbraw/zinc/15/23/37/1023152337.db2.gz HOFLEZAHEXHFFM-MRXNPFEDSA-N 1 1 313.397 3.574 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000769469729 1023162051 /nfs/dbraw/zinc/16/20/51/1023162051.db2.gz DMSSHEGBQUAJHI-GUDVDZBRSA-N 1 1 316.489 3.778 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000769476202 1023165223 /nfs/dbraw/zinc/16/52/23/1023165223.db2.gz XGPFVDWQJAFVCE-OXJNMPFZSA-N 1 1 311.425 3.971 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000769513563 1023172274 /nfs/dbraw/zinc/17/22/74/1023172274.db2.gz BQWFNCJLJWPRGI-OALUTQOASA-N 1 1 323.436 3.918 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1 ZINC000769557739 1023179521 /nfs/dbraw/zinc/17/95/21/1023179521.db2.gz ADSJTLRTYLRCER-ZDUSSCGKSA-N 1 1 303.352 3.968 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2[C@@H]3CC[C@H]2CN(CC)CC3)cc1 ZINC000770285927 1023291168 /nfs/dbraw/zinc/29/11/68/1023291168.db2.gz MEQJRHLSUNJLPP-UXHICEINSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(CN2[C@@H]3CC[C@H]2C[N@H+](CC)CC3)cc1 ZINC000770285927 1023291173 /nfs/dbraw/zinc/29/11/73/1023291173.db2.gz MEQJRHLSUNJLPP-UXHICEINSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(CN2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)cc1 ZINC000770285927 1023291178 /nfs/dbraw/zinc/29/11/78/1023291178.db2.gz MEQJRHLSUNJLPP-UXHICEINSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1)CC2 ZINC000770383419 1023302137 /nfs/dbraw/zinc/30/21/37/1023302137.db2.gz VFQULSLSMIGESL-UHFFFAOYSA-N 1 1 322.452 3.556 20 10 DHCDMO CCOc1cccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1O ZINC000770354169 1023304647 /nfs/dbraw/zinc/30/46/47/1023304647.db2.gz FDUDKKYJIZZRDQ-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1O ZINC000770354169 1023304659 /nfs/dbraw/zinc/30/46/59/1023304659.db2.gz FDUDKKYJIZZRDQ-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2Cc3cccc(Br)c3C2)c1 ZINC000770664932 1023336289 /nfs/dbraw/zinc/33/62/89/1023336289.db2.gz XGEAFMQKODLIAH-UHFFFAOYSA-N 1 1 318.214 3.979 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2Cc3cccc(Br)c3C2)c1 ZINC000770664932 1023336296 /nfs/dbraw/zinc/33/62/96/1023336296.db2.gz XGEAFMQKODLIAH-UHFFFAOYSA-N 1 1 318.214 3.979 20 10 DHCDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000785990248 1023648677 /nfs/dbraw/zinc/64/86/77/1023648677.db2.gz ZYVZEUSUWVPKRL-FUHIMQAGSA-N 1 1 316.489 3.658 20 10 DHCDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000093558525 1023773679 /nfs/dbraw/zinc/77/36/79/1023773679.db2.gz QBXPNAXBVSKBRY-JTQLQIEISA-N 1 1 318.280 3.728 20 10 DHCDMO COC(C)(C)CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000787260160 1023777292 /nfs/dbraw/zinc/77/72/92/1023777292.db2.gz NJSDUCREDPQGHV-UHFFFAOYSA-N 1 1 303.402 3.803 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(F)cn1 ZINC000787260812 1023777840 /nfs/dbraw/zinc/77/78/40/1023777840.db2.gz QSMYYCFXMAMOIY-UHFFFAOYSA-N 1 1 312.344 3.722 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(F)cn1 ZINC000787260812 1023777846 /nfs/dbraw/zinc/77/78/46/1023777846.db2.gz QSMYYCFXMAMOIY-UHFFFAOYSA-N 1 1 312.344 3.722 20 10 DHCDMO CCCN(CC)CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788610589 1023908322 /nfs/dbraw/zinc/90/83/22/1023908322.db2.gz LFQYFCAVWHPJRT-LBPRGKRZSA-N 1 1 318.383 3.794 20 10 DHCDMO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788589855 1023910013 /nfs/dbraw/zinc/91/00/13/1023910013.db2.gz DFHSIDUTVSIUBB-PGUXBMHVSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cccc(C(F)(F)F)c1O ZINC000788615107 1023914164 /nfs/dbraw/zinc/91/41/64/1023914164.db2.gz VAUFGRDIAMLESF-VHSXEESVSA-N 1 1 313.323 3.556 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788629355 1023916380 /nfs/dbraw/zinc/91/63/80/1023916380.db2.gz APKRIKAKALAZFM-UTUOFQBUSA-N 1 1 317.351 3.877 20 10 DHCDMO CCN(CC)[C@H](C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788808650 1023936230 /nfs/dbraw/zinc/93/62/30/1023936230.db2.gz YQCLBNLKADUDHJ-VXGBXAGGSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508371 1024162660 /nfs/dbraw/zinc/16/26/60/1024162660.db2.gz ZWZUKRKGZRJANU-GJZGRUSLSA-N 1 1 310.441 3.680 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508371 1024162663 /nfs/dbraw/zinc/16/26/63/1024162663.db2.gz ZWZUKRKGZRJANU-GJZGRUSLSA-N 1 1 310.441 3.680 20 10 DHCDMO CC[C@](C)([NH2+]Cc1cc(F)cc(F)c1O)c1nc(C)cs1 ZINC000883017776 1024213254 /nfs/dbraw/zinc/21/32/54/1024213254.db2.gz APXCSDURBLEYKS-HNNXBMFYSA-N 1 1 312.385 3.850 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1[N+](=O)[O-] ZINC000883029601 1024215841 /nfs/dbraw/zinc/21/58/41/1024215841.db2.gz ZURWIANDGHPWNS-JTQLQIEISA-N 1 1 322.311 3.738 20 10 DHCDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000130916795 1024228059 /nfs/dbraw/zinc/22/80/59/1024228059.db2.gz MOHOJMFJWGFQBU-AWEZNQCLSA-N 1 1 309.475 3.723 20 10 DHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000131021908 1024247237 /nfs/dbraw/zinc/24/72/37/1024247237.db2.gz KZRUBLAAGLUGAG-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO Cc1cc([O-])c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927632 1033203353 /nfs/dbraw/zinc/20/33/53/1033203353.db2.gz GWPHRJMJQNYORG-OAHLLOKOSA-N 1 1 322.880 3.518 20 10 DHCDMO Cc1cc([O-])c(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927632 1033203359 /nfs/dbraw/zinc/20/33/59/1033203359.db2.gz GWPHRJMJQNYORG-OAHLLOKOSA-N 1 1 322.880 3.518 20 10 DHCDMO CO[C@H]1C[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000883272056 1024341174 /nfs/dbraw/zinc/34/11/74/1024341174.db2.gz CGTHWECXWOSQOW-GUBZILKMSA-N 1 1 304.217 3.775 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)c(Cl)n1 ZINC000883301906 1024357815 /nfs/dbraw/zinc/35/78/15/1024357815.db2.gz LNOXQXMLWCPJKX-SECBINFHSA-N 1 1 312.747 3.878 20 10 DHCDMO CC[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Cl)ccc1O ZINC000883311448 1024363409 /nfs/dbraw/zinc/36/34/09/1024363409.db2.gz AFAGNDHYPGKMAO-CQSZACIVSA-N 1 1 317.820 3.956 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]C2(c3ncccn3)CCC2)c1O ZINC000883311787 1024364150 /nfs/dbraw/zinc/36/41/50/1024364150.db2.gz KYZFINMKVIPKJZ-GFCCVEGCSA-N 1 1 317.820 3.874 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000790748196 1024368171 /nfs/dbraw/zinc/36/81/71/1024368171.db2.gz KZPZEZUHXVWSQF-ZDUSSCGKSA-N 1 1 310.869 3.818 20 10 DHCDMO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790959052 1024406506 /nfs/dbraw/zinc/40/65/06/1024406506.db2.gz DMDGOSARWRSQCM-ZDUSSCGKSA-N 1 1 307.752 3.667 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1OCCc2ccccc21 ZINC000790959007 1024406896 /nfs/dbraw/zinc/40/68/96/1024406896.db2.gz SJUWSIKFGHSTLD-MRXNPFEDSA-N 1 1 321.779 3.588 20 10 DHCDMO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790989250 1024411543 /nfs/dbraw/zinc/41/15/43/1024411543.db2.gz AJUNFIXJMRVGNQ-ZFWWWQNUSA-N 1 1 315.816 3.868 20 10 DHCDMO CC(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790972104 1024420321 /nfs/dbraw/zinc/42/03/21/1024420321.db2.gz DDHAYMRHJXEPNX-BDJLRTHQSA-N 1 1 315.816 3.726 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@@H]2OCCC[C@@H]12)c1cc(Cl)c(Cl)cc1O ZINC000373206279 1024620379 /nfs/dbraw/zinc/62/03/79/1024620379.db2.gz AQPSABRAPIRTSU-JCTPYMPQSA-N 1 1 316.228 3.917 20 10 DHCDMO C[N@H+](CCOCc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792170116 1024640727 /nfs/dbraw/zinc/64/07/27/1024640727.db2.gz PJMPUMFSEIIJNF-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO C[N@@H+](CCOCc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792170116 1024640737 /nfs/dbraw/zinc/64/07/37/1024640737.db2.gz PJMPUMFSEIIJNF-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792167408 1024641382 /nfs/dbraw/zinc/64/13/82/1024641382.db2.gz HZTRLUGSJSYCDO-NSHDSACASA-N 1 1 323.795 3.953 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792167408 1024641384 /nfs/dbraw/zinc/64/13/84/1024641384.db2.gz HZTRLUGSJSYCDO-NSHDSACASA-N 1 1 323.795 3.953 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](C(C)C)N1CCCC1)c1ccc(F)cc1O ZINC000796696000 1024657306 /nfs/dbraw/zinc/65/73/06/1024657306.db2.gz PCIGWUOBKRVTOR-IRXDYDNUSA-N 1 1 308.441 3.692 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000689884961 1024696406 /nfs/dbraw/zinc/69/64/06/1024696406.db2.gz YEXPAWWJPFGTBO-LLVKDONJSA-N 1 1 316.214 3.726 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000793230319 1024943545 /nfs/dbraw/zinc/94/35/45/1024943545.db2.gz FWRFTDCKBHHVJN-GWCFXTLKSA-N 1 1 303.324 3.564 20 10 DHCDMO CCC[N@@H+](Cc1c(O)c(C(=O)OC)cc2ccccc21)C1CC1 ZINC000728902077 1024944256 /nfs/dbraw/zinc/94/42/56/1024944256.db2.gz CWSMHBGTBLJGIA-UHFFFAOYSA-N 1 1 313.397 3.706 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)cc1 ZINC000793619663 1025134122 /nfs/dbraw/zinc/13/41/22/1025134122.db2.gz JPXFEBRWCXJHBU-LJQANCHMSA-N 1 1 302.462 3.535 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769278 1025159476 /nfs/dbraw/zinc/15/94/76/1025159476.db2.gz UFWHHEPMJNXRJN-FQEVSTJZSA-N 1 1 316.489 3.526 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769278 1025159504 /nfs/dbraw/zinc/15/95/04/1025159504.db2.gz UFWHHEPMJNXRJN-FQEVSTJZSA-N 1 1 316.489 3.526 20 10 DHCDMO Cc1ccc2nc(C[N@H+]3CCc4cccc(O)c4C3)ccc2c1 ZINC001137217403 1025280478 /nfs/dbraw/zinc/28/04/78/1025280478.db2.gz WDBYFDNBAYOHKF-UHFFFAOYSA-N 1 1 304.393 3.807 20 10 DHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886496724 1025655209 /nfs/dbraw/zinc/65/52/09/1025655209.db2.gz FQJDXDCCYRXEGP-NWDGAFQWSA-N 1 1 316.376 3.902 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1c(O)cccc1F ZINC000886502834 1025657658 /nfs/dbraw/zinc/65/76/58/1025657658.db2.gz QCBGVQOYFMQRRK-AWEZNQCLSA-N 1 1 314.404 3.982 20 10 DHCDMO C[N@@H+](CCOC1CCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000805731314 1025668916 /nfs/dbraw/zinc/66/89/16/1025668916.db2.gz CUEIROSJQZPOMH-UHFFFAOYSA-N 1 1 302.462 3.678 20 10 DHCDMO COCc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccc1F ZINC000886530639 1025680578 /nfs/dbraw/zinc/68/05/78/1025680578.db2.gz OBQKZXBWOWHLTF-NSHDSACASA-N 1 1 307.340 3.668 20 10 DHCDMO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1c(O)cccc1F ZINC000886530243 1025681313 /nfs/dbraw/zinc/68/13/13/1025681313.db2.gz GWKYOFAHIAHHMN-XJKSGUPXSA-N 1 1 303.377 3.696 20 10 DHCDMO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886542978 1025689226 /nfs/dbraw/zinc/68/92/26/1025689226.db2.gz ITMYBZHDPDREDI-IGCXYCKISA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886543778 1025691728 /nfs/dbraw/zinc/69/17/28/1025691728.db2.gz VIQYUOABLZJBCE-BWACUDIHSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc([S@@](C)=O)cc1 ZINC000886557204 1025703975 /nfs/dbraw/zinc/70/39/75/1025703975.db2.gz WAJFEHNZIJFFRL-YEZLUTFDSA-N 1 1 321.417 3.681 20 10 DHCDMO C[N@@H+](CCc1ccccn1)Cc1ccc(N2CCCCC2)cc1 ZINC000071004794 1025706181 /nfs/dbraw/zinc/70/61/81/1025706181.db2.gz MCWGKMNLEPXHLZ-UHFFFAOYSA-N 1 1 309.457 3.746 20 10 DHCDMO C[C@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1c(O)cccc1F ZINC000886561989 1025711296 /nfs/dbraw/zinc/71/12/96/1025711296.db2.gz ODIRJMDWYILMGO-LBPRGKRZSA-N 1 1 311.397 3.694 20 10 DHCDMO COc1ccc(C2([NH2+][C@@H](C)c3c(O)cccc3F)CC2)cc1 ZINC000886572071 1025712169 /nfs/dbraw/zinc/71/21/69/1025712169.db2.gz WFMVUUMNWWUVGZ-LBPRGKRZSA-N 1 1 301.361 3.880 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1c(O)cccc1F ZINC000886597084 1025731250 /nfs/dbraw/zinc/73/12/50/1025731250.db2.gz VXIPSANVUWPRDJ-IINYFYTJSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886646280 1025756936 /nfs/dbraw/zinc/75/69/36/1025756936.db2.gz DMZSHCTVGARWCP-CJNGLKHVSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000248647128 1025984880 /nfs/dbraw/zinc/98/48/80/1025984880.db2.gz SRUHQWDJMTUSRB-CKFHNAJUSA-N 1 1 316.420 3.873 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)c(O)c1 ZINC000289914950 1026231293 /nfs/dbraw/zinc/23/12/93/1026231293.db2.gz VGDPVULMWOTHLK-SFHVURJKSA-N 1 1 312.413 3.913 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)c1O ZINC000808677013 1026355585 /nfs/dbraw/zinc/35/55/85/1026355585.db2.gz OJTQJXRNPUXSGM-APHBMKBZSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1O ZINC000808677013 1026355591 /nfs/dbraw/zinc/35/55/91/1026355591.db2.gz OJTQJXRNPUXSGM-APHBMKBZSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n[nH]1 ZINC000808706209 1026358489 /nfs/dbraw/zinc/35/84/89/1026358489.db2.gz FFJYXIHSBIFWRA-ZYHUDNBSSA-N 1 1 307.825 3.667 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000178864426 1026433651 /nfs/dbraw/zinc/43/36/51/1026433651.db2.gz FRDDTRMKVCASDR-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000178864426 1026433662 /nfs/dbraw/zinc/43/36/62/1026433662.db2.gz FRDDTRMKVCASDR-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2c[nH]c(-c3ccccc3)n2)cc1 ZINC000178864426 1026433668 /nfs/dbraw/zinc/43/36/68/1026433668.db2.gz FRDDTRMKVCASDR-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c[nH]c(-c3ccccc3)n2)cc1 ZINC000178864426 1026433675 /nfs/dbraw/zinc/43/36/75/1026433675.db2.gz FRDDTRMKVCASDR-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1O ZINC000809693045 1026585840 /nfs/dbraw/zinc/58/58/40/1026585840.db2.gz MTRJPTCNGYYRGJ-OAHLLOKOSA-N 1 1 305.809 3.804 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1O ZINC000809693045 1026585847 /nfs/dbraw/zinc/58/58/47/1026585847.db2.gz MTRJPTCNGYYRGJ-OAHLLOKOSA-N 1 1 305.809 3.804 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1O ZINC000809701179 1026589051 /nfs/dbraw/zinc/58/90/51/1026589051.db2.gz VESDYJMAEZVSNW-CZUORRHYSA-N 1 1 311.853 3.870 20 10 DHCDMO CN(CCC[N@@H+](C)Cc1cc(Cl)ccc1O)Cc1ccco1 ZINC000809718865 1026603570 /nfs/dbraw/zinc/60/35/70/1026603570.db2.gz QLRGPDICIFXFOJ-UHFFFAOYSA-N 1 1 322.836 3.593 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CCCC3)[C@@H]2C)cc1 ZINC000809724583 1026603730 /nfs/dbraw/zinc/60/37/30/1026603730.db2.gz QJSQAQMGIPDYHX-PXNSSMCTSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](N3CCCC3)[C@@H]2C)cc1 ZINC000809724583 1026603733 /nfs/dbraw/zinc/60/37/33/1026603733.db2.gz QJSQAQMGIPDYHX-PXNSSMCTSA-N 1 1 315.505 3.591 20 10 DHCDMO CN(C)CC[N@H+](Cc1cccc(Cl)c1)Cc1ccccc1O ZINC000809737218 1026609820 /nfs/dbraw/zinc/60/98/20/1026609820.db2.gz RHULOCKGZARTOQ-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO CN(C)CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccccc1O ZINC000809737218 1026609824 /nfs/dbraw/zinc/60/98/24/1026609824.db2.gz RHULOCKGZARTOQ-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000809755574 1026616854 /nfs/dbraw/zinc/61/68/54/1026616854.db2.gz LCNKCJYFRZTILX-UHFFFAOYSA-N 1 1 321.852 3.717 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000809758178 1026618281 /nfs/dbraw/zinc/61/82/81/1026618281.db2.gz FQUFZDJKFJHNDP-ZIAGYGMSSA-N 1 1 309.837 3.684 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000809782762 1026623629 /nfs/dbraw/zinc/62/36/29/1026623629.db2.gz GPESCSAJPKESIL-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000809782762 1026623633 /nfs/dbraw/zinc/62/36/33/1026623633.db2.gz GPESCSAJPKESIL-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1cc(OC)ccc1O ZINC000809784390 1026624209 /nfs/dbraw/zinc/62/42/09/1026624209.db2.gz UMEZUMJPBGMDSG-GOSISDBHSA-N 1 1 315.413 3.993 20 10 DHCDMO COc1cccc(C2(C[NH2+][C@@H](C)c3ccc(F)cc3O)CC2)c1 ZINC000810242409 1026726890 /nfs/dbraw/zinc/72/68/90/1026726890.db2.gz QMYMAZLSZSGRQY-ZDUSSCGKSA-N 1 1 315.388 3.922 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1O ZINC000811518438 1027019539 /nfs/dbraw/zinc/01/95/39/1027019539.db2.gz KMHUVLYLQLKKHI-NVXWUHKLSA-N 1 1 321.848 3.888 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@H]1CCOC(C)(C)C1 ZINC000811511664 1027025982 /nfs/dbraw/zinc/02/59/82/1027025982.db2.gz QHMDNVACJWHNFF-HNNXBMFYSA-N 1 1 308.441 3.671 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)[C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000811511906 1027026613 /nfs/dbraw/zinc/02/66/13/1027026613.db2.gz XGJRFWZTUVTSPD-HNNXBMFYSA-N 1 1 307.434 3.570 20 10 DHCDMO Cc1cccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1O ZINC000811508507 1027027307 /nfs/dbraw/zinc/02/73/07/1027027307.db2.gz UGWLEBWYHSCXSQ-SFHVURJKSA-N 1 1 308.425 3.685 20 10 DHCDMO CC[N@@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccc(N(C)C)cc1 ZINC000156851014 1027180348 /nfs/dbraw/zinc/18/03/48/1027180348.db2.gz DJLJAEVSHDFQMM-UHFFFAOYSA-N 1 1 314.477 3.726 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1cc(C)c(C)cc1O ZINC000812345742 1027257457 /nfs/dbraw/zinc/25/74/57/1027257457.db2.gz MBLVWEZPUHNAMZ-UHFFFAOYSA-N 1 1 314.429 3.985 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1 ZINC000812840008 1027440614 /nfs/dbraw/zinc/44/06/14/1027440614.db2.gz FHERIZOHDBNQJE-VAMGGRTRSA-N 1 1 316.489 3.658 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000779002754 1027750826 /nfs/dbraw/zinc/75/08/26/1027750826.db2.gz NUQBYWDSJGHHKI-PKOBYXMFSA-N 1 1 315.388 3.619 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1noc(-c2ccccc2)n1 ZINC000296986513 1027770795 /nfs/dbraw/zinc/77/07/95/1027770795.db2.gz SDGNWKQZRQXKCM-IUODEOHRSA-N 1 1 321.380 3.780 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)c1O ZINC000814178422 1027915455 /nfs/dbraw/zinc/91/54/55/1027915455.db2.gz PHXYMUIOBXKQNA-HNNXBMFYSA-N 1 1 314.404 3.550 20 10 DHCDMO C[C@H](Nc1[nH+]c2ccc(F)cc2n1C)c1ccc(N(C)C)cc1 ZINC000814259438 1027974764 /nfs/dbraw/zinc/97/47/64/1027974764.db2.gz NUPWPNVPMUCLMG-LBPRGKRZSA-N 1 1 312.392 3.952 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1ccc(F)cc1O ZINC000527953267 1027988038 /nfs/dbraw/zinc/98/80/38/1027988038.db2.gz VUDDYGGLBMFEML-BBRMVZONSA-N 1 1 306.425 3.589 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc(OC(F)F)c2)cc1 ZINC000747966253 1028142897 /nfs/dbraw/zinc/14/28/97/1028142897.db2.gz VZENTCLAJNGDPJ-UHFFFAOYSA-N 1 1 320.383 3.986 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000367378816 1028176039 /nfs/dbraw/zinc/17/60/39/1028176039.db2.gz VDFCVDUQJHECLZ-KSSFIOAISA-N 1 1 313.397 3.535 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000367378816 1028176042 /nfs/dbraw/zinc/17/60/42/1028176042.db2.gz VDFCVDUQJHECLZ-KSSFIOAISA-N 1 1 313.397 3.535 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2C2CCCC2)cc1OC ZINC000159915203 1028316225 /nfs/dbraw/zinc/31/62/25/1028316225.db2.gz AODBFQJHIJDEJX-HNNXBMFYSA-N 1 1 305.418 3.564 20 10 DHCDMO Cc1cc(CN2CCC[N@H+](C3CCCC3)CC2)ccc1N(C)C ZINC000815052436 1028332824 /nfs/dbraw/zinc/33/28/24/1028332824.db2.gz OMGFOAKYTIYVTM-UHFFFAOYSA-N 1 1 315.505 3.511 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)ccc1N(C)C ZINC000815034486 1028340303 /nfs/dbraw/zinc/34/03/03/1028340303.db2.gz QMRCRBRBGYTWJP-NRFANRHFSA-N 1 1 324.468 3.807 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)ccc1N(C)C ZINC000815068692 1028348542 /nfs/dbraw/zinc/34/85/42/1028348542.db2.gz ZEWPJWOCAWLGDG-LJQANCHMSA-N 1 1 309.457 3.747 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)ccc1N(C)C ZINC000815089582 1028360156 /nfs/dbraw/zinc/36/01/56/1028360156.db2.gz DSGUMLZSHLLYOE-IBGZPJMESA-N 1 1 309.457 3.521 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2c(F)cncc2F)ccc1N(C)C ZINC000815118001 1028363289 /nfs/dbraw/zinc/36/32/89/1028363289.db2.gz WOWYMHWFAFAMIM-GFCCVEGCSA-N 1 1 305.372 3.585 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)ccc1N(C)C ZINC000815108803 1028382310 /nfs/dbraw/zinc/38/23/10/1028382310.db2.gz ODSZWXMTTRXXQS-TZMCWYRMSA-N 1 1 300.368 3.834 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000369878252 1028542410 /nfs/dbraw/zinc/54/24/10/1028542410.db2.gz OWVHLWKADCBOTI-HKUYNNGSSA-N 1 1 315.388 3.576 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](O)C1)c1cccc(C(F)(F)F)c1O ZINC000815582243 1028553609 /nfs/dbraw/zinc/55/36/09/1028553609.db2.gz AYKYIGTWFATLKE-QJPTWQEYSA-N 1 1 317.351 3.613 20 10 DHCDMO CCc1cc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)on1 ZINC000815582597 1028554150 /nfs/dbraw/zinc/55/41/50/1028554150.db2.gz KRHJFUJOWZDSHA-VIFPVBQESA-N 1 1 314.307 3.812 20 10 DHCDMO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815600673 1028563934 /nfs/dbraw/zinc/56/39/34/1028563934.db2.gz AYGZYZSOPFFWGH-MISXGVKJSA-N 1 1 317.351 3.877 20 10 DHCDMO Cc1cc(C)c([C@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(O)c1 ZINC000815616778 1028573070 /nfs/dbraw/zinc/57/30/70/1028573070.db2.gz XZRMKLPTFRLPFC-INIZCTEOSA-N 1 1 304.478 3.782 20 10 DHCDMO CC[C@H](c1ccccc1O)N1CCC([NH2+]C2CCCC2)CC1 ZINC000370211908 1028577654 /nfs/dbraw/zinc/57/76/54/1028577654.db2.gz FOUJCXPDJIYLMN-GOSISDBHSA-N 1 1 302.462 3.840 20 10 DHCDMO CO[C@](C)(C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815627669 1028579054 /nfs/dbraw/zinc/57/90/54/1028579054.db2.gz GHODWJVSPPVSPZ-ZUZCIYMTSA-N 1 1 317.351 3.877 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(C)on2)c(O)c1 ZINC000371395610 1028703128 /nfs/dbraw/zinc/70/31/28/1028703128.db2.gz IDOBFNSCYITCTG-QGZVFWFLSA-N 1 1 316.401 3.815 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2c2cc(C)on2)c(O)c1 ZINC000371395610 1028703139 /nfs/dbraw/zinc/70/31/39/1028703139.db2.gz IDOBFNSCYITCTG-QGZVFWFLSA-N 1 1 316.401 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)CCOc2ccccc2F)cc1C ZINC000748050816 1028777926 /nfs/dbraw/zinc/77/79/26/1028777926.db2.gz CQUBNHISXLSWMR-UHFFFAOYSA-N 1 1 303.377 3.659 20 10 DHCDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000190223631 1028843146 /nfs/dbraw/zinc/84/31/46/1028843146.db2.gz CHILPFHWJNXJHM-HXUWFJFHSA-N 1 1 316.489 3.661 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000816530049 1028922785 /nfs/dbraw/zinc/92/27/85/1028922785.db2.gz RFGRXCMMWSNBEC-GFCCVEGCSA-N 1 1 314.832 3.539 20 10 DHCDMO C[C@H](C[NH2+]Cc1ccc2ccccc2c1[O-])C[NH+]1CCCCC1 ZINC000816536566 1028924048 /nfs/dbraw/zinc/92/40/48/1028924048.db2.gz CSGMEEGTUCXRKF-MRXNPFEDSA-N 1 1 312.457 3.757 20 10 DHCDMO COc1cc(C)cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816558367 1028941275 /nfs/dbraw/zinc/94/12/75/1028941275.db2.gz VRAIFQOXCJXTPB-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@@H]1O ZINC000816560435 1028944443 /nfs/dbraw/zinc/94/44/43/1028944443.db2.gz OYDZUZWKHIPSQV-MSOLQXFVSA-N 1 1 313.441 3.774 20 10 DHCDMO Cc1ccc(NCc2cc(Cl)c(F)cc2O)c(N(C)C)[nH+]1 ZINC000816559872 1028944734 /nfs/dbraw/zinc/94/47/34/1028944734.db2.gz XYEDKURPIZUPFZ-UHFFFAOYSA-N 1 1 309.772 3.566 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)cn1 ZINC000816568826 1028949318 /nfs/dbraw/zinc/94/93/18/1028949318.db2.gz RCCZGWFTYUMORG-UHFFFAOYSA-N 1 1 308.381 3.581 20 10 DHCDMO COc1ccc(F)cc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816574629 1028952052 /nfs/dbraw/zinc/95/20/52/1028952052.db2.gz NWICZOUFPXAIQA-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](OCC3CC3)C2)ccc2ccccc21 ZINC000816574982 1028952976 /nfs/dbraw/zinc/95/29/76/1028952976.db2.gz YMQMAUJFEUDHGQ-SFHVURJKSA-N 1 1 311.425 3.936 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594756 1028955970 /nfs/dbraw/zinc/95/59/70/1028955970.db2.gz OGSDGCXSWYGKJE-VXNVDRBHSA-N 1 1 311.706 3.957 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594756 1028955986 /nfs/dbraw/zinc/95/59/86/1028955986.db2.gz OGSDGCXSWYGKJE-VXNVDRBHSA-N 1 1 311.706 3.957 20 10 DHCDMO Cc1cc(Cl)nc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816599697 1028956765 /nfs/dbraw/zinc/95/67/65/1028956765.db2.gz VINXITAIZSIPDL-UHFFFAOYSA-N 1 1 315.175 3.831 20 10 DHCDMO Cc1noc([C@H]2CCC[N@H+]2Cc2ccc3ccccc3c2O)n1 ZINC000816609859 1028958784 /nfs/dbraw/zinc/95/87/84/1028958784.db2.gz OXYHVVSMLDOAJG-MRXNPFEDSA-N 1 1 309.369 3.574 20 10 DHCDMO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2O)[C@@H]1[C@@H]1CCCO1 ZINC000816614085 1028965774 /nfs/dbraw/zinc/96/57/74/1028965774.db2.gz MIFPCLDBJVDPMG-PKOBYXMFSA-N 1 1 311.425 3.935 20 10 DHCDMO CC[C@H](NC1CC([NH+]2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000373524314 1029069232 /nfs/dbraw/zinc/06/92/32/1029069232.db2.gz RYQVXKCLXTXXRQ-UUKMXZOPSA-N 1 1 315.505 3.810 20 10 DHCDMO CC[C@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(N(C)C)cc1 ZINC000373524314 1029069245 /nfs/dbraw/zinc/06/92/45/1029069245.db2.gz RYQVXKCLXTXXRQ-UUKMXZOPSA-N 1 1 315.505 3.810 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000817366725 1029145978 /nfs/dbraw/zinc/14/59/78/1029145978.db2.gz YWVCTXBZCRZLBL-GFCCVEGCSA-N 1 1 317.351 3.874 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c(O)c1 ZINC000817412162 1029152544 /nfs/dbraw/zinc/15/25/44/1029152544.db2.gz FBFDHWSHHVPUCO-LBPRGKRZSA-N 1 1 317.351 3.955 20 10 DHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817940265 1029281108 /nfs/dbraw/zinc/28/11/08/1029281108.db2.gz FCYIJLZAFHMYEL-IAGOWNOFSA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc2ccccc2o1 ZINC000817938106 1029283567 /nfs/dbraw/zinc/28/35/67/1029283567.db2.gz DQVGICRXSVAHHB-KDOFPFPSSA-N 1 1 323.440 3.849 20 10 DHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817938473 1029284369 /nfs/dbraw/zinc/28/43/69/1029284369.db2.gz LDEDVBCNBZKDLJ-MOPGFXCFSA-N 1 1 315.436 3.632 20 10 DHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(Cl)c1 ZINC000817939105 1029284907 /nfs/dbraw/zinc/28/49/07/1029284907.db2.gz ZAVYWEXIJCDQDU-FZKQIMNGSA-N 1 1 317.864 3.757 20 10 DHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc2c(c1)CCC2 ZINC000817938628 1029285124 /nfs/dbraw/zinc/28/51/24/1029285124.db2.gz OPXQOPVOYHPBRW-BTYIYWSLSA-N 1 1 323.484 3.592 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000817967031 1029307883 /nfs/dbraw/zinc/30/78/83/1029307883.db2.gz CRJUUHFOUYBZHZ-PIGZYNQJSA-N 1 1 300.377 3.842 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](Cc2cccnc2)C2CC2)c1O ZINC000290609657 1030125636 /nfs/dbraw/zinc/12/56/36/1030125636.db2.gz WKXIBHORCOMYCJ-UHFFFAOYSA-N 1 1 318.804 3.614 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(Cl)cc1O ZINC000841759356 1030229062 /nfs/dbraw/zinc/22/90/62/1030229062.db2.gz YYISMYMESBFERS-NEPJUHHUSA-N 1 1 303.789 3.872 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(OC)no2)cc1F ZINC000925014388 1030246743 /nfs/dbraw/zinc/24/67/43/1030246743.db2.gz QDYIHLDANHRHAC-GFCCVEGCSA-N 1 1 321.396 3.519 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ccncc2F)cc1 ZINC000823391199 1030274950 /nfs/dbraw/zinc/27/49/50/1030274950.db2.gz UIBZXGGOBMPVRZ-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccncc2F)cc1 ZINC000823391199 1030274962 /nfs/dbraw/zinc/27/49/62/1030274962.db2.gz UIBZXGGOBMPVRZ-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCOC1)c1ccc(Cl)cc1O ZINC000866511963 1030338862 /nfs/dbraw/zinc/33/88/62/1030338862.db2.gz GUFJYPJVTLEAAH-PLQHRBFRSA-N 1 1 309.837 3.901 20 10 DHCDMO C[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCOC1)c1ccc(Cl)cc1O ZINC000866511964 1030339232 /nfs/dbraw/zinc/33/92/32/1030339232.db2.gz GUFJYPJVTLEAAH-PPHDSNJXSA-N 1 1 309.837 3.901 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000866513367 1030339716 /nfs/dbraw/zinc/33/97/16/1030339716.db2.gz VHOGCXUXHPMASF-SKDZVZGDSA-N 1 1 307.409 3.777 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)c1ccc(F)cc1O ZINC000866539722 1030360534 /nfs/dbraw/zinc/36/05/34/1030360534.db2.gz PUZZCQZWEHODNS-RRQGHBQHSA-N 1 1 307.409 3.635 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1O ZINC000866541381 1030362619 /nfs/dbraw/zinc/36/26/19/1030362619.db2.gz ZYEDOQBOJHHVAP-OAHLLOKOSA-N 1 1 318.348 3.989 20 10 DHCDMO Cc1ccc([C@H](C)[N@H+]2CCOc3ccc(N)cc3C2)c(O)c1C ZINC000925755164 1030482649 /nfs/dbraw/zinc/48/26/49/1030482649.db2.gz TXRXRGHVCBWEPB-AWEZNQCLSA-N 1 1 312.413 3.547 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(N)ccn1)c1ccc(N2CCCCCC2)cc1 ZINC000925770041 1030486466 /nfs/dbraw/zinc/48/64/66/1030486466.db2.gz FFNZQUWTLURBDZ-MRXNPFEDSA-N 1 1 324.472 3.895 20 10 DHCDMO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1c(O)cccc1Cl)CCC2 ZINC000824176350 1030492385 /nfs/dbraw/zinc/49/23/85/1030492385.db2.gz MVQHPIAVFNDDPQ-HNNXBMFYSA-N 1 1 319.836 3.990 20 10 DHCDMO Cc1ccccc1CC[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000824554839 1030583026 /nfs/dbraw/zinc/58/30/26/1030583026.db2.gz NMKGTINUEKGDPK-UHFFFAOYSA-N 1 1 324.468 3.506 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1C ZINC000824695937 1030614207 /nfs/dbraw/zinc/61/42/07/1030614207.db2.gz DXJZDXYLDFRYAP-RCCFBDPRSA-N 1 1 303.446 3.525 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)cc1 ZINC000093507399 1030645976 /nfs/dbraw/zinc/64/59/76/1030645976.db2.gz NUDSMGABMNUNJH-IEBWSBKVSA-N 1 1 302.462 3.534 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000825133919 1030731786 /nfs/dbraw/zinc/73/17/86/1030731786.db2.gz QDSJDLSPNUPAEU-FQEVSTJZSA-N 1 1 314.473 3.679 20 10 DHCDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825502124 1030827317 /nfs/dbraw/zinc/82/73/17/1030827317.db2.gz ULNRMMSRCXPATG-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO Cc1c(F)cc(F)cc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001143769657 1030952816 /nfs/dbraw/zinc/95/28/16/1030952816.db2.gz QOUNBDNWBJTROR-UHFFFAOYSA-N 1 1 319.351 3.633 20 10 DHCDMO Cc1c(F)cc(F)cc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001143769657 1030952822 /nfs/dbraw/zinc/95/28/22/1030952822.db2.gz QOUNBDNWBJTROR-UHFFFAOYSA-N 1 1 319.351 3.633 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccsc1)OCO2 ZINC000054513362 1030982080 /nfs/dbraw/zinc/98/20/80/1030982080.db2.gz IINHQHRJWYQSLP-CYBMUJFWSA-N 1 1 303.383 3.520 20 10 DHCDMO Cc1nc2c(cccc2CC[NH2+][C@@H](C)c2c(O)cccc2F)o1 ZINC000926970377 1031023176 /nfs/dbraw/zinc/02/31/76/1031023176.db2.gz RDSPDTNBNVVZMU-NSHDSACASA-N 1 1 314.360 3.874 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](c1cnn(C)c1)C(C)C)c1ccc(F)cc1O ZINC000927067262 1031065385 /nfs/dbraw/zinc/06/53/85/1031065385.db2.gz FDNHETHZCCJPBV-NVXWUHKLSA-N 1 1 305.397 3.703 20 10 DHCDMO CCCC[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccccc1O ZINC000844324537 1031067252 /nfs/dbraw/zinc/06/72/52/1031067252.db2.gz VXKZRSWKLODUHK-UHFFFAOYSA-N 1 1 313.445 3.727 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1OCCc2ccccc21)c1c(O)cccc1F ZINC000927113508 1031096537 /nfs/dbraw/zinc/09/65/37/1031096537.db2.gz ZNTNSOCGJORDLM-ACJLOTCBSA-N 1 1 315.388 3.886 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1c2ccccc2CC[C@H]1O)c1ccc(F)cc1O ZINC000927138775 1031115418 /nfs/dbraw/zinc/11/54/18/1031115418.db2.gz HBFQTOCOXXNVLB-LMMKCTJWSA-N 1 1 315.388 3.620 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c(O)c1 ZINC000292742496 1031152977 /nfs/dbraw/zinc/15/29/77/1031152977.db2.gz HOFDIAJNFVPZSL-CVEARBPZSA-N 1 1 311.372 3.658 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2cc(C)cc(C)c2O)C(C)C)cn1 ZINC000844740354 1031309931 /nfs/dbraw/zinc/30/99/31/1031309931.db2.gz YBCBAPXZNQVZIH-UHFFFAOYSA-N 1 1 301.434 3.636 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@]3(CC3(F)F)C1)CCCC2 ZINC000844749186 1031314981 /nfs/dbraw/zinc/31/49/81/1031314981.db2.gz FPHKDZMDYKWKBQ-KRWDZBQOSA-N 1 1 307.384 3.892 20 10 DHCDMO Cc1nc([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)no1 ZINC000360262654 1031354504 /nfs/dbraw/zinc/35/45/04/1031354504.db2.gz UXTLNCAHEUPXKT-HNNXBMFYSA-N 1 1 323.396 3.616 20 10 DHCDMO CCC[N@H+](Cc1cc(Br)c(F)cc1[O-])CC1CC1 ZINC001144298804 1031436431 /nfs/dbraw/zinc/43/64/31/1031436431.db2.gz JMTMQCXIQKKVHS-UHFFFAOYSA-N 1 1 316.214 3.916 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CCC2(CCC2)C1 ZINC001144306840 1031455396 /nfs/dbraw/zinc/45/53/96/1031455396.db2.gz SQPLXOAXHNXECO-UHFFFAOYSA-N 1 1 314.198 3.670 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CCC2(CCC2)C1 ZINC001144306840 1031455386 /nfs/dbraw/zinc/45/53/86/1031455386.db2.gz SQPLXOAXHNXECO-UHFFFAOYSA-N 1 1 314.198 3.670 20 10 DHCDMO C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293753123 1031604434 /nfs/dbraw/zinc/60/44/34/1031604434.db2.gz YHUAVAATXUUPTP-QMMMGPOBSA-N 1 1 300.786 3.535 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000124021451 1031572298 /nfs/dbraw/zinc/57/22/98/1031572298.db2.gz UPOCOQFCWJTMEN-MRXNPFEDSA-N 1 1 308.441 3.673 20 10 DHCDMO C[C@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000124027829 1031574513 /nfs/dbraw/zinc/57/45/13/1031574513.db2.gz XIULBBBTWFJDNT-AWEZNQCLSA-N 1 1 303.494 3.712 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2csc(-c3ccccn3)n2)cc1 ZINC000124045500 1031588136 /nfs/dbraw/zinc/58/81/36/1031588136.db2.gz FGDOWYIPHMUWBK-UHFFFAOYSA-N 1 1 324.453 3.561 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@H]3CSC[C@H]3C2)c1 ZINC000872721188 1031648526 /nfs/dbraw/zinc/64/85/26/1031648526.db2.gz CVVVSILHDMVGFE-TZMCWYRMSA-N 1 1 321.486 3.580 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000873235795 1031768049 /nfs/dbraw/zinc/76/80/49/1031768049.db2.gz QZPYPHNWYLERLV-LBPRGKRZSA-N 1 1 316.832 3.542 20 10 DHCDMO CC(C)O[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000846013485 1031807807 /nfs/dbraw/zinc/80/78/07/1031807807.db2.gz BTNZAPMHRFJBSU-NSHDSACASA-N 1 1 301.789 3.574 20 10 DHCDMO CC(C)O[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000846013485 1031807825 /nfs/dbraw/zinc/80/78/25/1031807825.db2.gz BTNZAPMHRFJBSU-NSHDSACASA-N 1 1 301.789 3.574 20 10 DHCDMO OC1CCN(c2ccc(CNc3ccc(C4CC4)c[nH+]3)cc2)CC1 ZINC000897715858 1031808718 /nfs/dbraw/zinc/80/87/18/1031808718.db2.gz QOOXLTJURDTHKG-UHFFFAOYSA-N 1 1 323.440 3.532 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccc(N(C)C)c(F)c2)C(C)C)cn1 ZINC000846056300 1031818025 /nfs/dbraw/zinc/81/80/25/1031818025.db2.gz SWICJGDUGPERIC-UHFFFAOYSA-N 1 1 318.440 3.519 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCCOC1 ZINC000846053603 1031844225 /nfs/dbraw/zinc/84/42/25/1031844225.db2.gz VCFUAKUBTVWMIY-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001142525106 1031898358 /nfs/dbraw/zinc/89/83/58/1031898358.db2.gz XNEYWBXMWPVPIN-CQSZACIVSA-N 1 1 303.352 3.735 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001142525106 1031898368 /nfs/dbraw/zinc/89/83/68/1031898368.db2.gz XNEYWBXMWPVPIN-CQSZACIVSA-N 1 1 303.352 3.735 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001142525106 1031898379 /nfs/dbraw/zinc/89/83/79/1031898379.db2.gz XNEYWBXMWPVPIN-CQSZACIVSA-N 1 1 303.352 3.735 20 10 DHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001142527147 1031907839 /nfs/dbraw/zinc/90/78/39/1031907839.db2.gz MEZNNQOGQDVGNV-LBPRGKRZSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001142527147 1031907848 /nfs/dbraw/zinc/90/78/48/1031907848.db2.gz MEZNNQOGQDVGNV-LBPRGKRZSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001142527147 1031907853 /nfs/dbraw/zinc/90/78/53/1031907853.db2.gz MEZNNQOGQDVGNV-LBPRGKRZSA-N 1 1 307.315 3.799 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)[C@@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000846189351 1031923877 /nfs/dbraw/zinc/92/38/77/1031923877.db2.gz TVGUCFKLJHPZBV-XVGQJIODSA-N 1 1 317.404 3.868 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)[C@@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000846189348 1031923983 /nfs/dbraw/zinc/92/39/83/1031923983.db2.gz TVGUCFKLJHPZBV-SOVGHPHASA-N 1 1 317.404 3.868 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000294377396 1031968022 /nfs/dbraw/zinc/96/80/22/1031968022.db2.gz UPZZDWOJEKCNFE-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO Cc1[nH+]ccn1CCCN(C)c1ccc(-c2nccs2)cc1 ZINC000846753742 1032048931 /nfs/dbraw/zinc/04/89/31/1032048931.db2.gz YCQFEZYHXZJQCD-UHFFFAOYSA-N 1 1 312.442 3.842 20 10 DHCDMO CC1(C)CC([N@H+]2CCCc3cc(O)c(O)cc3C2)CC(C)(C)O1 ZINC001172660785 1033312573 /nfs/dbraw/zinc/31/25/73/1033312573.db2.gz XPPUGXQFVLKYMY-UHFFFAOYSA-N 1 1 319.445 3.582 20 10 DHCDMO Cc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(O)c1 ZINC000877519671 1033333456 /nfs/dbraw/zinc/33/34/56/1033333456.db2.gz ZEHHAKMEENOLML-HSALFYBXSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1ccc2c(c1)C[C@H]([N@H+]1CCCc3cc(O)c(O)cc3C1)CC2 ZINC001172844897 1033415374 /nfs/dbraw/zinc/41/53/74/1033415374.db2.gz VIUOUZQMKVBUJK-LJQANCHMSA-N 1 1 323.436 3.712 20 10 DHCDMO CC(C)[N@H+](Cc1ccccn1)Cc1cc(F)c(N(C)C)cc1F ZINC000862229405 1033785607 /nfs/dbraw/zinc/78/56/07/1033785607.db2.gz FCRUYXUBXNILFY-UHFFFAOYSA-N 1 1 319.399 3.836 20 10 DHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cc(F)c(N(C)C)cc1F ZINC000862229405 1033785636 /nfs/dbraw/zinc/78/56/36/1033785636.db2.gz FCRUYXUBXNILFY-UHFFFAOYSA-N 1 1 319.399 3.836 20 10 DHCDMO C[C@H](c1ccncc1)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862323426 1033814800 /nfs/dbraw/zinc/81/48/00/1033814800.db2.gz VECSSZOXSFSPFJ-GFCCVEGCSA-N 1 1 305.372 3.619 20 10 DHCDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862323426 1033814817 /nfs/dbraw/zinc/81/48/17/1033814817.db2.gz VECSSZOXSFSPFJ-GFCCVEGCSA-N 1 1 305.372 3.619 20 10 DHCDMO CCn1ccc(C[N@H+](C)Cc2c(O)cccc2Br)c1 ZINC000862341372 1033821868 /nfs/dbraw/zinc/82/18/68/1033821868.db2.gz VROCXNQBUABHEM-UHFFFAOYSA-N 1 1 323.234 3.608 20 10 DHCDMO CCn1ccc(C[N@@H+](C)Cc2c(O)cccc2Br)c1 ZINC000862341372 1033821887 /nfs/dbraw/zinc/82/18/87/1033821887.db2.gz VROCXNQBUABHEM-UHFFFAOYSA-N 1 1 323.234 3.608 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1F ZINC000862376677 1033834230 /nfs/dbraw/zinc/83/42/30/1033834230.db2.gz ZLTYYSPURNQGRI-LSDHHAIUSA-N 1 1 316.342 3.508 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1F ZINC000862376677 1033834241 /nfs/dbraw/zinc/83/42/41/1033834241.db2.gz ZLTYYSPURNQGRI-LSDHHAIUSA-N 1 1 316.342 3.508 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000862485491 1033865189 /nfs/dbraw/zinc/86/51/89/1033865189.db2.gz NOTJSFFSEUKLAF-GOEBONIOSA-N 1 1 319.445 3.500 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)C[C@H](C)C1(F)F ZINC000863273983 1034050253 /nfs/dbraw/zinc/05/02/53/1034050253.db2.gz GKHZBCUJPNFWNU-TXEJJXNPSA-N 1 1 306.356 3.664 20 10 DHCDMO Cc1ccccc1Cc1noc(C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879651218 1034074755 /nfs/dbraw/zinc/07/47/55/1034074755.db2.gz NIIAXYRDBDZESQ-AWEZNQCLSA-N 1 1 323.396 3.525 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCCOC2)cc1F ZINC000119746777 1034232189 /nfs/dbraw/zinc/23/21/89/1034232189.db2.gz HXHPCGNCASSHEU-MRXNPFEDSA-N 1 1 308.441 3.530 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](c3nccs3)C2)cc1 ZINC000880321139 1034296870 /nfs/dbraw/zinc/29/68/70/1034296870.db2.gz NLPVEMXXNQXFRJ-HNNXBMFYSA-N 1 1 301.459 3.589 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)cc1C(C)C ZINC000794647380 1034311549 /nfs/dbraw/zinc/31/15/49/1034311549.db2.gz OYXFFVMKRZQSAW-LIRRHRJNSA-N 1 1 303.446 3.823 20 10 DHCDMO C[C@H](N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1O ZINC000183396360 1034383766 /nfs/dbraw/zinc/38/37/66/1034383766.db2.gz GGRHMOVDMZHYTA-LPHOPBHVSA-N 1 1 310.441 3.880 20 10 DHCDMO CC[C@H]([NH2+]CCCN1CCC(C)CC1)c1ccc(C)cc1O ZINC000794794113 1034474901 /nfs/dbraw/zinc/47/49/01/1034474901.db2.gz PTNLFJJNLAMOAQ-SFHVURJKSA-N 1 1 304.478 3.863 20 10 DHCDMO C[C@@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185839562 1034576433 /nfs/dbraw/zinc/57/64/33/1034576433.db2.gz NBLKURDFOWCZPG-PGUXBMHVSA-N 1 1 309.406 3.756 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)n[nH]1 ZINC000186131078 1034601548 /nfs/dbraw/zinc/60/15/48/1034601548.db2.gz WNNJUJFPCCLOJP-JSGCOSHPSA-N 1 1 309.413 3.859 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccccc2F)C2CC2)c1O ZINC000120567871 1034662210 /nfs/dbraw/zinc/66/22/10/1034662210.db2.gz BSIXWRRVPYLSPU-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]CCCn1ccc2ccccc21 ZINC001177072015 1035347509 /nfs/dbraw/zinc/34/75/09/1035347509.db2.gz WKNNXSPMSXDMEI-UHFFFAOYSA-N 1 1 316.351 3.805 20 10 DHCDMO CCN(C)c1ccc(C[N@H+](Cc2ccccc2)C[C@@H](C)O)cc1 ZINC000773752139 1035437245 /nfs/dbraw/zinc/43/72/45/1035437245.db2.gz IBRMAXYHIAZOFP-QGZVFWFLSA-N 1 1 312.457 3.526 20 10 DHCDMO CO[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)Cc1ccccc1 ZINC001178763047 1035446399 /nfs/dbraw/zinc/44/63/99/1035446399.db2.gz YQPJLSAUOLYWOI-CYBMUJFWSA-N 1 1 323.795 3.532 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2nccs2)c2ccccc21 ZINC001204240583 1035471983 /nfs/dbraw/zinc/47/19/83/1035471983.db2.gz ZHWHGIVDGOYISO-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2nccs2)c2ccccc21 ZINC001204240583 1035471986 /nfs/dbraw/zinc/47/19/86/1035471986.db2.gz ZHWHGIVDGOYISO-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c1 ZINC001179965890 1035561833 /nfs/dbraw/zinc/56/18/33/1035561833.db2.gz BYSHJKRWPUMKIZ-INIZCTEOSA-N 1 1 313.445 3.629 20 10 DHCDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001180017609 1035568381 /nfs/dbraw/zinc/56/83/81/1035568381.db2.gz HXVUIBJRIVQYLE-NSHDSACASA-N 1 1 302.434 3.604 20 10 DHCDMO C[N@@H+](CCc1ccccc1F)Cc1cc(Cl)cc(F)c1[O-] ZINC001180175461 1035605555 /nfs/dbraw/zinc/60/55/55/1035605555.db2.gz UKMWDYCNPUQIGH-UHFFFAOYSA-N 1 1 311.759 3.998 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@@H](CCOC)C2)cc1 ZINC000773855567 1035659498 /nfs/dbraw/zinc/65/94/98/1035659498.db2.gz ICZSJWGOQOOFQN-KRWDZBQOSA-N 1 1 304.478 3.781 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ncccc2F)cc1 ZINC001180363994 1035664060 /nfs/dbraw/zinc/66/40/60/1035664060.db2.gz MCIGYNOXJZNRCG-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ncccc2F)cc1 ZINC001180363994 1035664067 /nfs/dbraw/zinc/66/40/67/1035664067.db2.gz MCIGYNOXJZNRCG-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1CC2(CCC2)CO1 ZINC001193838305 1035737584 /nfs/dbraw/zinc/73/75/84/1035737584.db2.gz ITSCSCQECXMJBM-QGZVFWFLSA-N 1 1 303.446 3.954 20 10 DHCDMO Oc1ccc(C[N@@H+](Cc2ccccn2)C2CCCCC2)c(O)c1 ZINC001204279539 1035765691 /nfs/dbraw/zinc/76/56/91/1035765691.db2.gz ANFMNUBOGBFEBK-UHFFFAOYSA-N 1 1 312.413 3.828 20 10 DHCDMO CCC[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H](O)c1ccccc1 ZINC001181419303 1035904865 /nfs/dbraw/zinc/90/48/65/1035904865.db2.gz YVOBMYJTTBYGQK-FUHWJXTLSA-N 1 1 321.367 3.662 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774160829 1036206795 /nfs/dbraw/zinc/20/67/95/1036206795.db2.gz BRPYQBRKCZQCPR-VHSXEESVSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774189355 1036216737 /nfs/dbraw/zinc/21/67/37/1036216737.db2.gz WPRQZPCUPGCLKM-OTYXRUKQSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774211483 1036233074 /nfs/dbraw/zinc/23/30/74/1036233074.db2.gz UELDVFKILQVOSA-MNOVXSKESA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774266308 1036268673 /nfs/dbraw/zinc/26/86/73/1036268673.db2.gz NEJJTIXEQZPUGK-WPRPVWTQSA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c1O ZINC000775669101 1036320814 /nfs/dbraw/zinc/32/08/14/1036320814.db2.gz FIIGROWJQVICEZ-AZUAARDMSA-N 1 1 311.425 3.789 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@@H]2CCC[C@@H](C)C2)cc1 ZINC001195790683 1036348877 /nfs/dbraw/zinc/34/88/77/1036348877.db2.gz VKIRIRFCRGYNHI-IAGOWNOFSA-N 1 1 304.478 3.890 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCCC[C@H]2[C@H](C)CN(C)C)c1O ZINC001183065920 1036516320 /nfs/dbraw/zinc/51/63/20/1036516320.db2.gz ROOGWVNLMYNYPT-QAPCUYQASA-N 1 1 304.478 3.507 20 10 DHCDMO CCc1cccc(C[N@H+]2CCCC[C@H]2[C@H](C)CN(C)C)c1O ZINC001183065920 1036516338 /nfs/dbraw/zinc/51/63/38/1036516338.db2.gz ROOGWVNLMYNYPT-QAPCUYQASA-N 1 1 304.478 3.507 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](C1CCC1)[C@@H]1CCCO1 ZINC001183123209 1036519757 /nfs/dbraw/zinc/51/97/57/1036519757.db2.gz MVJVIZMJFFISPH-HOTGVXAUSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](C1CCC1)[C@H]1CCCO1 ZINC001183123206 1036520318 /nfs/dbraw/zinc/52/03/18/1036520318.db2.gz MVJVIZMJFFISPH-CVEARBPZSA-N 1 1 313.800 3.622 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)c1 ZINC000775727009 1036571883 /nfs/dbraw/zinc/57/18/83/1036571883.db2.gz DYSSNWJNUGZTFO-BBRMVZONSA-N 1 1 301.386 3.967 20 10 DHCDMO [O-]c1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000153457321 1036602319 /nfs/dbraw/zinc/60/23/19/1036602319.db2.gz GCUNUSFFCDOXTK-GOSISDBHSA-N 1 1 324.468 3.996 20 10 DHCDMO [O-]c1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000153457321 1036602327 /nfs/dbraw/zinc/60/23/27/1036602327.db2.gz GCUNUSFFCDOXTK-GOSISDBHSA-N 1 1 324.468 3.996 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]2CCCC[C@@H]12 ZINC000915208380 1036707136 /nfs/dbraw/zinc/70/71/36/1036707136.db2.gz GCBDKQPHDXYMLU-SNPRPXQTSA-N 1 1 303.402 3.522 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)CCc2ccccc2F)c1O ZINC000754726013 1036757814 /nfs/dbraw/zinc/75/78/14/1036757814.db2.gz JWJXKPHFSRXSNE-UHFFFAOYSA-N 1 1 303.377 3.523 20 10 DHCDMO Oc1ccc(C[N@@H+](Cc2ccccn2)C2CCCCC2)cc1O ZINC001203878449 1036782612 /nfs/dbraw/zinc/78/26/12/1036782612.db2.gz ABFQWWKBLDXZDK-UHFFFAOYSA-N 1 1 312.413 3.828 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(OC)cn2)cc1 ZINC000775928875 1037193557 /nfs/dbraw/zinc/19/35/57/1037193557.db2.gz GLUXMKZKXKYHGK-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO C[C@H](Cc1cccc(F)c1)[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001168500804 1037227405 /nfs/dbraw/zinc/22/74/05/1037227405.db2.gz MNZVACWGEPHAJR-CYBMUJFWSA-N 1 1 315.388 3.616 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)nc1 ZINC000775972696 1037277153 /nfs/dbraw/zinc/27/71/53/1037277153.db2.gz PCRUZNGTJOVULF-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO COc1c(O)c(C[NH2+]C[C@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774983623 1037327367 /nfs/dbraw/zinc/32/73/67/1037327367.db2.gz HRCCDFPXASQKQP-LBPRGKRZSA-N 1 1 322.405 3.615 20 10 DHCDMO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775005232 1037364165 /nfs/dbraw/zinc/36/41/65/1037364165.db2.gz QKPMPIIEXPHMMF-JSGCOSHPSA-N 1 1 322.405 3.758 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001203636136 1037365320 /nfs/dbraw/zinc/36/53/20/1037365320.db2.gz PRBNYZOYBROSGU-VXGBXAGGSA-N 1 1 310.235 3.777 20 10 DHCDMO COc1c(O)c(C[NH2+]CCCCC2CCCC2)ccc1[N+](=O)[O-] ZINC000775023445 1037420604 /nfs/dbraw/zinc/42/06/04/1037420604.db2.gz JUXZWPHOQWLBFJ-UHFFFAOYSA-N 1 1 322.405 3.759 20 10 DHCDMO COc1c(O)c(C[NH+]2CCC(C)(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000775086448 1037583534 /nfs/dbraw/zinc/58/35/34/1037583534.db2.gz GQJYHVKJURUZOH-UHFFFAOYSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@H+](C[C@H]2CC=CCC2)C1 ZINC001201418938 1037658337 /nfs/dbraw/zinc/65/83/37/1037658337.db2.gz TWWFNNXCBAOGKJ-HNNXBMFYSA-N 1 1 310.441 3.901 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775136872 1037684680 /nfs/dbraw/zinc/68/46/80/1037684680.db2.gz NIOQKZYQRXJJGL-QMMMGPOBSA-N 1 1 311.706 3.959 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775136872 1037684701 /nfs/dbraw/zinc/68/47/01/1037684701.db2.gz NIOQKZYQRXJJGL-QMMMGPOBSA-N 1 1 311.706 3.959 20 10 DHCDMO CCCC[N@@H+](C)Cc1c(O)c(C(=O)OC)cc2ccccc21 ZINC000913064398 1037714094 /nfs/dbraw/zinc/71/40/94/1037714094.db2.gz RAHPBTOZMDVWCS-UHFFFAOYSA-N 1 1 301.386 3.564 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccsc2)c1 ZINC000800985082 1037997035 /nfs/dbraw/zinc/99/70/35/1037997035.db2.gz LJFXRZNCCOICQL-WDEREUQCSA-N 1 1 305.399 3.652 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]CC1CC(c2ccccc2)C1 ZINC001202127798 1038049945 /nfs/dbraw/zinc/04/99/45/1038049945.db2.gz XEQJPBQUGXFRII-UHFFFAOYSA-N 1 1 303.352 3.954 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+](CCc2nccs2)C(C)C)c1 ZINC000164608958 1038225460 /nfs/dbraw/zinc/22/54/60/1038225460.db2.gz OVTDAILTJFWPST-UHFFFAOYSA-N 1 1 304.459 3.919 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487048 1038553354 /nfs/dbraw/zinc/55/33/54/1038553354.db2.gz GYLJACKXCOJFIO-YCPHGPKFSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487048 1038553363 /nfs/dbraw/zinc/55/33/63/1038553363.db2.gz GYLJACKXCOJFIO-YCPHGPKFSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)C[C@@H]1CCCO1 ZINC000057100951 1038565077 /nfs/dbraw/zinc/56/50/77/1038565077.db2.gz UQUCDTDACFESTC-INIZCTEOSA-N 1 1 315.413 3.555 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Cl)ccc1[O-] ZINC000775512596 1038604456 /nfs/dbraw/zinc/60/44/56/1038604456.db2.gz RMTDIIMXIVZWAM-LZWOXQAQSA-N 1 1 310.869 3.959 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1O ZINC000775522714 1038632225 /nfs/dbraw/zinc/63/22/25/1038632225.db2.gz YMVCSTBJLBIRHV-KGLIPLIRSA-N 1 1 305.809 3.887 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+](CC(F)F)CC1CCC1 ZINC000761289636 1038897345 /nfs/dbraw/zinc/89/73/45/1038897345.db2.gz FHKPZMBXVNTBMR-UHFFFAOYSA-N 1 1 306.356 3.808 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@@H+](CC(F)F)CC1CCC1 ZINC000761289636 1038897366 /nfs/dbraw/zinc/89/73/66/1038897366.db2.gz FHKPZMBXVNTBMR-UHFFFAOYSA-N 1 1 306.356 3.808 20 10 DHCDMO Cc1ncsc1C[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000172496779 1039922526 /nfs/dbraw/zinc/92/25/26/1039922526.db2.gz YIWJAJZBVPKDOL-UHFFFAOYSA-N 1 1 320.458 3.792 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000272218838 130009216 /nfs/dbraw/zinc/00/92/16/130009216.db2.gz BNCDLAGPTZVJRO-UHFFFAOYSA-N 1 1 315.388 3.713 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000272226430 130010060 /nfs/dbraw/zinc/01/00/60/130010060.db2.gz CZFYISMDOWKFSF-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000272226430 130010061 /nfs/dbraw/zinc/01/00/61/130010061.db2.gz CZFYISMDOWKFSF-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO CCc1nc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cs1 ZINC000273580374 130140844 /nfs/dbraw/zinc/14/08/44/130140844.db2.gz MKIQLFAMZZBNJF-VHSXEESVSA-N 1 1 321.402 3.731 20 10 DHCDMO CCc1noc(CC)c1C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000285520221 131177051 /nfs/dbraw/zinc/17/70/51/131177051.db2.gz BBZYYJMTRFQWLB-CQSZACIVSA-N 1 1 306.381 3.885 20 10 DHCDMO CCCC[N@@H+](Cc1cnc([C@@H](C)O)s1)Cc1ccccc1O ZINC000289546008 131394479 /nfs/dbraw/zinc/39/44/79/131394479.db2.gz FWYSHFDSEMPOKV-CYBMUJFWSA-N 1 1 320.458 3.704 20 10 DHCDMO c1ncn2cc(C[NH2+]Cc3ccc(N4CCCCC4)cc3)ccc12 ZINC000297383759 132013690 /nfs/dbraw/zinc/01/36/90/132013690.db2.gz ATTUYUPYAHZHDW-UHFFFAOYSA-N 1 1 320.440 3.614 20 10 DHCDMO CCOCc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000184990062 333203251 /nfs/dbraw/zinc/20/32/51/333203251.db2.gz RYNUAUCFEHLMRS-CYBMUJFWSA-N 1 1 303.377 3.919 20 10 DHCDMO COCc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)ccc1F ZINC000185495563 333209280 /nfs/dbraw/zinc/20/92/80/333209280.db2.gz LKRINNYHQDHLKD-LLVKDONJSA-N 1 1 307.340 3.668 20 10 DHCDMO COCc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)ccc1F ZINC000185495542 333209327 /nfs/dbraw/zinc/20/93/27/333209327.db2.gz LKRINNYHQDHLKD-NSHDSACASA-N 1 1 307.340 3.668 20 10 DHCDMO Oc1ccc(C2CC[NH+](Cc3cccc(F)c3O)CC2)cc1 ZINC000272270727 334032367 /nfs/dbraw/zinc/03/23/67/334032367.db2.gz LIDYHVIELMZCER-UHFFFAOYSA-N 1 1 301.361 3.617 20 10 DHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000290322043 334172409 /nfs/dbraw/zinc/17/24/09/334172409.db2.gz DBCFCTRUOHRECW-UHFFFAOYSA-N 1 1 321.852 3.717 20 10 DHCDMO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(F)cc1O ZINC000375242784 337006460 /nfs/dbraw/zinc/00/64/60/337006460.db2.gz QOIQESFTKJUYEH-XPTSAGLGSA-N 1 1 307.752 3.969 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1O ZINC000375242785 337006505 /nfs/dbraw/zinc/00/65/05/337006505.db2.gz QOIQESFTKJUYEH-YMTOWFKASA-N 1 1 307.752 3.969 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1C[C@@H](CC)O[C@]2(CCCOC2)C1 ZINC000377696816 337058974 /nfs/dbraw/zinc/05/89/74/337058974.db2.gz NPQSZUCXRLMYQA-HHXXYDBFSA-N 1 1 319.445 3.503 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000377839306 337062345 /nfs/dbraw/zinc/06/23/45/337062345.db2.gz IBQFGJZGQNMGAB-HNNXBMFYSA-N 1 1 311.381 3.717 20 10 DHCDMO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000378443602 337072933 /nfs/dbraw/zinc/07/29/33/337072933.db2.gz NDUQRTAZSCOCDA-INIZCTEOSA-N 1 1 319.836 3.733 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@H]2CCCc3c2cnn3C)c1O ZINC000180641061 337176899 /nfs/dbraw/zinc/17/68/99/337176899.db2.gz YQRWOTWFMUHYOW-HNNXBMFYSA-N 1 1 319.836 3.597 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(OC)c(C)c2)o1 ZINC000266189807 524032268 /nfs/dbraw/zinc/03/22/68/524032268.db2.gz YBQZUNGLAQXORT-MRXNPFEDSA-N 1 1 303.402 3.636 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c1O ZINC000180471772 524408589 /nfs/dbraw/zinc/40/85/89/524408589.db2.gz ULZZCGOPXCBEHB-SFHVURJKSA-N 1 1 311.425 3.739 20 10 DHCDMO Cc1noc(C2CCC([NH2+][C@H](C)c3ccc(F)cc3O)CC2)n1 ZINC000363845801 526586529 /nfs/dbraw/zinc/58/65/29/526586529.db2.gz BPQZTLCXTUYQCT-PWQPVHBWSA-N 1 1 319.380 3.600 20 10 DHCDMO CCN(CC)c1ccc(CNC2CC[NH+](C3CCC3)CC2)cc1 ZINC000299323504 535686442 /nfs/dbraw/zinc/68/64/42/535686442.db2.gz IVRMCFLSXMNMOL-UHFFFAOYSA-N 1 1 315.505 3.639 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]C2CCN(C3CCC3)CC2)cc1 ZINC000299323504 535686450 /nfs/dbraw/zinc/68/64/50/535686450.db2.gz IVRMCFLSXMNMOL-UHFFFAOYSA-N 1 1 315.505 3.639 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)Nc2cc(CCOC)cc[nH+]2)cc1 ZINC000286934869 535765043 /nfs/dbraw/zinc/76/50/43/535765043.db2.gz AXIQBIBYDTVXQE-OAHLLOKOSA-N 1 1 313.445 3.900 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287728644 535804320 /nfs/dbraw/zinc/80/43/20/535804320.db2.gz PAWLVEYWRJGUKS-MLGOLLRUSA-N 1 1 321.852 3.928 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](COC)c1ccccc1)c1ccc(F)cc1O ZINC000286000728 535808153 /nfs/dbraw/zinc/80/81/53/535808153.db2.gz HNMDYOZIGJDLDO-SJORKVTESA-N 1 1 303.377 3.960 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](C)[C@H](F)C3)c2c1 ZINC000777965697 1032058952 /nfs/dbraw/zinc/05/89/52/1032058952.db2.gz FGCASYDLSNBMMI-SJKOYZFVSA-N 1 1 303.377 3.734 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(Cl)c(F)c1 ZINC000846773166 1032075766 /nfs/dbraw/zinc/07/57/66/1032075766.db2.gz XBTLMFKTJLXLTC-UHFFFAOYSA-N 1 1 321.827 3.962 20 10 DHCDMO COc1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)c(O)cc1C ZINC000160382510 1014036726 /nfs/dbraw/zinc/03/67/26/1014036726.db2.gz DLHCWECUWVQKBW-UHFFFAOYSA-N 1 1 317.351 3.874 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1cc2c(cc1O)CCCC2 ZINC000160484203 1014112369 /nfs/dbraw/zinc/11/23/69/1014112369.db2.gz JVDXDHUJHLIELS-UHFFFAOYSA-N 1 1 316.470 3.792 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CCCCC1 ZINC000156950141 1014639543 /nfs/dbraw/zinc/63/95/43/1014639543.db2.gz YGJRSKVFXJOOKP-UHFFFAOYSA-N 1 1 302.462 3.678 20 10 DHCDMO Cc1ccc(C[N@@H+](C)Cc2cccc(Br)c2O)o1 ZINC000160862885 1014727576 /nfs/dbraw/zinc/72/75/76/1014727576.db2.gz GOKCTZYKPROXOX-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2cccc(Br)c2O)o1 ZINC000160862885 1014727583 /nfs/dbraw/zinc/72/75/83/1014727583.db2.gz GOKCTZYKPROXOX-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO CC[N@@H+](Cc1ccnn1C1CCC1)Cc1ccc(N(C)C)cc1 ZINC000891435417 1015037882 /nfs/dbraw/zinc/03/78/82/1015037882.db2.gz CRURIMYKCXOYFQ-UHFFFAOYSA-N 1 1 312.461 3.696 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000896228122 1015514248 /nfs/dbraw/zinc/51/42/48/1015514248.db2.gz QJAWCYAMMHZXQG-CYBMUJFWSA-N 1 1 303.299 3.567 20 10 DHCDMO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccccc3O)n2)cc1 ZINC000276711582 1015540592 /nfs/dbraw/zinc/54/05/92/1015540592.db2.gz CWAJAMALVPGBKM-ZDUSSCGKSA-N 1 1 323.396 3.855 20 10 DHCDMO CCc1cc(C[N@@H+](C)C[C@@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000176088677 1015665863 /nfs/dbraw/zinc/66/58/63/1015665863.db2.gz ADTGVHZHYJBUKL-HNNXBMFYSA-N 1 1 305.462 3.720 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)O[C@@H](C)[C@@H]3C)c2c1 ZINC000783542355 1015760172 /nfs/dbraw/zinc/76/01/72/1015760172.db2.gz JYVIWGIVEHZARK-IHRRRGAJSA-N 1 1 315.413 3.552 20 10 DHCDMO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000281169519 1015843171 /nfs/dbraw/zinc/84/31/71/1015843171.db2.gz QPEHLDGAEAOKGR-SFHVURJKSA-N 1 1 312.461 3.696 20 10 DHCDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000281169519 1015843180 /nfs/dbraw/zinc/84/31/80/1015843180.db2.gz QPEHLDGAEAOKGR-SFHVURJKSA-N 1 1 312.461 3.696 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1ccc(F)cc1O ZINC000184834900 1016388850 /nfs/dbraw/zinc/38/88/50/1016388850.db2.gz CADGJCCHSCHTBU-SJCJKPOMSA-N 1 1 320.383 3.624 20 10 DHCDMO Cc1cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)ccc1N(C)C ZINC001167558576 1016533355 /nfs/dbraw/zinc/53/33/55/1016533355.db2.gz PEVSMZQAHBLIES-ZWKOTPCHSA-N 1 1 304.503 3.921 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1O ZINC000185152724 1016645199 /nfs/dbraw/zinc/64/51/99/1016645199.db2.gz UXPSRTXRGOGXDV-UHFFFAOYSA-N 1 1 309.409 3.757 20 10 DHCDMO CCn1c2cccc(F)c2nc1C[N@H+](C)Cc1ccccc1O ZINC000111235549 1016744792 /nfs/dbraw/zinc/74/47/92/1016744792.db2.gz DDHXCNCOYFYJFH-UHFFFAOYSA-N 1 1 313.376 3.533 20 10 DHCDMO CCn1c2cccc(F)c2nc1C[N@@H+](C)Cc1ccccc1O ZINC000111235549 1016744803 /nfs/dbraw/zinc/74/48/03/1016744803.db2.gz DDHXCNCOYFYJFH-UHFFFAOYSA-N 1 1 313.376 3.533 20 10 DHCDMO COc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185574372 1017025589 /nfs/dbraw/zinc/02/55/89/1017025589.db2.gz XEMOTTMPSCEWEI-QWHCGFSZSA-N 1 1 319.376 3.658 20 10 DHCDMO Cc1cc(C[N@@H+](C)C2CC(OC(C)(C)C)C2)ccc1N(C)C ZINC001171275582 1032209239 /nfs/dbraw/zinc/20/92/39/1032209239.db2.gz BGYAXRKXGWHGGD-UHFFFAOYSA-N 1 1 304.478 3.839 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)[nH]n1 ZINC000282815864 1032496736 /nfs/dbraw/zinc/49/67/36/1032496736.db2.gz AGTABWASJAXBCM-MRXNPFEDSA-N 1 1 321.424 3.957 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+](Cc3c(O)ccc4ccccc43)C2)n[nH]1 ZINC000282815864 1032496740 /nfs/dbraw/zinc/49/67/40/1032496740.db2.gz AGTABWASJAXBCM-MRXNPFEDSA-N 1 1 321.424 3.957 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n[nH]1 ZINC000282815864 1032496744 /nfs/dbraw/zinc/49/67/44/1032496744.db2.gz AGTABWASJAXBCM-MRXNPFEDSA-N 1 1 321.424 3.957 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(N2CCCCCC2)cc1 ZINC000773131949 1032567573 /nfs/dbraw/zinc/56/75/73/1032567573.db2.gz MXBUBYKVXXFGPW-MRXNPFEDSA-N 1 1 312.461 3.651 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](OC)C[C@H]2C)cc1F ZINC000799736362 1012494820 /nfs/dbraw/zinc/49/48/20/1012494820.db2.gz OZELKHKMNBIDPZ-ZBFHGGJFSA-N 1 1 308.441 3.671 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CCC[C@@H]1C[NH3+] ZINC001205983214 1032638333 /nfs/dbraw/zinc/63/83/33/1032638333.db2.gz OJHLLEVWQDZKBR-WDEREUQCSA-N 1 1 317.260 3.506 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCCC2)cc1)C(F)(F)F ZINC001208895173 1012769386 /nfs/dbraw/zinc/76/93/86/1012769386.db2.gz ZQMZTPHPWKEOEI-ZDUSSCGKSA-N 1 1 300.368 3.917 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2[O-])CC1 ZINC000278168261 1018256521 /nfs/dbraw/zinc/25/65/21/1018256521.db2.gz CDWMSGOLRWXFNP-JTQLQIEISA-N 1 1 317.260 3.834 20 10 DHCDMO CC[C@H]([NH2+]CCCN1CCCCC1)c1ccc(N(C)C)cc1 ZINC000764663345 1018342537 /nfs/dbraw/zinc/34/25/37/1018342537.db2.gz VRIZXEOQJKZVGM-IBGZPJMESA-N 1 1 303.494 3.669 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000766120369 1018418014 /nfs/dbraw/zinc/41/80/14/1018418014.db2.gz RSXWVIWYJJPCMD-LLVKDONJSA-N 1 1 310.319 3.715 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@@H+]1CCCC[C@H]1C ZINC000764930461 1018430927 /nfs/dbraw/zinc/43/09/27/1018430927.db2.gz SQTOMHQVLNFZIZ-ZACQAIPSSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@H+]1CCCC[C@H]1C ZINC000764930461 1018430931 /nfs/dbraw/zinc/43/09/31/1018430931.db2.gz SQTOMHQVLNFZIZ-ZACQAIPSSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](NCC[N@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000765349906 1018766220 /nfs/dbraw/zinc/76/62/20/1018766220.db2.gz ODZTWLRLVXAFPO-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@H](NCC[N@@H+](C)C1CCCCC1)c1ccc(N(C)C)cc1 ZINC000765349906 1018766232 /nfs/dbraw/zinc/76/62/32/1018766232.db2.gz ODZTWLRLVXAFPO-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@@](C)([NH2+]Cc1ccc2c(c1)CCCO2)c1nccs1 ZINC000921769453 1018800785 /nfs/dbraw/zinc/80/07/85/1018800785.db2.gz PPTDKMRJVHZMPB-QGZVFWFLSA-N 1 1 302.443 3.883 20 10 DHCDMO Cc1cccc2c1CC[C@@H]([N@H+]1CCCc3cc(O)c(O)cc3C1)C2 ZINC001171572245 1032787879 /nfs/dbraw/zinc/78/78/79/1032787879.db2.gz BIMCLTVMALGUKZ-GOSISDBHSA-N 1 1 323.436 3.712 20 10 DHCDMO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858164877 1032790191 /nfs/dbraw/zinc/79/01/91/1032790191.db2.gz GPDBLUMVFCXAME-VOJFVSQTSA-N 1 1 318.367 3.643 20 10 DHCDMO C[C@H]([NH2+]CCc1ccncc1)c1cc(Cl)c(Cl)cc1O ZINC000278768487 1019345606 /nfs/dbraw/zinc/34/56/06/1019345606.db2.gz PBPFFOXSWZHPIS-JTQLQIEISA-N 1 1 311.212 3.987 20 10 DHCDMO CCN1CCC([N@@H+](C)Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110527 1019391026 /nfs/dbraw/zinc/39/10/26/1019391026.db2.gz IFARIQGMBIJPNS-UHFFFAOYSA-N 1 1 304.478 3.606 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@H](C)C1 ZINC000282222721 1019695896 /nfs/dbraw/zinc/69/58/96/1019695896.db2.gz IBXQLRBZXXBETG-APWZRJJASA-N 1 1 302.462 3.676 20 10 DHCDMO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727429370 1019712267 /nfs/dbraw/zinc/71/22/67/1019712267.db2.gz JRSRSKVXTWJAGM-VFNWGFHPSA-N 1 1 323.436 3.843 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)ccc1OC ZINC000727831003 1019818372 /nfs/dbraw/zinc/81/83/72/1019818372.db2.gz BGUGLYFPPDUYLY-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](N3CCCCC3)C2)cc1C(C)C ZINC000730804553 1020028376 /nfs/dbraw/zinc/02/83/76/1020028376.db2.gz IGSUXUKKXHATJZ-SFHVURJKSA-N 1 1 316.489 3.884 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@H]([NH+]3CCCCC3)C2)cc1C(C)C ZINC000730804553 1020028382 /nfs/dbraw/zinc/02/83/82/1020028382.db2.gz IGSUXUKKXHATJZ-SFHVURJKSA-N 1 1 316.489 3.884 20 10 DHCDMO CCCC[N@@H+](CCOC)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000731660936 1020128995 /nfs/dbraw/zinc/12/89/95/1020128995.db2.gz MVUBRJXVJMOUJA-UHFFFAOYSA-N 1 1 309.450 3.644 20 10 DHCDMO Cc1[nH+]ccn1CCCSc1ncc(-c2ccccc2)n1C ZINC000264228632 1032881912 /nfs/dbraw/zinc/88/19/12/1032881912.db2.gz ZMUWFYODJYINMJ-UHFFFAOYSA-N 1 1 312.442 3.774 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](Nc2nccs2)C1 ZINC000732049479 1020197092 /nfs/dbraw/zinc/19/70/92/1020197092.db2.gz ZDFOJHXZCUJFAN-CYBMUJFWSA-N 1 1 323.849 3.579 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCc3sccc3[C@@H]2C)c1O ZINC000732526605 1020249614 /nfs/dbraw/zinc/24/96/14/1020249614.db2.gz MTUSUEALYLKKMT-LBPRGKRZSA-N 1 1 303.427 3.890 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000091958294 1020326695 /nfs/dbraw/zinc/32/66/95/1020326695.db2.gz VTOHHIYIOVPTIC-GDBMZVCRSA-N 1 1 321.804 3.727 20 10 DHCDMO Cc1ncsc1C[N@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000179443918 1020349571 /nfs/dbraw/zinc/34/95/71/1020349571.db2.gz CKWXJXVADBYBIX-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766046143 1020606928 /nfs/dbraw/zinc/60/69/28/1020606928.db2.gz XJNGEAZSNVTCGY-MAUKXSAKSA-N 1 1 305.510 3.770 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1CN[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000725845758 1020683797 /nfs/dbraw/zinc/68/37/97/1020683797.db2.gz HSTODZBSBXHNMF-PMACEKPBSA-N 1 1 322.452 3.776 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1CN[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000725845758 1020683799 /nfs/dbraw/zinc/68/37/99/1020683799.db2.gz HSTODZBSBXHNMF-PMACEKPBSA-N 1 1 322.452 3.776 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738145067 1020863328 /nfs/dbraw/zinc/86/33/28/1020863328.db2.gz NJSOFHXJCUYNJX-MRXNPFEDSA-N 1 1 304.478 3.524 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738145067 1020863331 /nfs/dbraw/zinc/86/33/31/1020863331.db2.gz NJSOFHXJCUYNJX-MRXNPFEDSA-N 1 1 304.478 3.524 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2ncc[nH]2)c(C)n1-c1cccc(C)c1 ZINC000858544077 1032940378 /nfs/dbraw/zinc/94/03/78/1032940378.db2.gz YJHJPHUWQRSQTK-OAHLLOKOSA-N 1 1 308.429 3.976 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CO[C@@H](C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000858546710 1032942085 /nfs/dbraw/zinc/94/20/85/1032942085.db2.gz DJECSDMUMDXUAT-NURSFMCSSA-N 1 1 315.335 3.629 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCCOC(C)C)c2c1 ZINC000740860164 1020955357 /nfs/dbraw/zinc/95/53/57/1020955357.db2.gz YQHQZQXHJRKIOZ-UHFFFAOYSA-N 1 1 317.429 3.801 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)OCO2 ZINC000742173802 1021094430 /nfs/dbraw/zinc/09/44/30/1021094430.db2.gz LNBIJJGTWFRANE-CQSZACIVSA-N 1 1 317.772 3.721 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)OCO2 ZINC000742173802 1021094437 /nfs/dbraw/zinc/09/44/37/1021094437.db2.gz LNBIJJGTWFRANE-CQSZACIVSA-N 1 1 317.772 3.721 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](OCC(F)(F)F)C2)cc1C ZINC000742367056 1021107276 /nfs/dbraw/zinc/10/72/76/1021107276.db2.gz HOUYYOAKYXTNJL-AWEZNQCLSA-N 1 1 317.351 3.552 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2CCC(C)(C)C2)c1O ZINC000743391445 1021281754 /nfs/dbraw/zinc/28/17/54/1021281754.db2.gz UZYQNLKYYNCVBR-UHFFFAOYSA-N 1 1 313.397 3.564 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCS1 ZINC000743400154 1021285310 /nfs/dbraw/zinc/28/53/10/1021285310.db2.gz JDLJPJHOWFHULN-AWEZNQCLSA-N 1 1 309.475 3.723 20 10 DHCDMO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000850501885 1021563197 /nfs/dbraw/zinc/56/31/97/1021563197.db2.gz QWIAIAZQIDLJFX-LLVKDONJSA-N 1 1 315.404 3.898 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1cccc(C(F)(F)F)c1O ZINC000850571295 1021614402 /nfs/dbraw/zinc/61/44/02/1021614402.db2.gz PCQWQTZGVXQWSV-WDEREUQCSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cccc(C(F)(F)F)c1O ZINC000850573038 1021617305 /nfs/dbraw/zinc/61/73/05/1021617305.db2.gz SODZCZXZYXLTJW-ZJUUUORDSA-N 1 1 313.323 3.556 20 10 DHCDMO C[N@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccccc1O ZINC000109770328 1021748016 /nfs/dbraw/zinc/74/80/16/1021748016.db2.gz KDLFUKINSQECCX-UHFFFAOYSA-N 1 1 320.392 3.616 20 10 DHCDMO C[N@@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccccc1O ZINC000109770328 1021748026 /nfs/dbraw/zinc/74/80/26/1021748026.db2.gz KDLFUKINSQECCX-UHFFFAOYSA-N 1 1 320.392 3.616 20 10 DHCDMO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccccc1O ZINC000109772639 1021748344 /nfs/dbraw/zinc/74/83/44/1021748344.db2.gz XWSADXZGFZVALN-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccccc1O ZINC000109772639 1021748355 /nfs/dbraw/zinc/74/83/55/1021748355.db2.gz XWSADXZGFZVALN-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO CC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccc1O ZINC000155172028 1022026113 /nfs/dbraw/zinc/02/61/13/1022026113.db2.gz RGBJAMGPTBHPOW-WMZOPIPTSA-N 1 1 304.478 3.945 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172123369 1033025209 /nfs/dbraw/zinc/02/52/09/1033025209.db2.gz CDHVWGIBXKFYBU-PMOLBWCYSA-N 1 1 315.505 3.590 20 10 DHCDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000155197288 1022058612 /nfs/dbraw/zinc/05/86/12/1022058612.db2.gz DXDXBCLGLQHHKK-UHFFFAOYSA-N 1 1 303.475 3.965 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1O ZINC000179608420 1022068393 /nfs/dbraw/zinc/06/83/93/1022068393.db2.gz LHAGKPOKTULZIH-MRXNPFEDSA-N 1 1 317.454 3.943 20 10 DHCDMO CCn1nccc1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000853239147 1022240232 /nfs/dbraw/zinc/24/02/32/1022240232.db2.gz BFTJBDSCCUIVDK-VIFPVBQESA-N 1 1 314.216 3.766 20 10 DHCDMO CC[C@H]1C[C@H](C[N@@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC000780754122 1022246504 /nfs/dbraw/zinc/24/65/04/1022246504.db2.gz MUCHSJNWVBJDKO-MJGOQNOKSA-N 1 1 304.478 3.780 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]3COC[C@H]3C1)oc1ccccc12 ZINC000853586617 1022296627 /nfs/dbraw/zinc/29/66/27/1022296627.db2.gz VCNLZHICIVBWCP-UKRRQHHQSA-N 1 1 323.392 3.760 20 10 DHCDMO Cn1c[nH+]cc1CCOc1ccc(N2CCCCC2)c(Cl)c1 ZINC000853725659 1022325131 /nfs/dbraw/zinc/32/51/31/1022325131.db2.gz RPBBXAHOSAAXSZ-UHFFFAOYSA-N 1 1 319.836 3.685 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC001169395620 1022395152 /nfs/dbraw/zinc/39/51/52/1022395152.db2.gz KQHRGECHWPWIIW-UHFFFAOYSA-N 1 1 305.393 3.890 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCCC3(CCCC3)C2)c1O ZINC001169395620 1022395168 /nfs/dbraw/zinc/39/51/68/1022395168.db2.gz KQHRGECHWPWIIW-UHFFFAOYSA-N 1 1 305.393 3.890 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1O ZINC000179694946 1022511580 /nfs/dbraw/zinc/51/15/80/1022511580.db2.gz BIFIANFNFXOGIC-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCCC23CC3)cc1Br ZINC001237682896 1022551774 /nfs/dbraw/zinc/55/17/74/1022551774.db2.gz ULJOLRHHYSDHEP-UHFFFAOYSA-N 1 1 310.235 3.982 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCOCC1)CCCC2 ZINC000776769690 1022559017 /nfs/dbraw/zinc/55/90/17/1022559017.db2.gz VWYJIQWPDBIOBR-LJQANCHMSA-N 1 1 315.457 3.662 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2cc(F)ccc2O)C2CC2)cc1 ZINC000179889685 1022566189 /nfs/dbraw/zinc/56/61/89/1022566189.db2.gz MPSGTDRFRLLXMO-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@]2(CO)CC(C)C)cc1 ZINC001169927869 1022590884 /nfs/dbraw/zinc/59/08/84/1022590884.db2.gz IYGKESOJAXBCAS-IBGZPJMESA-N 1 1 304.478 3.516 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2OC)c1 ZINC000180026700 1022610617 /nfs/dbraw/zinc/61/06/17/1022610617.db2.gz KONWCAXIVSAZAU-QGZVFWFLSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)cc1 ZINC000876535055 1033086585 /nfs/dbraw/zinc/08/65/85/1033086585.db2.gz GIFOSSFUSKKZIT-UHFFFAOYSA-N 1 1 324.468 3.588 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cccc(OCC)c2O)cc1 ZINC000768163268 1022908365 /nfs/dbraw/zinc/90/83/65/1022908365.db2.gz MRBKIMDXGRPCCM-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000876557525 1033091177 /nfs/dbraw/zinc/09/11/77/1033091177.db2.gz AWMAIACKJCFEDB-UHFFFAOYSA-N 1 1 319.408 3.866 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1C ZINC000768207380 1022916172 /nfs/dbraw/zinc/91/61/72/1022916172.db2.gz GRZQOBOOCAKLLJ-UHFFFAOYSA-N 1 1 324.468 3.772 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000768230175 1022929578 /nfs/dbraw/zinc/92/95/78/1022929578.db2.gz RZZFVUITTGRKJN-GOSISDBHSA-N 1 1 311.425 3.998 20 10 DHCDMO COc1ccccc1C[N@@H+](Cc1c(O)cccc1OC)C1CC1 ZINC000768257669 1022933500 /nfs/dbraw/zinc/93/35/00/1022933500.db2.gz OBEPNCMPXVNIGC-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)cc1 ZINC000768256353 1022933907 /nfs/dbraw/zinc/93/39/07/1022933907.db2.gz CTJKJPICSNSGIR-UHFFFAOYSA-N 1 1 320.440 3.794 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)cc1 ZINC000768256353 1022933917 /nfs/dbraw/zinc/93/39/17/1022933917.db2.gz CTJKJPICSNSGIR-UHFFFAOYSA-N 1 1 320.440 3.794 20 10 DHCDMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000768262167 1022935731 /nfs/dbraw/zinc/93/57/31/1022935731.db2.gz HHBYMUVQIZNGDG-LLVKDONJSA-N 1 1 319.788 3.967 20 10 DHCDMO CCCC[N@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[O-])CC1 ZINC000768304470 1022942942 /nfs/dbraw/zinc/94/29/42/1022942942.db2.gz WQNNECYWPOOOLJ-UHFFFAOYSA-N 1 1 324.896 3.990 20 10 DHCDMO CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[O-])CC1 ZINC000768304470 1022942945 /nfs/dbraw/zinc/94/29/45/1022942945.db2.gz WQNNECYWPOOOLJ-UHFFFAOYSA-N 1 1 324.896 3.990 20 10 DHCDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000768320398 1022945233 /nfs/dbraw/zinc/94/52/33/1022945233.db2.gz ULIPDCLOGGBURD-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO CC(C)[N@@H+](Cc1cnn2ccccc12)Cc1ccc(N(C)C)cc1 ZINC000768350328 1022950724 /nfs/dbraw/zinc/95/07/24/1022950724.db2.gz DBVUMAVUNMBOQM-UHFFFAOYSA-N 1 1 322.456 3.811 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(OC)c(C)cc2O)cc1C ZINC000768448237 1022967742 /nfs/dbraw/zinc/96/77/42/1022967742.db2.gz BPOSOHUQYJTYBC-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(O)cc1C ZINC000768446729 1022968178 /nfs/dbraw/zinc/96/81/78/1022968178.db2.gz NSXVLSZZDMEGDD-QGZVFWFLSA-N 1 1 311.425 3.774 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3ccccc3)C1)CCCC2 ZINC000768442683 1022968251 /nfs/dbraw/zinc/96/82/51/1022968251.db2.gz YWIUOSLRTQGDOK-NRFANRHFSA-N 1 1 323.436 3.845 20 10 DHCDMO COc1cc(C[N@@H+](C)CCCOc2ccccc2)c(O)cc1C ZINC000768439696 1022968794 /nfs/dbraw/zinc/96/87/94/1022968794.db2.gz MRCINKFESPERJD-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(O)cc1C ZINC000768453357 1022969116 /nfs/dbraw/zinc/96/91/16/1022969116.db2.gz VOXJBYULXYPVRK-CQSZACIVSA-N 1 1 315.388 3.838 20 10 DHCDMO COc1cc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c(O)cc1C ZINC000768462125 1022973288 /nfs/dbraw/zinc/97/32/88/1022973288.db2.gz JQCFKJWLXCSZEI-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c(O)cc1C ZINC000768462125 1022973299 /nfs/dbraw/zinc/97/32/99/1022973299.db2.gz JQCFKJWLXCSZEI-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]([C@@H]3CCOC3)C1)CCCC2 ZINC000768463848 1022973645 /nfs/dbraw/zinc/97/36/45/1022973645.db2.gz YAGVMQIJKRSVQL-ZWKOTPCHSA-N 1 1 315.457 3.520 20 10 DHCDMO CC(C)CO[C@H]1CC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768464219 1022974593 /nfs/dbraw/zinc/97/45/93/1022974593.db2.gz OOUYJYXJWVWECK-SFHVURJKSA-N 1 1 303.446 3.518 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC000768772153 1023025075 /nfs/dbraw/zinc/02/50/75/1023025075.db2.gz YKPDACWSXRVGIL-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC000768772153 1023025090 /nfs/dbraw/zinc/02/50/90/1023025090.db2.gz YKPDACWSXRVGIL-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO COc1ccccc1OCC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000768821543 1023037695 /nfs/dbraw/zinc/03/76/95/1023037695.db2.gz BPSREDHGLUKBAP-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO Cc1cc(O)c(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1C ZINC000768913729 1023056008 /nfs/dbraw/zinc/05/60/08/1023056008.db2.gz QXSSKBIGDASPQG-ZIFCJYIRSA-N 1 1 316.489 3.846 20 10 DHCDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cc(C)ccc2O)c1 ZINC000768936816 1023059552 /nfs/dbraw/zinc/05/95/52/1023059552.db2.gz PFKGEMMIVANCRG-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1O ZINC000768929699 1023060673 /nfs/dbraw/zinc/06/06/73/1023060673.db2.gz JYGDGMWTCWPDOE-AWEZNQCLSA-N 1 1 313.397 3.747 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000769000339 1023076184 /nfs/dbraw/zinc/07/61/84/1023076184.db2.gz SWZPQFRNOOQCMN-UHFFFAOYSA-N 1 1 316.832 3.758 20 10 DHCDMO CC[C@H]1CCC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000769005243 1023077606 /nfs/dbraw/zinc/07/76/06/1023077606.db2.gz ARXXVZVRKKWYHO-LBPRGKRZSA-N 1 1 314.223 3.538 20 10 DHCDMO CCC[N@@H+](Cc1cc(OC)cc(OC)c1)Cc1ccccc1O ZINC000769201620 1023101065 /nfs/dbraw/zinc/10/10/65/1023101065.db2.gz YBXQIPSCIVPNJR-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCN(C2CC2)C1 ZINC000769327025 1023122861 /nfs/dbraw/zinc/12/28/61/1023122861.db2.gz SXJAKZUEUAXTRR-FQEVSTJZSA-N 1 1 322.452 3.728 20 10 DHCDMO CN(Cc1cc(-c2ccccc2)ccc1O)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000769327025 1023122876 /nfs/dbraw/zinc/12/28/76/1023122876.db2.gz SXJAKZUEUAXTRR-FQEVSTJZSA-N 1 1 322.452 3.728 20 10 DHCDMO CN(Cc1cc(-c2ccccc2)ccc1O)[C@H]1CC[N@H+](C2CC2)C1 ZINC000769327025 1023122884 /nfs/dbraw/zinc/12/28/84/1023122884.db2.gz SXJAKZUEUAXTRR-FQEVSTJZSA-N 1 1 322.452 3.728 20 10 DHCDMO CCC[N@H+](Cc1cc(OCC)ccc1O)C[C@H]1CCCCO1 ZINC000769339579 1023128699 /nfs/dbraw/zinc/12/86/99/1023128699.db2.gz SMZVCPMXHUVCGA-QGZVFWFLSA-N 1 1 307.434 3.572 20 10 DHCDMO CC(C)(C)C[N@@H+](CCCO)Cc1ccc(N2CCCCC2)cc1 ZINC000769342285 1023128888 /nfs/dbraw/zinc/12/88/88/1023128888.db2.gz JAAKVRUOZDDEED-UHFFFAOYSA-N 1 1 318.505 3.907 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@]3(C1)OCc1ccccc13)CCC2 ZINC000184811744 1023129609 /nfs/dbraw/zinc/12/96/09/1023129609.db2.gz NPLKGSBMIXMIET-OAQYLSRUSA-N 1 1 321.420 3.512 20 10 DHCDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769353999 1023132323 /nfs/dbraw/zinc/13/23/23/1023132323.db2.gz YSDCNCBVMQQFRX-KRWDZBQOSA-N 1 1 322.452 3.643 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCCC[C@H](SCC)C2)c1 ZINC000769403228 1023143639 /nfs/dbraw/zinc/14/36/39/1023143639.db2.gz GWYIGXSJEGIAQM-INIZCTEOSA-N 1 1 309.475 3.899 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000769426841 1023147643 /nfs/dbraw/zinc/14/76/43/1023147643.db2.gz IRIDDLBLPBBZOC-SFHVURJKSA-N 1 1 315.438 3.691 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c(O)c1 ZINC000769396513 1023149703 /nfs/dbraw/zinc/14/97/03/1023149703.db2.gz LYAHWVOWJFLRKO-HNNXBMFYSA-N 1 1 315.388 3.920 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000769464782 1023159168 /nfs/dbraw/zinc/15/91/68/1023159168.db2.gz ANVMVIRFNUYCII-DZGCQCFKSA-N 1 1 315.388 3.918 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000769469751 1023161038 /nfs/dbraw/zinc/16/10/38/1023161038.db2.gz DSKSWNQFBNUTDG-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000769469751 1023161040 /nfs/dbraw/zinc/16/10/40/1023161040.db2.gz DSKSWNQFBNUTDG-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000769469751 1023161046 /nfs/dbraw/zinc/16/10/46/1023161046.db2.gz DSKSWNQFBNUTDG-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000769497792 1023166870 /nfs/dbraw/zinc/16/68/70/1023166870.db2.gz BHULPBXEVHQXMB-DOTOQJQBSA-N 1 1 311.425 3.854 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@H]2C)c1O ZINC000769499341 1023168747 /nfs/dbraw/zinc/16/87/47/1023168747.db2.gz QLPUHQVUAUPYEY-WBVHZDCISA-N 1 1 311.425 3.854 20 10 DHCDMO c1cc(N2CCOCC2)ccc1C[N@H+]1CCCC12CCCCC2 ZINC000769505725 1023170871 /nfs/dbraw/zinc/17/08/71/1023170871.db2.gz MGMGJPILYFNBHR-UHFFFAOYSA-N 1 1 314.473 3.822 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H]2CC[C@@H](SCC)C2)c(O)c1 ZINC000769551079 1023177620 /nfs/dbraw/zinc/17/76/20/1023177620.db2.gz UZESNOCXNZRITD-GOEBONIOSA-N 1 1 309.475 3.897 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)cc1F ZINC000770287027 1023291647 /nfs/dbraw/zinc/29/16/47/1023291647.db2.gz UNFSLUYLDZQNQI-SJLPKXTDSA-N 1 1 320.452 3.673 20 10 DHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCC[C@H]1O ZINC000770292654 1023292272 /nfs/dbraw/zinc/29/22/72/1023292272.db2.gz NVHYPTDUOVHNIF-PKOBYXMFSA-N 1 1 311.425 3.652 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000770301755 1023294034 /nfs/dbraw/zinc/29/40/34/1023294034.db2.gz BPUZZRHKOVPZJM-UHFFFAOYSA-N 1 1 303.324 3.565 20 10 DHCDMO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(O)c1 ZINC000876680938 1033120792 /nfs/dbraw/zinc/12/07/92/1033120792.db2.gz JVMMFPMKNDWJDI-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(O)c1 ZINC000876680938 1033120796 /nfs/dbraw/zinc/12/07/96/1033120796.db2.gz JVMMFPMKNDWJDI-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C12CCC2 ZINC000770354552 1023303623 /nfs/dbraw/zinc/30/36/23/1023303623.db2.gz YANOPWMZCDYFTE-ROUUACIJSA-N 1 1 302.462 3.532 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cnc1Cl ZINC000771934875 1023489184 /nfs/dbraw/zinc/48/91/84/1023489184.db2.gz DTBQAEGZUXBCLC-UHFFFAOYSA-N 1 1 303.837 3.741 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000771935586 1023489955 /nfs/dbraw/zinc/48/99/55/1023489955.db2.gz YUAWLZZBCICNAY-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO COc1ncccc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000785692733 1023606084 /nfs/dbraw/zinc/60/60/84/1023606084.db2.gz IDLIPIWNAABWLL-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1 ZINC000787421481 1023791054 /nfs/dbraw/zinc/79/10/54/1023791054.db2.gz RYKWUADKRXWMKU-CQSZACIVSA-N 1 1 317.351 3.954 20 10 DHCDMO C[C@H]([NH2+]CC1(N(C)C)CCC1)c1cccc(C(F)(F)F)c1O ZINC000788759448 1023930220 /nfs/dbraw/zinc/93/02/20/1023930220.db2.gz TULNWSTYNQQFER-NSHDSACASA-N 1 1 316.367 3.546 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)cc1C(C)C ZINC000789506798 1024104706 /nfs/dbraw/zinc/10/47/06/1024104706.db2.gz NPTOLEPEWTZIJA-HKUYNNGSSA-N 1 1 303.446 3.967 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000789511419 1024106550 /nfs/dbraw/zinc/10/65/50/1024106550.db2.gz ZYLJHFPHQDIIAI-DOTOQJQBSA-N 1 1 319.445 3.539 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)cc1F ZINC000129957224 1024109511 /nfs/dbraw/zinc/10/95/11/1024109511.db2.gz LMHQBPQMTREDNZ-INIZCTEOSA-N 1 1 320.452 3.673 20 10 DHCDMO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2cc(F)cc(F)c2O)CCO1 ZINC000883084383 1024236097 /nfs/dbraw/zinc/23/60/97/1024236097.db2.gz PUNMKNQLBBJKBU-HOCLYGCPSA-N 1 1 313.388 3.744 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000883088818 1024236647 /nfs/dbraw/zinc/23/66/47/1024236647.db2.gz RBCCIJJWYJYHNV-DOTOQJQBSA-N 1 1 319.351 3.680 20 10 DHCDMO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000269096821 1024239912 /nfs/dbraw/zinc/23/99/12/1024239912.db2.gz RZFQZFHEUSCDRG-STQMWFEESA-N 1 1 319.474 3.767 20 10 DHCDMO CN1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc21 ZINC000883136985 1024255888 /nfs/dbraw/zinc/25/58/88/1024255888.db2.gz SZDSQQMRPKMIKX-INIZCTEOSA-N 1 1 318.367 3.731 20 10 DHCDMO COc1cccc(C2([NH2+]Cc3cc(F)cc(F)c3O)CCC2)c1 ZINC000883180664 1024270374 /nfs/dbraw/zinc/27/03/74/1024270374.db2.gz HWSAEKOWKWBHHQ-UHFFFAOYSA-N 1 1 319.351 3.848 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NC2CC[NH+](CC(C)C)CC2)cc1 ZINC000131175005 1024272918 /nfs/dbraw/zinc/27/29/18/1024272918.db2.gz KRSIHOFULKHYNN-KRWDZBQOSA-N 1 1 317.521 3.914 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(CC(C)C)CC2)cc1 ZINC000131175005 1024272923 /nfs/dbraw/zinc/27/29/23/1024272923.db2.gz KRSIHOFULKHYNN-KRWDZBQOSA-N 1 1 317.521 3.914 20 10 DHCDMO c1c(C[NH2+]Cc2ccc(N3CCCCC3)cc2)onc1C1CC1 ZINC000876988398 1033199609 /nfs/dbraw/zinc/19/96/09/1033199609.db2.gz FHDSZPCUYXJYMN-UHFFFAOYSA-N 1 1 311.429 3.832 20 10 DHCDMO COCC[N@@H+](Cc1c(O)ccc2ccncc21)[C@@H]1CC[C@H](C)C1 ZINC000790476862 1024308276 /nfs/dbraw/zinc/30/82/76/1024308276.db2.gz FDVWZHALFPJFEF-GOEBONIOSA-N 1 1 314.429 3.577 20 10 DHCDMO COC[C@H](Cc1ccccc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790970608 1024409500 /nfs/dbraw/zinc/40/95/00/1024409500.db2.gz LZVKCIDJUDPZEQ-ZDUSSCGKSA-N 1 1 323.795 3.532 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCc3sccc3[C@H]2C)cc1OC ZINC000271114129 1024457436 /nfs/dbraw/zinc/45/74/36/1024457436.db2.gz VRFKMSRTCVBSNN-LLVKDONJSA-N 1 1 319.426 3.590 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310167927 1024494564 /nfs/dbraw/zinc/49/45/64/1024494564.db2.gz SPAAPPAZLFVEPJ-PKOBYXMFSA-N 1 1 324.468 3.701 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2Cl)c1 ZINC000756342177 1024591468 /nfs/dbraw/zinc/59/14/68/1024591468.db2.gz OUBMOYKEVHTUEG-LLVKDONJSA-N 1 1 319.788 3.683 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)[C@H](CCO)c1ccccc1 ZINC000792165855 1024641447 /nfs/dbraw/zinc/64/14/47/1024641447.db2.gz LQDCYPXYQNCBKM-OAHLLOKOSA-N 1 1 323.795 3.740 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@H](CCO)c1ccccc1 ZINC000792165855 1024641453 /nfs/dbraw/zinc/64/14/53/1024641453.db2.gz LQDCYPXYQNCBKM-OAHLLOKOSA-N 1 1 323.795 3.740 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCc2cc(Br)ccc2C1 ZINC000792181579 1024643505 /nfs/dbraw/zinc/64/35/05/1024643505.db2.gz RHOIANYURAMCRR-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCc2cc(Br)ccc2C1 ZINC000792181579 1024643511 /nfs/dbraw/zinc/64/35/11/1024643511.db2.gz RHOIANYURAMCRR-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)CC[C@H]1C(F)(F)F ZINC000792190187 1024645752 /nfs/dbraw/zinc/64/57/52/1024645752.db2.gz QXGALOLFIVNXTO-CYBMUJFWSA-N 1 1 305.315 3.942 20 10 DHCDMO CCc1ccc([C@@H]2C[N@H+](Cc3cc(F)ccc3O)CCO2)cc1 ZINC000792190884 1024645956 /nfs/dbraw/zinc/64/59/56/1024645956.db2.gz VWDDRBYDTRDBLG-IBGZPJMESA-N 1 1 315.388 3.667 20 10 DHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3cc(F)ccc3O)CCO2)cc1 ZINC000792190884 1024645965 /nfs/dbraw/zinc/64/59/65/1024645965.db2.gz VWDDRBYDTRDBLG-IBGZPJMESA-N 1 1 315.388 3.667 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc(F)cc2C)c(O)cc1C ZINC000792707486 1024786211 /nfs/dbraw/zinc/78/62/11/1024786211.db2.gz MXHYQYIXEBADPK-UHFFFAOYSA-N 1 1 303.377 3.789 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(Br)cc2O)CCC1(F)F ZINC000825944316 1033260551 /nfs/dbraw/zinc/26/05/51/1033260551.db2.gz SXZHRAZAAUGSBL-VIFPVBQESA-N 1 1 320.177 3.632 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@H]1c1cccnc1 ZINC000793573406 1025126899 /nfs/dbraw/zinc/12/68/99/1025126899.db2.gz NHTDGAFRIIISON-IBGZPJMESA-N 1 1 308.425 3.859 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)cc1F ZINC000793609663 1025129870 /nfs/dbraw/zinc/12/98/70/1025129870.db2.gz QYFIXSSLUXFPAN-OALUTQOASA-N 1 1 320.452 3.815 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000124389312 1025424285 /nfs/dbraw/zinc/42/42/85/1025424285.db2.gz XLVOTRNBTPBICI-QGZVFWFLSA-N 1 1 320.392 3.594 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1C[C@]12CCOC2)C1CCCC1 ZINC000886008523 1025437162 /nfs/dbraw/zinc/43/71/62/1025437162.db2.gz OPNDKYWPYOMSHL-APWZRJJASA-N 1 1 301.430 3.563 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1Cl ZINC000825955177 1033283977 /nfs/dbraw/zinc/28/39/77/1033283977.db2.gz HNGMHTKYQBWRSF-UONOGXRCSA-N 1 1 301.764 3.831 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc2c(c1)OCO2 ZINC000886498652 1025655111 /nfs/dbraw/zinc/65/51/11/1025655111.db2.gz KOAKWWJLLWKFRG-MNOVXSKESA-N 1 1 303.333 3.672 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000894016943 1025659097 /nfs/dbraw/zinc/65/90/97/1025659097.db2.gz JQTYFGMDVDYJAX-CYBMUJFWSA-N 1 1 301.386 3.608 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccccc1Cl)c1c(O)cccc1F ZINC000886549474 1025696702 /nfs/dbraw/zinc/69/67/02/1025696702.db2.gz IRWZAJJSDQFOGU-BMIGLBTASA-N 1 1 309.768 3.569 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12)c1c(O)cccc1F ZINC000886558232 1025703212 /nfs/dbraw/zinc/70/32/12/1025703212.db2.gz FCESFVUBDYCWDO-PWXJCGIASA-N 1 1 313.463 3.562 20 10 DHCDMO CC(C)n1ncc2c1C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)CC2 ZINC000886598518 1025730039 /nfs/dbraw/zinc/73/00/39/1025730039.db2.gz CKVKCNIQKVFJEU-GXTWGEPZSA-N 1 1 317.408 3.517 20 10 DHCDMO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886609092 1025737252 /nfs/dbraw/zinc/73/72/52/1025737252.db2.gz MEAUCHOPZWLMHH-VEVIJQCQSA-N 1 1 303.377 3.612 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Br)ccc1O ZINC000806179222 1025834773 /nfs/dbraw/zinc/83/47/73/1025834773.db2.gz BJYVSPBJVKMNEL-PRHODGIISA-N 1 1 320.177 3.993 20 10 DHCDMO C[C@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000806180919 1025835580 /nfs/dbraw/zinc/83/55/80/1025835580.db2.gz SXWLVZYNWMQNBK-WCQYABFASA-N 1 1 323.795 3.611 20 10 DHCDMO C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)ccc1O ZINC000248490952 1025968269 /nfs/dbraw/zinc/96/82/69/1025968269.db2.gz IJERLEQERFCPBV-LSDHHAIUSA-N 1 1 308.441 3.837 20 10 DHCDMO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000924873811 1026015607 /nfs/dbraw/zinc/01/56/07/1026015607.db2.gz YWTGUZZZEAFGKF-INIZCTEOSA-N 1 1 311.429 3.533 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000093684202 1026124188 /nfs/dbraw/zinc/12/41/88/1026124188.db2.gz YZDZBFFOOBNCIE-GOSISDBHSA-N 1 1 311.425 3.739 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c1O ZINC000289744102 1026154319 /nfs/dbraw/zinc/15/43/19/1026154319.db2.gz QIHAGTJZELWBNR-HSALFYBXSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c1 ZINC000289811695 1026185590 /nfs/dbraw/zinc/18/55/90/1026185590.db2.gz SXFOHSOWZGTJMO-VAMGGRTRSA-N 1 1 323.436 3.705 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2ccncc2)c1O ZINC000289826528 1026188680 /nfs/dbraw/zinc/18/86/80/1026188680.db2.gz OKYHZVTWUFMQBS-HNNXBMFYSA-N 1 1 318.804 3.786 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCN2CCCCC2)c1O ZINC000808673826 1026353060 /nfs/dbraw/zinc/35/30/60/1026353060.db2.gz VHJODXLXLGFRTE-AWEZNQCLSA-N 1 1 310.869 3.881 20 10 DHCDMO CCCN1CCC([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808672071 1026354677 /nfs/dbraw/zinc/35/46/77/1026354677.db2.gz BPKYUXXPUZUSDG-CYBMUJFWSA-N 1 1 310.869 3.879 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n[nH]1 ZINC000808706206 1026357871 /nfs/dbraw/zinc/35/78/71/1026357871.db2.gz FFJYXIHSBIFWRA-CMPLNLGQSA-N 1 1 307.825 3.667 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000808729098 1026381994 /nfs/dbraw/zinc/38/19/94/1026381994.db2.gz ZHPPVFIBPNHEMZ-MLGOLLRUSA-N 1 1 301.361 3.748 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CCCC3)[C@H]2C)cc1 ZINC000809724584 1026603610 /nfs/dbraw/zinc/60/36/10/1026603610.db2.gz QJSQAQMGIPDYHX-XLIONFOSSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](N3CCCC3)[C@H]2C)cc1 ZINC000809724584 1026603612 /nfs/dbraw/zinc/60/36/12/1026603612.db2.gz QJSQAQMGIPDYHX-XLIONFOSSA-N 1 1 315.505 3.591 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c1 ZINC000809768163 1026606486 /nfs/dbraw/zinc/60/64/86/1026606486.db2.gz DEXSBTMYPBWXGU-QGZVFWFLSA-N 1 1 321.424 3.715 20 10 DHCDMO C[C@H](C[N@@H+](Cc1cc(F)ccc1O)[C@@H](C)CO)c1ccccc1 ZINC000809773844 1026607457 /nfs/dbraw/zinc/60/74/57/1026607457.db2.gz ALXABLJTSXLPCX-CABCVRRESA-N 1 1 317.404 3.518 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1cc(F)ccc1O ZINC000809755758 1026618829 /nfs/dbraw/zinc/61/88/29/1026618829.db2.gz BVZFXCURXCSMAP-INIZCTEOSA-N 1 1 317.408 3.989 20 10 DHCDMO CC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccc(C)cc1O ZINC000280249608 1026623979 /nfs/dbraw/zinc/62/39/79/1026623979.db2.gz WNXNSPWNDMQEEL-SFHVURJKSA-N 1 1 304.478 3.862 20 10 DHCDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809790360 1026628040 /nfs/dbraw/zinc/62/80/40/1026628040.db2.gz HMFUXXYWYZFNPW-HXUWFJFHSA-N 1 1 316.489 3.661 20 10 DHCDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC000809790991 1026629596 /nfs/dbraw/zinc/62/95/96/1026629596.db2.gz RMMPHAYFKCJFFZ-IBGZPJMESA-N 1 1 322.468 3.656 20 10 DHCDMO CC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(C(F)(F)F)cc1[O-] ZINC000810214165 1026706925 /nfs/dbraw/zinc/70/69/25/1026706925.db2.gz PSYCYCUWICNXLQ-CQSZACIVSA-N 1 1 318.383 3.794 20 10 DHCDMO CCC[N@H+](CC)C[C@H](C)N[C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810263071 1026722578 /nfs/dbraw/zinc/72/25/78/1026722578.db2.gz KSCKOWYKBGVYQH-VNHYZAJKSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810263071 1026722587 /nfs/dbraw/zinc/72/25/87/1026722587.db2.gz KSCKOWYKBGVYQH-VNHYZAJKSA-N 1 1 308.441 3.790 20 10 DHCDMO CC(C)(C)OC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000295211206 1027144964 /nfs/dbraw/zinc/14/49/64/1027144964.db2.gz AOYFGDHFRALTME-UHFFFAOYSA-N 1 1 315.816 3.964 20 10 DHCDMO Oc1c(F)cccc1C[NH2+][C@H]1CCCc2c(F)cc(F)cc21 ZINC000296198436 1027570069 /nfs/dbraw/zinc/57/00/69/1027570069.db2.gz YZBMVPSUUYCEIH-INIZCTEOSA-N 1 1 307.315 3.977 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)cc1 ZINC000778985395 1027718869 /nfs/dbraw/zinc/71/88/69/1027718869.db2.gz SCIUICVIWINTCE-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@H]1C[C@@H](C[N@@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000779015110 1027818071 /nfs/dbraw/zinc/81/80/71/1027818071.db2.gz MYYBRUAYDAYNPL-HOTGVXAUSA-N 1 1 303.446 3.952 20 10 DHCDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000779018903 1027851008 /nfs/dbraw/zinc/85/10/08/1027851008.db2.gz IZARIUYGGXOAFC-GOSISDBHSA-N 1 1 317.404 3.550 20 10 DHCDMO CCc1nccn1[C@@H]1CCC[N@H+]([C@@H](CC)c2ccccc2O)C1 ZINC000364622943 1027855527 /nfs/dbraw/zinc/85/55/27/1027855527.db2.gz MLHLWJXPJVYNJZ-WBVHZDCISA-N 1 1 313.445 3.939 20 10 DHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCCc2cccnc21 ZINC000365001409 1027896807 /nfs/dbraw/zinc/89/68/07/1027896807.db2.gz MZFVLFULSBVBON-INIZCTEOSA-N 1 1 300.377 3.826 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1O ZINC000814178132 1027913979 /nfs/dbraw/zinc/91/39/79/1027913979.db2.gz CYYVFPUTATXPFF-HNNXBMFYSA-N 1 1 309.837 3.603 20 10 DHCDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000008186364 1028048521 /nfs/dbraw/zinc/04/85/21/1028048521.db2.gz MDVFXMFDOASGIT-CYBMUJFWSA-N 1 1 317.410 3.692 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1[O-] ZINC000367491334 1028191250 /nfs/dbraw/zinc/19/12/50/1028191250.db2.gz SPUKUXVGBICYMC-ZENOOKHLSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1)c1ccc(F)cc1O ZINC000367584969 1028208110 /nfs/dbraw/zinc/20/81/10/1028208110.db2.gz CAJUSTPDFDWLBS-CGTJXYLNSA-N 1 1 307.409 3.777 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@H]2c2cc(C)on2)c1 ZINC000368046117 1028286601 /nfs/dbraw/zinc/28/66/01/1028286601.db2.gz YOFHHVCOFXQUST-LRDDRELGSA-N 1 1 302.374 3.595 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)ccc1N(C)C ZINC000815034487 1028338993 /nfs/dbraw/zinc/33/89/93/1028338993.db2.gz QMRCRBRBGYTWJP-OAQYLSRUSA-N 1 1 324.468 3.807 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(N(C)C)c(C)c2)o1 ZINC000815089843 1028357633 /nfs/dbraw/zinc/35/76/33/1028357633.db2.gz OBPVFPXIVIROHK-KRWDZBQOSA-N 1 1 316.445 3.694 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)ccc1N(C)C ZINC000815118503 1028366849 /nfs/dbraw/zinc/36/68/49/1028366849.db2.gz WJGZWDXRRHULPL-WMZOPIPTSA-N 1 1 304.478 3.577 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@H]2c2ccnn2C)cc1 ZINC000815107556 1028378297 /nfs/dbraw/zinc/37/82/97/1028378297.db2.gz QQPMWOQOPFKTNQ-IBGZPJMESA-N 1 1 312.461 3.603 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cccc(C(F)(F)F)c1O ZINC000815566287 1028546151 /nfs/dbraw/zinc/54/61/51/1028546151.db2.gz OLGSPOXINSQFBJ-MNOVXSKESA-N 1 1 303.324 3.631 20 10 DHCDMO CCC[C@@](C)(O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815579687 1028551603 /nfs/dbraw/zinc/55/16/03/1028551603.db2.gz SHOQTFANWFTKDS-QMTHXVAHSA-N 1 1 305.340 3.613 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)on1 ZINC000815576673 1028551882 /nfs/dbraw/zinc/55/18/82/1028551882.db2.gz WBKPXUKWPKUGRU-VIFPVBQESA-N 1 1 300.280 3.558 20 10 DHCDMO CCC[N@H+](Cc1nc(CCC(C)C)no1)Cc1ccccc1O ZINC000076073923 1028556174 /nfs/dbraw/zinc/55/61/74/1028556174.db2.gz ZTNYCLPENIHLGX-UHFFFAOYSA-N 1 1 317.433 3.776 20 10 DHCDMO CCC[N@@H+](Cc1nc(CCC(C)C)no1)Cc1ccccc1O ZINC000076073923 1028556182 /nfs/dbraw/zinc/55/61/82/1028556182.db2.gz ZTNYCLPENIHLGX-UHFFFAOYSA-N 1 1 317.433 3.776 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815587369 1028556822 /nfs/dbraw/zinc/55/68/22/1028556822.db2.gz IFFOTXYEEIIMAT-IINYFYTJSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815597239 1028561729 /nfs/dbraw/zinc/56/17/29/1028561729.db2.gz QNQCWAGCODKERD-QWRGUYRKSA-N 1 1 319.367 3.859 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)c(O)c1 ZINC000815610612 1028570211 /nfs/dbraw/zinc/57/02/11/1028570211.db2.gz OSWRLFRERULIFF-CQSZACIVSA-N 1 1 322.412 3.645 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)CC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000815621939 1028574573 /nfs/dbraw/zinc/57/45/73/1028574573.db2.gz HPGINCOJASJSDM-CMPLNLGQSA-N 1 1 317.351 3.613 20 10 DHCDMO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370201385 1028578496 /nfs/dbraw/zinc/57/84/96/1028578496.db2.gz KASANPPMLMCUSM-HNNXBMFYSA-N 1 1 305.809 3.506 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1 ZINC000815643146 1028590296 /nfs/dbraw/zinc/59/02/96/1028590296.db2.gz VEPMOTHMEMFLPQ-XGNXJENSSA-N 1 1 305.418 3.654 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000815651715 1028594699 /nfs/dbraw/zinc/59/46/99/1028594699.db2.gz BABLIEJTRCLZSZ-JOYOIKCWSA-N 1 1 305.340 3.611 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H](c3cccs3)C[C@H]2C)c1O ZINC000371397868 1028702804 /nfs/dbraw/zinc/70/28/04/1028702804.db2.gz FMGICWYLPPAPRE-OCCSQVGLSA-N 1 1 303.427 3.840 20 10 DHCDMO C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(F)cc1O ZINC000371865324 1028768951 /nfs/dbraw/zinc/76/89/51/1028768951.db2.gz UFGFNDBVWJLMPQ-ZDUSSCGKSA-N 1 1 307.409 3.921 20 10 DHCDMO COCC[C@H]1CCCC[N@H+]([C@@H](C)c2cc(OC)ccc2O)C1 ZINC000372718254 1028888593 /nfs/dbraw/zinc/88/85/93/1028888593.db2.gz PQAQSQAHBVPDIE-LSDHHAIUSA-N 1 1 307.434 3.600 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)cc1O ZINC000816495438 1028895974 /nfs/dbraw/zinc/89/59/74/1028895974.db2.gz WXBHDYPUNPFXLJ-UHFFFAOYSA-N 1 1 323.392 3.892 20 10 DHCDMO Cn1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1Cl ZINC000816508026 1028913166 /nfs/dbraw/zinc/91/31/66/1028913166.db2.gz ACESQAPGYBSYGY-UHFFFAOYSA-N 1 1 319.836 3.724 20 10 DHCDMO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816559658 1028943979 /nfs/dbraw/zinc/94/39/79/1028943979.db2.gz QURPPPZNGPWRTH-ABAIWWIYSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000816560661 1028945604 /nfs/dbraw/zinc/94/56/04/1028945604.db2.gz WUBZGRFVLGPRIY-HNNXBMFYSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000816560661 1028945621 /nfs/dbraw/zinc/94/56/21/1028945621.db2.gz WUBZGRFVLGPRIY-HNNXBMFYSA-N 1 1 313.800 3.576 20 10 DHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C ZINC000816624718 1028951504 /nfs/dbraw/zinc/95/15/04/1028951504.db2.gz FLVUOPLHJXCWGB-SFHVURJKSA-N 1 1 320.452 3.529 20 10 DHCDMO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2O)[C@H]1[C@@H]1CCCO1 ZINC000816614082 1028964978 /nfs/dbraw/zinc/96/49/78/1028964978.db2.gz MIFPCLDBJVDPMG-HKUYNNGSSA-N 1 1 311.425 3.935 20 10 DHCDMO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816613220 1028966442 /nfs/dbraw/zinc/96/64/42/1028966442.db2.gz MTHKBPYTXOUSDN-ABKXIKBNSA-N 1 1 307.752 3.797 20 10 DHCDMO COc1cc2c(cc1Cl)C[N@@H+](Cc1cccc(C)c1O)CC2 ZINC000816664933 1028983512 /nfs/dbraw/zinc/98/35/12/1028983512.db2.gz KZIIULGRPIQITB-UHFFFAOYSA-N 1 1 317.816 3.921 20 10 DHCDMO O[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C12CCCC2 ZINC000816630778 1028984460 /nfs/dbraw/zinc/98/44/60/1028984460.db2.gz RLJMRBYEWIQENT-IBGZPJMESA-N 1 1 314.473 3.556 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H](O)CC2)cc1 ZINC000816667425 1028984529 /nfs/dbraw/zinc/98/45/29/1028984529.db2.gz NCAFJASJEHBUAK-IBGZPJMESA-N 1 1 304.478 3.660 20 10 DHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccs1 ZINC000817938659 1029282895 /nfs/dbraw/zinc/28/28/95/1029282895.db2.gz OZANTYHTHNMIBC-CVEARBPZSA-N 1 1 303.475 3.555 20 10 DHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817943317 1029286328 /nfs/dbraw/zinc/28/63/28/1029286328.db2.gz UJKSWHIAKNWGRI-MOPGFXCFSA-N 1 1 315.436 3.632 20 10 DHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(C2CC2)c1 ZINC000817943823 1029287921 /nfs/dbraw/zinc/28/79/21/1029287921.db2.gz VTWCVFTZOYJZRV-BTYIYWSLSA-N 1 1 323.484 3.981 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1[O-] ZINC000817950615 1029293854 /nfs/dbraw/zinc/29/38/54/1029293854.db2.gz YVCRSXMSUMPUTL-QGZVFWFLSA-N 1 1 318.848 3.788 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000817967028 1029308195 /nfs/dbraw/zinc/30/81/95/1029308195.db2.gz CRJUUHFOUYBZHZ-APPDUMDISA-N 1 1 300.377 3.842 20 10 DHCDMO C[C@@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817982909 1029321239 /nfs/dbraw/zinc/32/12/39/1029321239.db2.gz WCEHCHUCHZPCBM-QMTHXVAHSA-N 1 1 316.367 3.579 20 10 DHCDMO Cc1cc(F)c(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c(F)c1 ZINC000818185391 1029350106 /nfs/dbraw/zinc/35/01/06/1029350106.db2.gz SXAMMRFQPRHPFK-UHFFFAOYSA-N 1 1 308.347 3.768 20 10 DHCDMO COc1ccc(N2CC[C@H](CNc3[nH]c4ccccc4[nH+]3)C2)cc1 ZINC000819934270 1029630196 /nfs/dbraw/zinc/63/01/96/1029630196.db2.gz DNIXHGNEVIHHGW-CQSZACIVSA-N 1 1 322.412 3.510 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CCC(CO)CC1 ZINC000290359691 1030013442 /nfs/dbraw/zinc/01/34/42/1030013442.db2.gz GTCAHLYKZGTYAH-UHFFFAOYSA-N 1 1 316.489 3.660 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCc3cccc(F)c3C2)cc1 ZINC001171005963 1030210140 /nfs/dbraw/zinc/21/01/40/1030210140.db2.gz URGIAEUZFBKMAJ-GOSISDBHSA-N 1 1 312.432 3.881 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866480912 1030317520 /nfs/dbraw/zinc/31/75/20/1030317520.db2.gz KATIPAINQQEOHJ-DYVFJYSZSA-N 1 1 307.409 3.921 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291157357 1030369334 /nfs/dbraw/zinc/36/93/34/1030369334.db2.gz CACLYOMXLGRDMD-LJQANCHMSA-N 1 1 319.408 3.703 20 10 DHCDMO C[C@@H](Cc1ccccc1)N1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000823752796 1030387775 /nfs/dbraw/zinc/38/77/75/1030387775.db2.gz NPBIMXRESYPSNM-KRWDZBQOSA-N 1 1 324.468 3.577 20 10 DHCDMO COc1cccc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000866596126 1030389523 /nfs/dbraw/zinc/38/95/23/1030389523.db2.gz BFGSRMKDYKNFHZ-IAQYHMDHSA-N 1 1 307.340 3.901 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000866596481 1030390002 /nfs/dbraw/zinc/39/00/02/1030390002.db2.gz MQIHVEBRYFAMDY-ZBEGNZNMSA-N 1 1 307.340 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)c1ccnn1C ZINC000866614733 1030405839 /nfs/dbraw/zinc/40/58/39/1030405839.db2.gz OPTUVMPMGRBKIY-NXEZZACHSA-N 1 1 313.323 3.556 20 10 DHCDMO Cc1cc(C[NH2+][C@@H]2CCn3ccnc32)c(C)n1-c1cccc(C)c1 ZINC000824520824 1030572458 /nfs/dbraw/zinc/57/24/58/1030572458.db2.gz AOPUTQXNLJHPFE-LJQANCHMSA-N 1 1 320.440 3.834 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H](C)CCC=C(C)C)ccc1[N+](=O)[O-] ZINC000824677914 1030610810 /nfs/dbraw/zinc/61/08/10/1030610810.db2.gz LACWIULZROMRPX-GFCCVEGCSA-N 1 1 308.378 3.534 20 10 DHCDMO C[C@]1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC1(Cl)Cl ZINC000824772239 1030630551 /nfs/dbraw/zinc/63/05/51/1030630551.db2.gz FQCLDKIZDLCDFF-LLVKDONJSA-N 1 1 312.599 3.858 20 10 DHCDMO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000824798640 1030641731 /nfs/dbraw/zinc/64/17/31/1030641731.db2.gz GLHNUSCACIFZOW-ZBEGNZNMSA-N 1 1 315.816 3.726 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@]3(CCCOC3)C2)cc1Cl ZINC000824856095 1030653966 /nfs/dbraw/zinc/65/39/66/1030653966.db2.gz SOCOBJUMMSEMJM-QGZVFWFLSA-N 1 1 309.837 3.747 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)c2nccn21 ZINC000825017724 1030700685 /nfs/dbraw/zinc/70/06/85/1030700685.db2.gz YJBFXTIRNAQZIP-YJBOKZPZSA-N 1 1 310.445 3.669 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000825215388 1030750588 /nfs/dbraw/zinc/75/05/88/1030750588.db2.gz OKRVPLCQNXVHFH-QGZVFWFLSA-N 1 1 307.459 3.510 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](OC(F)F)C2)cc1Cl ZINC000825480079 1030834618 /nfs/dbraw/zinc/83/46/18/1030834618.db2.gz YHWCPPONCVVMKO-NSHDSACASA-N 1 1 305.752 3.558 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](OC(F)F)C2)cc1Cl ZINC000825480075 1030835974 /nfs/dbraw/zinc/83/59/74/1030835974.db2.gz YHWCPPONCVVMKO-LLVKDONJSA-N 1 1 305.752 3.558 20 10 DHCDMO Cc1cc(N(C)C)ccc1CNC1CC[NH+](C2CCCC2)CC1 ZINC000122791616 1030870232 /nfs/dbraw/zinc/87/02/32/1030870232.db2.gz LEWMWTMEWMXTFZ-UHFFFAOYSA-N 1 1 315.505 3.558 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc(F)cc(F)c1O ZINC000927062155 1031060105 /nfs/dbraw/zinc/06/01/05/1031060105.db2.gz XIBJANXWBCCPSA-ZUZCIYMTSA-N 1 1 304.340 3.794 20 10 DHCDMO C[N@@H+](Cc1cc(Br)c(F)cc1O)C[C@H]1CC1(C)C ZINC001144306637 1031456295 /nfs/dbraw/zinc/45/62/95/1031456295.db2.gz KHIMKVUEVVZKRD-SNVBAGLBSA-N 1 1 316.214 3.772 20 10 DHCDMO C[N@H+](Cc1cc(Br)c(F)cc1O)C[C@H]1CC1(C)C ZINC001144306637 1031456303 /nfs/dbraw/zinc/45/63/03/1031456303.db2.gz KHIMKVUEVVZKRD-SNVBAGLBSA-N 1 1 316.214 3.772 20 10 DHCDMO CCc1noc(CC)c1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293613255 1031540910 /nfs/dbraw/zinc/54/09/10/1031540910.db2.gz LZYXCKOSHUVPCQ-UHFFFAOYSA-N 1 1 312.772 3.587 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1C ZINC000872261263 1031566490 /nfs/dbraw/zinc/56/64/90/1031566490.db2.gz BLTAMTGVNATUPS-SFHVURJKSA-N 1 1 303.446 3.933 20 10 DHCDMO Oc1cccc2c1CC[C@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293697611 1031573916 /nfs/dbraw/zinc/57/39/16/1031573916.db2.gz SUNWLHYVQHOITK-CQSZACIVSA-N 1 1 307.752 3.667 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1O ZINC000124080774 1031608245 /nfs/dbraw/zinc/60/82/45/1031608245.db2.gz CGZLZAVEQWCSIO-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](COC)c2ccco2)cc1C ZINC000873068176 1031701653 /nfs/dbraw/zinc/70/16/53/1031701653.db2.gz IFQVUHFTZJOQNQ-INIZCTEOSA-N 1 1 303.402 3.854 20 10 DHCDMO Cc1nn(-c2cccc(C)c2)cc1C[N@H+](C)Cc1ccccc1O ZINC000845906035 1031769315 /nfs/dbraw/zinc/76/93/15/1031769315.db2.gz NCGUEIQGDFRUII-UHFFFAOYSA-N 1 1 321.424 3.827 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@](C)(c3cccc(F)c3)C2)c1O ZINC000845999491 1031801911 /nfs/dbraw/zinc/80/19/11/1031801911.db2.gz AKVCTKGZCPVTFX-IBGZPJMESA-N 1 1 315.388 3.704 20 10 DHCDMO C[C@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccc(Cl)cc1O ZINC000846186854 1031918535 /nfs/dbraw/zinc/91/85/35/1031918535.db2.gz GKCJPCANNWZXMQ-APPDUMDISA-N 1 1 309.837 3.901 20 10 DHCDMO C[C@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccc(Cl)cc1O ZINC000846186856 1031920108 /nfs/dbraw/zinc/92/01/08/1031920108.db2.gz GKCJPCANNWZXMQ-GTNSWQLSSA-N 1 1 309.837 3.901 20 10 DHCDMO COCC(C)(C)[N@@H+](C)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000825986644 1033387552 /nfs/dbraw/zinc/38/75/52/1033387552.db2.gz KOIQBKAFAAQGFX-UHFFFAOYSA-N 1 1 309.450 3.555 20 10 DHCDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000877685444 1033411979 /nfs/dbraw/zinc/41/19/79/1033411979.db2.gz ZTPBEEDDQGRDST-SSDOTTSWSA-N 1 1 300.786 3.800 20 10 DHCDMO COc1cccc(C[N@@H+]2Cc3cccc(O)c3C2)c1OC(C)C ZINC000877703747 1033416765 /nfs/dbraw/zinc/41/67/65/1033416765.db2.gz SDBOKGIOBQTNBC-UHFFFAOYSA-N 1 1 313.397 3.704 20 10 DHCDMO COc1cccc(C[N@H+]2Cc3cccc(O)c3C2)c1OC(C)C ZINC000877703747 1033416772 /nfs/dbraw/zinc/41/67/72/1033416772.db2.gz SDBOKGIOBQTNBC-UHFFFAOYSA-N 1 1 313.397 3.704 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](C(F)(F)F)CC2)cc1Cl ZINC000877819932 1033470676 /nfs/dbraw/zinc/47/06/76/1033470676.db2.gz BHHDSIFRPCUPQO-ZDUSSCGKSA-N 1 1 323.742 3.507 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](C(F)(F)F)CC2)cc1Cl ZINC000877819932 1033470679 /nfs/dbraw/zinc/47/06/79/1033470679.db2.gz BHHDSIFRPCUPQO-ZDUSSCGKSA-N 1 1 323.742 3.507 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)C1CCC2(CCOCC2)CC1 ZINC001173050653 1033513865 /nfs/dbraw/zinc/51/38/65/1033513865.db2.gz DPNQZWOAZDXVPM-UHFFFAOYSA-N 1 1 303.446 3.954 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000153231705 1033567912 /nfs/dbraw/zinc/56/79/12/1033567912.db2.gz ZFFLWWKLGNLXSY-HNNXBMFYSA-N 1 1 303.427 3.635 20 10 DHCDMO CCSC[C@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001173287664 1033680545 /nfs/dbraw/zinc/68/05/45/1033680545.db2.gz KOKZFNYEMMSSNC-JTQLQIEISA-N 1 1 310.850 3.825 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000777221946 1033719368 /nfs/dbraw/zinc/71/93/68/1033719368.db2.gz OKTMAFNNTNZINM-FQEVSTJZSA-N 1 1 309.409 3.670 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)n(C)n2)cc1 ZINC000927112376 1033830719 /nfs/dbraw/zinc/83/07/19/1033830719.db2.gz NLCTZUMNUPHSQA-AWEZNQCLSA-N 1 1 312.461 3.604 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000862476021 1033863923 /nfs/dbraw/zinc/86/39/23/1033863923.db2.gz FKTLCVZLANMLCE-BEFAXECRSA-N 1 1 316.489 3.833 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000862485492 1033865976 /nfs/dbraw/zinc/86/59/76/1033865976.db2.gz NOTJSFFSEUKLAF-HOCLYGCPSA-N 1 1 319.445 3.500 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1cnn(C)c1)Cc1ccccc1O ZINC000176680696 1034102612 /nfs/dbraw/zinc/10/26/12/1034102612.db2.gz ADRYJHODJZMJSK-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO CC(C)C[NH+]1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000177836070 1034186489 /nfs/dbraw/zinc/18/64/89/1034186489.db2.gz TYFSHRSADTUUHA-MRXNPFEDSA-N 1 1 303.494 3.524 20 10 DHCDMO CC(C)CN1CCC([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000177836070 1034186496 /nfs/dbraw/zinc/18/64/96/1034186496.db2.gz TYFSHRSADTUUHA-MRXNPFEDSA-N 1 1 303.494 3.524 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000864015998 1034256195 /nfs/dbraw/zinc/25/61/95/1034256195.db2.gz HRQLYLDMKHBEMN-UHFFFAOYSA-N 1 1 316.748 3.747 20 10 DHCDMO C[C@@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185838345 1034576548 /nfs/dbraw/zinc/57/65/48/1034576548.db2.gz DQDTVXJGAMOLOS-NVGCLXPQSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185838327 1034577495 /nfs/dbraw/zinc/57/74/95/1034577495.db2.gz DQDTVXJGAMOLOS-PEBVRCNWSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(F)cc1O ZINC000186009296 1034594071 /nfs/dbraw/zinc/59/40/71/1034594071.db2.gz MJMSFZAGUZCGQG-ZUZCIYMTSA-N 1 1 305.324 3.845 20 10 DHCDMO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001176916107 1035339090 /nfs/dbraw/zinc/33/90/90/1035339090.db2.gz SYRWGEOIHSGVPI-MOPGFXCFSA-N 1 1 302.462 3.595 20 10 DHCDMO CCCOc1ccc(CN[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1C ZINC001177476191 1035371288 /nfs/dbraw/zinc/37/12/88/1035371288.db2.gz YXAQIHRHEYPHBL-FUHWJXTLSA-N 1 1 318.505 3.994 20 10 DHCDMO CCCOc1ccc(CN[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1C ZINC001177476191 1035371293 /nfs/dbraw/zinc/37/12/93/1035371293.db2.gz YXAQIHRHEYPHBL-FUHWJXTLSA-N 1 1 318.505 3.994 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000195134654 1035414849 /nfs/dbraw/zinc/41/48/49/1035414849.db2.gz XPGHJKOOTMZXDK-WMZOPIPTSA-N 1 1 310.441 3.565 20 10 DHCDMO Cc1cccc2c1OC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC001178852757 1035451437 /nfs/dbraw/zinc/45/14/37/1035451437.db2.gz XXTXWLNYOGDBPD-LBPRGKRZSA-N 1 1 321.779 3.586 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2c2c(C)n[nH]c2C)cc1 ZINC000773822824 1035494639 /nfs/dbraw/zinc/49/46/39/1035494639.db2.gz SKTAHQHTJRAREU-SFHVURJKSA-N 1 1 312.461 3.820 20 10 DHCDMO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958400 1035562869 /nfs/dbraw/zinc/56/28/69/1035562869.db2.gz ZNGPGHSFFAXTKP-GDBMZVCRSA-N 1 1 315.816 3.820 20 10 DHCDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958400 1035562872 /nfs/dbraw/zinc/56/28/72/1035562872.db2.gz ZNGPGHSFFAXTKP-GDBMZVCRSA-N 1 1 315.816 3.820 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000905677699 1035613418 /nfs/dbraw/zinc/61/34/18/1035613418.db2.gz JPYDGHHYXKTXJK-AWEZNQCLSA-N 1 1 317.326 3.875 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1 ZINC001180430599 1035670779 /nfs/dbraw/zinc/67/07/79/1035670779.db2.gz OXGYBJXYIJKICO-FUHWJXTLSA-N 1 1 305.462 3.745 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1O ZINC001204279463 1035751915 /nfs/dbraw/zinc/75/19/15/1035751915.db2.gz NJGQBRREMSVGHU-UHFFFAOYSA-N 1 1 303.352 3.791 20 10 DHCDMO CCc1cccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1O ZINC001204279463 1035751937 /nfs/dbraw/zinc/75/19/37/1035751937.db2.gz NJGQBRREMSVGHU-UHFFFAOYSA-N 1 1 303.352 3.791 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)CC(C)(C)CC(=O)OCC ZINC001181185000 1035858396 /nfs/dbraw/zinc/85/83/96/1035858396.db2.gz MWSLZTUYZCVNNN-UHFFFAOYSA-N 1 1 321.461 3.974 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC001181526227 1035934720 /nfs/dbraw/zinc/93/47/20/1035934720.db2.gz VKYNBMIHMBVCCT-UONOGXRCSA-N 1 1 309.837 3.684 20 10 DHCDMO C[C@@H]([NH2+]CC(C)(C)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774109038 1036167021 /nfs/dbraw/zinc/16/70/21/1036167021.db2.gz BVZFLSNCEOUKQV-SECBINFHSA-N 1 1 305.249 3.690 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCO)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774252175 1036256803 /nfs/dbraw/zinc/25/68/03/1036256803.db2.gz JRUMSMCPQXROKI-OQPBUACISA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cc(Cl)cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1O ZINC000775657768 1036261623 /nfs/dbraw/zinc/26/16/23/1036261623.db2.gz HRFGRPOSGBFCKA-UHFFFAOYSA-N 1 1 324.896 3.906 20 10 DHCDMO C[C@H]([NH2+]CCOC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774300567 1036277726 /nfs/dbraw/zinc/27/77/26/1036277726.db2.gz MYGVGYQQMRZDBO-VIFPVBQESA-N 1 1 304.217 3.919 20 10 DHCDMO C[C@H]([NH2+]CC1(CO)CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774356065 1036313687 /nfs/dbraw/zinc/31/36/87/1036313687.db2.gz MRKGCQUYXWJUQX-JTQLQIEISA-N 1 1 318.244 3.902 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)C2CCCCCCC2)cc1OC ZINC000775668773 1036319776 /nfs/dbraw/zinc/31/97/76/1036319776.db2.gz KRSWUIDMVMNMSK-UHFFFAOYSA-N 1 1 307.434 3.954 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@H]2C2CC2)c1O ZINC000775678262 1036408922 /nfs/dbraw/zinc/40/89/22/1036408922.db2.gz YPYGGUYWSYNCIQ-AWEZNQCLSA-N 1 1 310.235 3.838 20 10 DHCDMO C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC001206540471 1036438262 /nfs/dbraw/zinc/43/82/62/1036438262.db2.gz BSAOHSQYMJKPJX-HNNXBMFYSA-N 1 1 317.260 3.650 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000775690157 1036465840 /nfs/dbraw/zinc/46/58/40/1036465840.db2.gz JYDVVCFXGLYJFH-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000775697772 1036472237 /nfs/dbraw/zinc/47/22/37/1036472237.db2.gz GHCUUKPWUDYXKH-HNNXBMFYSA-N 1 1 315.388 3.605 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1O ZINC000775738357 1036597569 /nfs/dbraw/zinc/59/75/69/1036597569.db2.gz BDRDKCLYSLYCJU-ZIAGYGMSSA-N 1 1 309.837 3.603 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@H](O)c1ccccc1 ZINC001183698728 1036649497 /nfs/dbraw/zinc/64/94/97/1036649497.db2.gz ZBZANWRIUTXYBP-RDJZCZTQSA-N 1 1 323.795 3.787 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]2CCCC[C@H]12 ZINC000915208381 1036705934 /nfs/dbraw/zinc/70/59/34/1036705934.db2.gz GCBDKQPHDXYMLU-YUELXQCFSA-N 1 1 303.402 3.522 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCOCC12CCCC2 ZINC001184364301 1036811334 /nfs/dbraw/zinc/81/13/34/1036811334.db2.gz RGLDPQROWZPGID-HNNXBMFYSA-N 1 1 313.800 3.624 20 10 DHCDMO CCc1nc(C)c(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)[nH]1 ZINC001203244173 1037143205 /nfs/dbraw/zinc/14/32/05/1037143205.db2.gz SVTBSMLBTGRFEQ-UHFFFAOYSA-N 1 1 312.461 3.513 20 10 DHCDMO CCOc1ccc(N2CC[NH+](Cc3ccc(F)cc3)CC2)cc1 ZINC001203918482 1037145974 /nfs/dbraw/zinc/14/59/74/1037145974.db2.gz ZXOACTGGJMBDME-UHFFFAOYSA-N 1 1 314.404 3.547 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H]2COCc2ccccc2)cc1 ZINC001203934141 1037250738 /nfs/dbraw/zinc/25/07/38/1037250738.db2.gz OBXULMPVRBOJRA-HXUWFJFHSA-N 1 1 310.441 3.544 20 10 DHCDMO Cc1cc(O)c(CNC[C@H](C)C[NH+]2CCCCC2)c(Cl)c1 ZINC001199580938 1037284850 /nfs/dbraw/zinc/28/48/50/1037284850.db2.gz DHBHVPYSWAOGSX-AWEZNQCLSA-N 1 1 310.869 3.566 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1ccccc1O)CC1(C)COC1 ZINC000776010150 1037305025 /nfs/dbraw/zinc/30/50/25/1037305025.db2.gz MMBIMOVNXVGLFD-MRXNPFEDSA-N 1 1 311.425 3.992 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1 ZINC000776013867 1037306975 /nfs/dbraw/zinc/30/69/75/1037306975.db2.gz JOQFIEJVXJRRJJ-FQEVSTJZSA-N 1 1 309.409 3.722 20 10 DHCDMO CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775028991 1037437677 /nfs/dbraw/zinc/43/76/77/1037437677.db2.gz JHWCYLOVINXQFS-OCCSQVGLSA-N 1 1 322.405 3.758 20 10 DHCDMO CC(C)CC(C)(C)C[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001200933224 1037470332 /nfs/dbraw/zinc/47/03/32/1037470332.db2.gz UVXHGGJADJTYJB-UHFFFAOYSA-N 1 1 317.521 3.600 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCOC(C)(C)[C@H]3C)c2c1 ZINC000763213907 1037488847 /nfs/dbraw/zinc/48/88/47/1037488847.db2.gz VVXPKRQZEOBABP-CYBMUJFWSA-N 1 1 315.413 3.553 20 10 DHCDMO COc1c(O)c(C[NH2+]CC2(C)CCCCCC2)ccc1[N+](=O)[O-] ZINC000775053496 1037501196 /nfs/dbraw/zinc/50/11/96/1037501196.db2.gz ZGKDBHWABGHBRC-UHFFFAOYSA-N 1 1 322.405 3.759 20 10 DHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(OCC)cc1O ZINC000775203038 1038001373 /nfs/dbraw/zinc/00/13/73/1038001373.db2.gz JANIWIJMVTWKHK-GOSISDBHSA-N 1 1 307.434 3.572 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)CCc2ccc(F)cc2)c1O ZINC000164201216 1038103724 /nfs/dbraw/zinc/10/37/24/1038103724.db2.gz REKZDZXWMFGWHU-UHFFFAOYSA-N 1 1 303.377 3.523 20 10 DHCDMO COc1cc(C[N@@H+](C)C[C@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000164309876 1038155669 /nfs/dbraw/zinc/15/56/69/1038155669.db2.gz DALBJUXZGQQDCS-CQSZACIVSA-N 1 1 321.461 3.557 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000917074007 1038161708 /nfs/dbraw/zinc/16/17/08/1038161708.db2.gz MTKRPPAYAPFTHE-CYBMUJFWSA-N 1 1 313.272 3.911 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1O ZINC000775522716 1038633483 /nfs/dbraw/zinc/63/34/83/1038633483.db2.gz YMVCSTBJLBIRHV-ZIAGYGMSSA-N 1 1 305.809 3.887 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000760881006 1038957433 /nfs/dbraw/zinc/95/74/33/1038957433.db2.gz LAGUCBZKLAGBLR-NWDGAFQWSA-N 1 1 304.463 3.714 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCc1cccnc1)Cc1ccco1 ZINC000172164030 1039759223 /nfs/dbraw/zinc/75/92/23/1039759223.db2.gz ABWZCPBJDDJKJC-UHFFFAOYSA-N 1 1 308.381 3.625 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(F)cc1O ZINC000062745231 184251871 /nfs/dbraw/zinc/25/18/71/184251871.db2.gz ZETPFIUTIRZRGS-RISCZKNCSA-N 1 1 308.422 3.546 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2[O-])CC1 ZINC000273301087 130105056 /nfs/dbraw/zinc/10/50/56/130105056.db2.gz BIQUWSPYJLGFBN-JTQLQIEISA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(F)cc1O ZINC000273481199 130125822 /nfs/dbraw/zinc/12/58/22/130125822.db2.gz MBKJQYSMPFBLEI-DRONIGIMSA-N 1 1 321.417 3.681 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc2ccccc2c1O ZINC000273515537 130130410 /nfs/dbraw/zinc/13/04/10/130130410.db2.gz SNAOSQWFAQVIJL-YVEFUNNKSA-N 1 1 307.397 3.997 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(OC)ccc1OC)c1ccc(F)cc1O ZINC000285561228 131181185 /nfs/dbraw/zinc/18/11/85/131181185.db2.gz HGHBQAMPHUVDQJ-INIZCTEOSA-N 1 1 319.376 3.789 20 10 DHCDMO COCc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000293797401 131771016 /nfs/dbraw/zinc/77/10/16/131771016.db2.gz BTYVBPUINUMPHO-UHFFFAOYSA-N 1 1 309.768 3.621 20 10 DHCDMO CC[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(F)cc1O ZINC000297442558 132015785 /nfs/dbraw/zinc/01/57/85/132015785.db2.gz WHTMNRCBVWMBSO-HNNXBMFYSA-N 1 1 302.393 3.945 20 10 DHCDMO C[C@H](O)c1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000294305036 335120927 /nfs/dbraw/zinc/12/09/27/335120927.db2.gz QCUKOKKOQYVGAI-JTQLQIEISA-N 1 1 309.768 3.528 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000184673398 333363814 /nfs/dbraw/zinc/36/38/14/333363814.db2.gz VZKFYUINZBYEBR-SNVBAGLBSA-N 1 1 323.742 3.829 20 10 DHCDMO COc1cccc(CNc2cc(C)[nH+]c3c(OC)cccc23)c1O ZINC000301975918 336340882 /nfs/dbraw/zinc/34/08/82/336340882.db2.gz DENMCSAWNZFPJB-UHFFFAOYSA-N 1 1 324.380 3.878 20 10 DHCDMO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1O ZINC000375242782 337006366 /nfs/dbraw/zinc/00/63/66/337006366.db2.gz QOIQESFTKJUYEH-LKFCYVNXSA-N 1 1 307.752 3.969 20 10 DHCDMO Cc1n[nH]cc1C1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000375271500 337007109 /nfs/dbraw/zinc/00/71/09/337007109.db2.gz CJGUCUOPNQGIFB-UHFFFAOYSA-N 1 1 323.799 3.596 20 10 DHCDMO CN(C)c1ccc(C[NH2+]C[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000377757674 337060185 /nfs/dbraw/zinc/06/01/85/337060185.db2.gz AIZJDMGEGGNQFS-TZIWHRDSSA-N 1 1 323.484 3.535 20 10 DHCDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3cc(C)ccc3O)C2)s1 ZINC000378352642 337070874 /nfs/dbraw/zinc/07/08/74/337070874.db2.gz YVVRJXABIIABNT-AWEZNQCLSA-N 1 1 302.443 3.845 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccccc1-n1ccnc1)c1ccc(F)cc1O ZINC000185125279 337203224 /nfs/dbraw/zinc/20/32/24/337203224.db2.gz HNJNRHOGYVVRHF-CYBMUJFWSA-N 1 1 311.360 3.568 20 10 DHCDMO Cc1nnc([C@H]([NH2+][C@@H](C)c2cc(C)ccc2O)c2ccccc2)[nH]1 ZINC000185324327 337205145 /nfs/dbraw/zinc/20/51/45/337205145.db2.gz PHTWMGYRCBXIHW-SCLBCKFNSA-N 1 1 322.412 3.567 20 10 DHCDMO Cc1cccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000191576761 524438832 /nfs/dbraw/zinc/43/88/32/524438832.db2.gz RCOSGNOKHZUNED-CYBMUJFWSA-N 1 1 315.417 3.982 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000180257699 526348592 /nfs/dbraw/zinc/34/85/92/526348592.db2.gz SAVNRMAIKCAMNX-GOEBONIOSA-N 1 1 321.417 3.681 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(F)ccc1O)CCC2 ZINC000180148832 527106532 /nfs/dbraw/zinc/10/65/32/527106532.db2.gz ZGJYFEOGNHDJKO-AWEZNQCLSA-N 1 1 306.406 3.806 20 10 DHCDMO CC(C)[N@H+](Cc1nccn1C(F)F)Cc1ccc(N(C)C)cc1 ZINC000298685082 535122320 /nfs/dbraw/zinc/12/23/20/535122320.db2.gz BCABAUSEYIWBDQ-UHFFFAOYSA-N 1 1 322.403 3.755 20 10 DHCDMO CC(C)[N@@H+](Cc1nccn1C(F)F)Cc1ccc(N(C)C)cc1 ZINC000298685082 535122327 /nfs/dbraw/zinc/12/23/27/535122327.db2.gz BCABAUSEYIWBDQ-UHFFFAOYSA-N 1 1 322.403 3.755 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(F)cc1O ZINC000286161792 535918170 /nfs/dbraw/zinc/91/81/70/535918170.db2.gz PWINEUGLLFKJBT-SJCJKPOMSA-N 1 1 303.377 3.826 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc(OC)c2O)cc1 ZINC000155149919 1013244178 /nfs/dbraw/zinc/24/41/78/1013244178.db2.gz XZZWJJBYGYMZNT-QGZVFWFLSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1n[nH]c(C)c1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000155242858 1013322253 /nfs/dbraw/zinc/32/22/53/1013322253.db2.gz OUISNHLUPAUCAX-UHFFFAOYSA-N 1 1 312.461 3.649 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)c1O ZINC000894461915 1013378739 /nfs/dbraw/zinc/37/87/39/1013378739.db2.gz LZHIOFVPBPABDI-WMLDXEAASA-N 1 1 312.413 3.687 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cccc(C)c2C)c(O)c1OC ZINC000894580342 1013425503 /nfs/dbraw/zinc/42/55/03/1013425503.db2.gz DTZARUGULLRHIL-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1cnc2ccccn12)C1CCCC1 ZINC000160330783 1013855038 /nfs/dbraw/zinc/85/50/38/1013855038.db2.gz CENDEFLFVYRMKG-UHFFFAOYSA-N 1 1 321.424 3.985 20 10 DHCDMO C[C@@H]([NH2+]C1CC(F)(F)C1)c1cc(Br)c(F)cc1O ZINC000760037863 1014305441 /nfs/dbraw/zinc/30/54/41/1014305441.db2.gz JIDIWXXNXGZUAA-ZCFIWIBFSA-N 1 1 324.140 3.742 20 10 DHCDMO Oc1c(Br)cccc1C[NH+]1CCC(C(F)F)CC1 ZINC000307875231 1014623209 /nfs/dbraw/zinc/62/32/09/1014623209.db2.gz DWRJOBGKIRIECH-UHFFFAOYSA-N 1 1 320.177 3.632 20 10 DHCDMO Oc1ccc(Cl)cc1C[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000895155069 1014653863 /nfs/dbraw/zinc/65/38/63/1014653863.db2.gz CHRSSVLTEPIEGI-UHFFFAOYSA-N 1 1 322.739 3.811 20 10 DHCDMO CCOCC[N@@H+](CC)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000754726717 1015116505 /nfs/dbraw/zinc/11/65/05/1015116505.db2.gz VFVBHEDGWWGRGX-UHFFFAOYSA-N 1 1 309.450 3.557 20 10 DHCDMO COc1cc(C[N@@H+](C)CCOCC2CC2)c(O)c(C(C)(C)C)c1 ZINC000754739827 1015195185 /nfs/dbraw/zinc/19/51/85/1015195185.db2.gz PYRXSKZZXKPDHD-UHFFFAOYSA-N 1 1 321.461 3.557 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2F)c(O)c1OC ZINC000891593316 1015421956 /nfs/dbraw/zinc/42/19/56/1015421956.db2.gz WTIBTGBMNRPELE-GFCCVEGCSA-N 1 1 319.376 3.742 20 10 DHCDMO COc1ccc(C[N@@H+](C2CC2)C2CCCCC2)c(O)c1OC ZINC000891625678 1015464934 /nfs/dbraw/zinc/46/49/34/1015464934.db2.gz PQVKZLXLIMUYCP-UHFFFAOYSA-N 1 1 305.418 3.707 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1 ZINC000896228123 1015512985 /nfs/dbraw/zinc/51/29/85/1015512985.db2.gz QJAWCYAMMHZXQG-ZDUSSCGKSA-N 1 1 303.299 3.567 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c(O)c1OC ZINC000891781565 1015614505 /nfs/dbraw/zinc/61/45/05/1015614505.db2.gz JFEODKXRHMXNEN-OAHLLOKOSA-N 1 1 305.418 3.564 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000896639610 1015693819 /nfs/dbraw/zinc/69/38/19/1015693819.db2.gz XCSGCYRYUYUPSP-ZFWWWQNUSA-N 1 1 300.377 3.742 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(CC(F)(F)F)cc1 ZINC000896641934 1015694757 /nfs/dbraw/zinc/69/47/57/1015694757.db2.gz OXKCSKCMCWXMJO-UHFFFAOYSA-N 1 1 313.294 3.926 20 10 DHCDMO C[N@H+](Cc1nc2ccccc2n1C(F)F)Cc1ccccc1O ZINC000072629628 1016731205 /nfs/dbraw/zinc/73/12/05/1016731205.db2.gz GEHQMDRYDSSQGC-UHFFFAOYSA-N 1 1 317.339 3.769 20 10 DHCDMO C[N@@H+](Cc1nc2ccccc2n1C(F)F)Cc1ccccc1O ZINC000072629628 1016731214 /nfs/dbraw/zinc/73/12/14/1016731214.db2.gz GEHQMDRYDSSQGC-UHFFFAOYSA-N 1 1 317.339 3.769 20 10 DHCDMO COc1ccc(CC[NH2+][C@H](C)c2ccc(F)cc2O)cc1F ZINC000185333184 1016863642 /nfs/dbraw/zinc/86/36/42/1016863642.db2.gz BITFUAMLFWSLSA-LLVKDONJSA-N 1 1 307.340 3.572 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)CC2(N(C)C)CCC2)cc1C(C)C ZINC000783548615 1016870371 /nfs/dbraw/zinc/87/03/71/1016870371.db2.gz OVHKDZGBMHAQRU-UHFFFAOYSA-N 1 1 304.478 3.740 20 10 DHCDMO Cc1cc(O)c(CN(C)CC2([NH+](C)C)CCC2)cc1C(C)C ZINC000783548615 1016870389 /nfs/dbraw/zinc/87/03/89/1016870389.db2.gz OVHKDZGBMHAQRU-UHFFFAOYSA-N 1 1 304.478 3.740 20 10 DHCDMO COc1cccc(Cl)c1C[NH2+]Cc1c(O)cccc1Cl ZINC000234915634 1032352943 /nfs/dbraw/zinc/35/29/43/1032352943.db2.gz ZEVBBKNEGFFSMN-UHFFFAOYSA-N 1 1 312.196 3.997 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccsc1)C[C@H]1CCCO1 ZINC000160204888 1012019179 /nfs/dbraw/zinc/01/91/79/1012019179.db2.gz APKQJPKOPYCWFL-MRXNPFEDSA-N 1 1 303.427 3.635 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CC[C@@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926904934 1032663379 /nfs/dbraw/zinc/66/33/79/1032663379.db2.gz KDZQUOWTIUDLKY-CWSCBRNRSA-N 1 1 321.314 3.682 20 10 DHCDMO COc1c(F)cc(F)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001143563360 1012891490 /nfs/dbraw/zinc/89/14/90/1012891490.db2.gz XBFWZRWEBHFVHP-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO COc1c(F)cc(F)cc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001143563360 1012891506 /nfs/dbraw/zinc/89/15/06/1012891506.db2.gz XBFWZRWEBHFVHP-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)Cc2cnc(C)s2)c(O)c1 ZINC000179383244 1012971353 /nfs/dbraw/zinc/97/13/53/1012971353.db2.gz DVYUVMYMKPKQAD-UHFFFAOYSA-N 1 1 306.431 3.578 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCc3c(F)cccc3C2)cc1 ZINC001171440437 1032684806 /nfs/dbraw/zinc/68/48/06/1032684806.db2.gz JCFXSTOVZJIQAW-SFHVURJKSA-N 1 1 312.432 3.881 20 10 DHCDMO COc1ccccc1[C@H](C)N(C)Cc1c([O-])cc(F)cc1F ZINC001140584045 1017196703 /nfs/dbraw/zinc/19/67/03/1017196703.db2.gz DRBOANJMNIEMIQ-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO COc1cccc2c1CC[N@@H+](Cc1c(O)cccc1Cl)C2 ZINC000783594075 1017400370 /nfs/dbraw/zinc/40/03/70/1017400370.db2.gz BOZFIYBLQZQISD-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CCc1nc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cs1 ZINC000840933125 1017507503 /nfs/dbraw/zinc/50/75/03/1017507503.db2.gz FNLLPCJZNBKXMF-ZDUSSCGKSA-N 1 1 303.475 3.931 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@H]1CCc3cc(F)c(F)cc3C1)CC2 ZINC001171497821 1032736720 /nfs/dbraw/zinc/73/67/20/1032736720.db2.gz WTQYSAXOWLQJOY-HNNXBMFYSA-N 1 1 315.363 3.586 20 10 DHCDMO CCCN1CCC([NH2+][C@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000161621201 1018275386 /nfs/dbraw/zinc/27/53/86/1018275386.db2.gz LRDIODPKPXRGFE-LJQANCHMSA-N 1 1 303.494 3.668 20 10 DHCDMO COc1c(O)c(C[N@H+](C)[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000278216927 1018378212 /nfs/dbraw/zinc/37/82/12/1018378212.db2.gz LCUCWYSFLQNRAA-GFCCVEGCSA-N 1 1 316.357 3.502 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000278216927 1018378220 /nfs/dbraw/zinc/37/82/20/1018378220.db2.gz LCUCWYSFLQNRAA-GFCCVEGCSA-N 1 1 316.357 3.502 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H](O)c2ccccc2)cc1 ZINC000764821620 1018391396 /nfs/dbraw/zinc/39/13/96/1018391396.db2.gz BAXZBFVKEUCPHV-HXUWFJFHSA-N 1 1 312.457 3.698 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000796682015 1018412087 /nfs/dbraw/zinc/41/20/87/1018412087.db2.gz GOEKBNZFLFOOIL-CVEARBPZSA-N 1 1 322.449 3.936 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000796682016 1018428056 /nfs/dbraw/zinc/42/80/56/1018428056.db2.gz GOEKBNZFLFOOIL-HOTGVXAUSA-N 1 1 322.449 3.936 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCc2ccncc2)cc1 ZINC000764953673 1018432930 /nfs/dbraw/zinc/43/29/30/1018432930.db2.gz FUUCXTNKGHVLMI-UHFFFAOYSA-N 1 1 311.473 3.992 20 10 DHCDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)cn1 ZINC000858135486 1032778732 /nfs/dbraw/zinc/77/87/32/1032778732.db2.gz VTMVFEGKIUYOPH-GFCCVEGCSA-N 1 1 322.403 3.659 20 10 DHCDMO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(N(C)C)cc1 ZINC000765935976 1018897243 /nfs/dbraw/zinc/89/72/43/1018897243.db2.gz OWGYIGNJNIYJAJ-LBPRGKRZSA-N 1 1 301.459 3.937 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)Cc2cnc(C(C)C)nc2)cc1Cl ZINC000825774581 1032811797 /nfs/dbraw/zinc/81/17/97/1032811797.db2.gz YSVYVDJAJKNBFF-UHFFFAOYSA-N 1 1 319.836 3.899 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@]1(C)O ZINC001143103499 1019370580 /nfs/dbraw/zinc/37/05/80/1019370580.db2.gz DRXWZSIACMJQAK-LIRRHRJNSA-N 1 1 305.462 3.673 20 10 DHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000170789010 1019435053 /nfs/dbraw/zinc/43/50/53/1019435053.db2.gz TYOIBBYRTJRTMZ-VXGBXAGGSA-N 1 1 316.376 3.902 20 10 DHCDMO Oc1ccc(Cl)c(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000922334962 1020016761 /nfs/dbraw/zinc/01/67/61/1020016761.db2.gz NIOBQJKYXQEACX-UHFFFAOYSA-N 1 1 303.789 3.660 20 10 DHCDMO CC1CCN(c2ccc(CNc3[nH+]cnc4[nH]ccc43)cc2)CC1 ZINC000731029060 1020053947 /nfs/dbraw/zinc/05/39/47/1020053947.db2.gz ROVJJGDTZAGQMH-UHFFFAOYSA-N 1 1 321.428 3.806 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cc(N(C)C)ccn2)cc1C ZINC000922477935 1020094003 /nfs/dbraw/zinc/09/40/03/1020094003.db2.gz MWZGACNSNCCVNC-UHFFFAOYSA-N 1 1 313.445 3.535 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(Br)cc1F ZINC000731843422 1020157224 /nfs/dbraw/zinc/15/72/24/1020157224.db2.gz FGJNIEWCSSHZBH-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCOCC(F)(F)F)C1CCCC1 ZINC000731848111 1020157852 /nfs/dbraw/zinc/15/78/52/1020157852.db2.gz SFCWCABBFWEXBS-UHFFFAOYSA-N 1 1 317.351 3.716 20 10 DHCDMO C[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1Br ZINC000732202842 1020211964 /nfs/dbraw/zinc/21/19/64/1020211964.db2.gz GOSWVDOJFOOLMG-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(F)ccc1Br ZINC000732202842 1020211976 /nfs/dbraw/zinc/21/19/76/1020211976.db2.gz GOSWVDOJFOOLMG-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NCC[N@H+](C)C2CCCC2)cc1 ZINC000765802053 1020252851 /nfs/dbraw/zinc/25/28/51/1020252851.db2.gz RRFDWHMMHHJDHI-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NCC[N@@H+](C)C2CCCC2)cc1 ZINC000765802053 1020252854 /nfs/dbraw/zinc/25/28/54/1020252854.db2.gz RRFDWHMMHHJDHI-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)cc1C ZINC000091958198 1020328039 /nfs/dbraw/zinc/32/80/39/1020328039.db2.gz ICOFHCCFGSXIAV-WMZOPIPTSA-N 1 1 315.413 3.690 20 10 DHCDMO CCn1c2ccccc2nc1C[NH2+]Cc1c(O)cccc1Cl ZINC000733328121 1020374726 /nfs/dbraw/zinc/37/47/26/1020374726.db2.gz HWHYWVCCFZPIKP-UHFFFAOYSA-N 1 1 315.804 3.705 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000179553435 1020409224 /nfs/dbraw/zinc/40/92/24/1020409224.db2.gz OAEFNWLVUGDXBO-MRXNPFEDSA-N 1 1 311.381 3.501 20 10 DHCDMO COc1cccc(Cl)c1C[N@H+]1CCc2cccc(O)c2C1 ZINC001140730224 1020422332 /nfs/dbraw/zinc/42/23/32/1020422332.db2.gz BNKIVLBOUFVUGA-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CCCC[N@H+](Cc1ncc(Cl)n1C)Cc1ccccc1O ZINC000282560738 1020457982 /nfs/dbraw/zinc/45/79/82/1020457982.db2.gz YKGRDPGFCVVOLA-UHFFFAOYSA-N 1 1 307.825 3.581 20 10 DHCDMO CCCC[N@@H+](Cc1ncc(Cl)n1C)Cc1ccccc1O ZINC000282560738 1020457985 /nfs/dbraw/zinc/45/79/85/1020457985.db2.gz YKGRDPGFCVVOLA-UHFFFAOYSA-N 1 1 307.825 3.581 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490706 1032918266 /nfs/dbraw/zinc/91/82/66/1032918266.db2.gz MHSJNFYLBHJNGX-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490706 1032918277 /nfs/dbraw/zinc/91/82/77/1032918277.db2.gz MHSJNFYLBHJNGX-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CCCC[N@H+](Cc1ncnn1C(C)(C)C)Cc1ccccc1O ZINC000282492448 1020612628 /nfs/dbraw/zinc/61/26/28/1020612628.db2.gz PZLFSQAJJJIKCH-UHFFFAOYSA-N 1 1 316.449 3.541 20 10 DHCDMO CCCC[N@@H+](Cc1ncnn1C(C)(C)C)Cc1ccccc1O ZINC000282492448 1020612634 /nfs/dbraw/zinc/61/26/34/1020612634.db2.gz PZLFSQAJJJIKCH-UHFFFAOYSA-N 1 1 316.449 3.541 20 10 DHCDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000735668496 1020760863 /nfs/dbraw/zinc/76/08/63/1020760863.db2.gz JYLSQRJRDGTEAS-NEPJUHHUSA-N 1 1 309.475 3.721 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCS[C@H](C)[C@H]3C)c2c1 ZINC000735666154 1020761315 /nfs/dbraw/zinc/76/13/15/1020761315.db2.gz CKTTUUVPZARGPG-CHWSQXEVSA-N 1 1 317.454 3.880 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc2c(s1)CCCC2 ZINC000736355128 1020810643 /nfs/dbraw/zinc/81/06/43/1020810643.db2.gz DQXZFLHMNODSFC-GFCCVEGCSA-N 1 1 314.454 3.808 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000738098966 1020860460 /nfs/dbraw/zinc/86/04/60/1020860460.db2.gz MMOOKSJMHFIEDJ-GOSISDBHSA-N 1 1 324.468 3.996 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc3oc4ccccc4c3cc2O)CCCO1 ZINC000738158573 1020863210 /nfs/dbraw/zinc/86/32/10/1020863210.db2.gz MPCZPLROZQCBKU-CYBMUJFWSA-N 1 1 311.381 3.902 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)C1CCC(C(=O)OC(C)(C)C)CC1 ZINC001171930002 1032941282 /nfs/dbraw/zinc/94/12/82/1032941282.db2.gz NBOOYBHWMGFNCN-UHFFFAOYSA-N 1 1 319.445 3.725 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@@H](c2ccccc2)CO1 ZINC000743409060 1021288811 /nfs/dbraw/zinc/28/88/11/1021288811.db2.gz QYTFQLHUZICXEW-MGPUTAFESA-N 1 1 323.436 3.843 20 10 DHCDMO COc1cc(C[NH2+]C(C)(C)C(F)F)c(O)c(C(C)(C)C)c1 ZINC000850281276 1021463652 /nfs/dbraw/zinc/46/36/52/1021463652.db2.gz FSINKARHPZSBQL-UHFFFAOYSA-N 1 1 301.377 3.832 20 10 DHCDMO CC1(C)[C@H](C[NH2+]Cc2cccc(Br)c2O)C1(F)F ZINC000850394223 1021508139 /nfs/dbraw/zinc/50/81/39/1021508139.db2.gz NLSWZAOTBKLPCN-JTQLQIEISA-N 1 1 320.177 3.536 20 10 DHCDMO CC[C@H]([NH2+]CCc1noc2ccccc21)c1ccc(F)cc1O ZINC000850481792 1021557219 /nfs/dbraw/zinc/55/72/19/1021557219.db2.gz BPWVIDGWVQKTSZ-HNNXBMFYSA-N 1 1 314.360 3.956 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)C[C@H](C)O)cc1 ZINC000776522079 1021820670 /nfs/dbraw/zinc/82/06/70/1021820670.db2.gz ZIXVAJAUYCJADG-KRWDZBQOSA-N 1 1 312.457 3.526 20 10 DHCDMO COCC[N@@H+](CCc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000746051807 1021836038 /nfs/dbraw/zinc/83/60/38/1021836038.db2.gz VCGDJTMYJPDLBM-UHFFFAOYSA-N 1 1 313.441 3.700 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)CC1CCCCC1 ZINC000756337967 1021944441 /nfs/dbraw/zinc/94/44/41/1021944441.db2.gz ZXUDYQVVJPVNJE-SFHVURJKSA-N 1 1 303.446 3.954 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172123368 1033023113 /nfs/dbraw/zinc/02/31/13/1033023113.db2.gz CDHVWGIBXKFYBU-ACDBMABISA-N 1 1 315.505 3.590 20 10 DHCDMO CCCC[N@@H+](Cc1cc(OC)ns1)Cc1ccccc1O ZINC000852017629 1022060867 /nfs/dbraw/zinc/06/08/67/1022060867.db2.gz FDRKYQBGHCQOIE-UHFFFAOYSA-N 1 1 306.431 3.660 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCc3ccccc3[C@H]2C)cc1OC ZINC000180076123 1022107898 /nfs/dbraw/zinc/10/78/98/1022107898.db2.gz RLQYEIUWUMYMDQ-CYBMUJFWSA-N 1 1 313.397 3.529 20 10 DHCDMO CCN(C)c1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000766472729 1022122651 /nfs/dbraw/zinc/12/26/51/1022122651.db2.gz BCSPGSXRKCRPGA-KVSKMBFKSA-N 1 1 303.494 3.666 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)no1 ZINC000921197297 1022225612 /nfs/dbraw/zinc/22/56/12/1022225612.db2.gz GLQFNGAAIGPNRO-UHFFFAOYSA-N 1 1 309.413 3.989 20 10 DHCDMO COCC[N@@H+](CCF)Cc1cc2oc3ccccc3c2cc1O ZINC000853548814 1022292505 /nfs/dbraw/zinc/29/25/05/1022292505.db2.gz QNYFKYXLTGTLEB-UHFFFAOYSA-N 1 1 317.360 3.710 20 10 DHCDMO CC[C@]1(C)C[N@@H+](Cc2ccc(N3CCCCC3)c(C)c2)CCO1 ZINC001169340916 1022361501 /nfs/dbraw/zinc/36/15/01/1022361501.db2.gz BYPZEHLJPUVNBU-HXUWFJFHSA-N 1 1 316.489 3.986 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1ccc(F)cc1O ZINC000756449012 1022381490 /nfs/dbraw/zinc/38/14/90/1022381490.db2.gz HFINRJFVIQZZTJ-KBPBESRZSA-N 1 1 308.441 3.692 20 10 DHCDMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n[nH]1 ZINC000186131253 1022554941 /nfs/dbraw/zinc/55/49/41/1022554941.db2.gz XZFFJDCSJUVHCI-TZMCWYRMSA-N 1 1 313.445 3.584 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H]1CCc2ccccc21 ZINC000179907041 1022578440 /nfs/dbraw/zinc/57/84/40/1022578440.db2.gz VIPXKJZPIQLTBW-NRFANRHFSA-N 1 1 322.452 3.643 20 10 DHCDMO CC[N@H+](Cc1cc(OC)ccc1O)Cc1c(F)cccc1F ZINC000180008998 1022603736 /nfs/dbraw/zinc/60/37/36/1022603736.db2.gz KBRKDIIXCMGLDW-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)Cc1c(F)cccc1F ZINC000180008998 1022603740 /nfs/dbraw/zinc/60/37/40/1022603740.db2.gz KBRKDIIXCMGLDW-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CN1CCC[C@@H]1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396347 1022711019 /nfs/dbraw/zinc/71/10/19/1022711019.db2.gz DKQXMMBWSNZKMS-QGZVFWFLSA-N 1 1 302.462 3.621 20 10 DHCDMO CN1CCC[C@@H]1CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396347 1022711033 /nfs/dbraw/zinc/71/10/33/1022711033.db2.gz DKQXMMBWSNZKMS-QGZVFWFLSA-N 1 1 302.462 3.621 20 10 DHCDMO CCC[N@@H+](CC(=O)Nc1ccc(C)cc1)Cc1ccccc1O ZINC000069009960 1022860122 /nfs/dbraw/zinc/86/01/22/1022860122.db2.gz YCNTVODLKKCSEG-UHFFFAOYSA-N 1 1 312.413 3.551 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](CC)CCO)cc1 ZINC000768140164 1022905709 /nfs/dbraw/zinc/90/57/09/1022905709.db2.gz DAQJMYQUKIXNCH-UHFFFAOYSA-N 1 1 312.457 3.527 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1OC ZINC000768168165 1022909925 /nfs/dbraw/zinc/90/99/25/1022909925.db2.gz ARGWASUZSLWMSF-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2c(O)cccc2OC)C2CC2)cc1 ZINC000768199198 1022913955 /nfs/dbraw/zinc/91/39/55/1022913955.db2.gz FVKONVZHLJHCBF-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(OC)c(F)c2)c(O)c1 ZINC000768201517 1022914231 /nfs/dbraw/zinc/91/42/31/1022914231.db2.gz YHHKRSJQSJSEOZ-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCC[C@@H]2CO)cc1 ZINC000768239751 1022923798 /nfs/dbraw/zinc/92/37/98/1022923798.db2.gz MIAJASNEZNMHCG-OAQYLSRUSA-N 1 1 324.468 3.670 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000768214926 1022928774 /nfs/dbraw/zinc/92/87/74/1022928774.db2.gz HMGIFQOXIXWUGJ-UHFFFAOYSA-N 1 1 313.372 3.829 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000768248988 1022932978 /nfs/dbraw/zinc/93/29/78/1022932978.db2.gz NBNDFLNTKVYVQI-INIZCTEOSA-N 1 1 315.438 3.691 20 10 DHCDMO CCC(CC)[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000768257128 1022936812 /nfs/dbraw/zinc/93/68/12/1022936812.db2.gz HJZYMJJPAUDMJZ-UHFFFAOYSA-N 1 1 320.452 3.815 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000768330062 1022945074 /nfs/dbraw/zinc/94/50/74/1022945074.db2.gz NCVFMFXKZZWNGN-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO CC[N@@H+](CCc1cccs1)Cc1cc(OC)c(C)cc1O ZINC000768439994 1022964488 /nfs/dbraw/zinc/96/44/88/1022964488.db2.gz MWCPDNSURMRQNQ-UHFFFAOYSA-N 1 1 305.443 3.835 20 10 DHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(OC)c(C)cc2O)C1 ZINC000768444645 1022968322 /nfs/dbraw/zinc/96/83/22/1022968322.db2.gz BAFVAKPBXHLAAC-HNNXBMFYSA-N 1 1 309.475 3.817 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C)[C@H]3CCCC[C@@H]32)cc1OC ZINC000768439443 1022968978 /nfs/dbraw/zinc/96/89/78/1022968978.db2.gz LZPULRBAHVYRPB-IMJJTQAJSA-N 1 1 319.445 3.810 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000768480592 1022970547 /nfs/dbraw/zinc/97/05/47/1022970547.db2.gz AYYBDVUKHNHJPR-UHFFFAOYSA-N 1 1 308.356 3.638 20 10 DHCDMO CCC(CC)C[N@@H+](CC)Cc1ccc(N2CCOCC2)cc1 ZINC000768506797 1022975236 /nfs/dbraw/zinc/97/52/36/1022975236.db2.gz GOTSWPNVDZPACA-UHFFFAOYSA-N 1 1 304.478 3.781 20 10 DHCDMO COc1cc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c(O)cc1C ZINC000768466480 1022975441 /nfs/dbraw/zinc/97/54/41/1022975441.db2.gz QSWHQAPKCDEEPQ-KRWDZBQOSA-N 1 1 319.445 3.633 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@H]2C2CC2)c1 ZINC000781913751 1022981132 /nfs/dbraw/zinc/98/11/32/1022981132.db2.gz SZGDSIMKJARXRI-AWEZNQCLSA-N 1 1 310.235 3.838 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000781913751 1022981141 /nfs/dbraw/zinc/98/11/41/1022981141.db2.gz SZGDSIMKJARXRI-AWEZNQCLSA-N 1 1 310.235 3.838 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@]2(C)Cc2ccccc2)c1O ZINC000768534557 1022983713 /nfs/dbraw/zinc/98/37/13/1022983713.db2.gz FPIBOSMAODDMMH-HXUWFJFHSA-N 1 1 311.425 3.998 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](CCOC)Cc2ccco2)cc1 ZINC000768587443 1022998269 /nfs/dbraw/zinc/99/82/69/1022998269.db2.gz XFAOCEORNRKMCT-UHFFFAOYSA-N 1 1 316.445 3.774 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)c(F)c1)Cc1ccccn1 ZINC000768927556 1023057341 /nfs/dbraw/zinc/05/73/41/1023057341.db2.gz YHDZTAFYVVSSAA-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO c1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000769008112 1023076999 /nfs/dbraw/zinc/07/69/99/1023076999.db2.gz NUUYOTSTSDLANF-HXUWFJFHSA-N 1 1 314.473 3.678 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000769333270 1023124662 /nfs/dbraw/zinc/12/46/62/1023124662.db2.gz JARFFKQQVNGRFE-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCO[C@](C)(c3ccccc3)C2)cc1 ZINC000769398293 1023139146 /nfs/dbraw/zinc/13/91/46/1023139146.db2.gz JJGGEQCAIOVEAX-FQEVSTJZSA-N 1 1 310.441 3.500 20 10 DHCDMO COc1cccc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)c1O ZINC000769404024 1023141041 /nfs/dbraw/zinc/14/10/41/1023141041.db2.gz HQHOOIGLLFAFCZ-UHFFFAOYSA-N 1 1 315.388 3.747 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000769405560 1023142831 /nfs/dbraw/zinc/14/28/31/1023142831.db2.gz XTTRUGHCENSYBV-IBGZPJMESA-N 1 1 317.521 3.697 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000769481888 1023151591 /nfs/dbraw/zinc/15/15/91/1023151591.db2.gz ANRPKFDXLQNIKQ-XLIONFOSSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCN(CC)C[C@H]2C)cc1 ZINC000769481888 1023151603 /nfs/dbraw/zinc/15/16/03/1023151603.db2.gz ANRPKFDXLQNIKQ-XLIONFOSSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCN(CC)C[C@H]2C)cc1 ZINC000769481888 1023151605 /nfs/dbraw/zinc/15/16/05/1023151605.db2.gz ANRPKFDXLQNIKQ-XLIONFOSSA-N 1 1 317.521 3.695 20 10 DHCDMO CC[N@H+](Cc1c(O)cccc1Cl)C[C@@H](O)c1ccc(C)cc1 ZINC000769484885 1023152369 /nfs/dbraw/zinc/15/23/69/1023152369.db2.gz WLLVTESUIZMCRD-GOSISDBHSA-N 1 1 319.832 3.910 20 10 DHCDMO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H](c2ccccc2)CO1 ZINC000769490980 1023154523 /nfs/dbraw/zinc/15/45/23/1023154523.db2.gz ZZPWYPIQMZVKRI-OXJNMPFZSA-N 1 1 310.441 3.715 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H](c2ccccc2)CO1 ZINC000769490980 1023154526 /nfs/dbraw/zinc/15/45/26/1023154526.db2.gz ZZPWYPIQMZVKRI-OXJNMPFZSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000769497795 1023167008 /nfs/dbraw/zinc/16/70/08/1023167008.db2.gz BHULPBXEVHQXMB-WBVHZDCISA-N 1 1 311.425 3.854 20 10 DHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1c(O)cccc1Cl ZINC000769499876 1023168461 /nfs/dbraw/zinc/16/84/61/1023168461.db2.gz XFKXPFWWXGRCIE-HNNXBMFYSA-N 1 1 319.832 3.819 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1O ZINC000769508684 1023170303 /nfs/dbraw/zinc/17/03/03/1023170303.db2.gz UPABIXVUNGQLCT-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769537053 1023175796 /nfs/dbraw/zinc/17/57/96/1023175796.db2.gz HCQSIOZKZVJDNR-OAHLLOKOSA-N 1 1 308.441 3.530 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000769852559 1023229193 /nfs/dbraw/zinc/22/91/93/1023229193.db2.gz IKDHJQHFZGPMND-UHFFFAOYSA-N 1 1 310.441 3.579 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC000770376148 1023300023 /nfs/dbraw/zinc/30/00/23/1023300023.db2.gz VDPRMTCLFPHKME-OALUTQOASA-N 1 1 316.489 3.781 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC000770376147 1023301171 /nfs/dbraw/zinc/30/11/71/1023301171.db2.gz VDPRMTCLFPHKME-MOPGFXCFSA-N 1 1 316.489 3.781 20 10 DHCDMO Cc1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c(O)c1 ZINC000876804189 1033146570 /nfs/dbraw/zinc/14/65/70/1033146570.db2.gz NJHKSAXROSNMEX-RDJZCZTQSA-N 1 1 317.454 3.850 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000876778919 1033140965 /nfs/dbraw/zinc/14/09/65/1033140965.db2.gz RZBNAXDDRIIHML-GUYCJALGSA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000876778664 1033141668 /nfs/dbraw/zinc/14/16/68/1033141668.db2.gz LKAANDZDTMGVCG-SUMWQHHRSA-N 1 1 303.427 3.724 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)CN1CCC[C@H](C)C1)c1ccc(F)cc1O ZINC000796703175 1023900231 /nfs/dbraw/zinc/90/02/31/1023900231.db2.gz FQULDICZRXIWQV-VBQJREDUSA-N 1 1 308.441 3.692 20 10 DHCDMO CCC(CC)(CO)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788670344 1023923123 /nfs/dbraw/zinc/92/31/23/1023923123.db2.gz JSIWMHZWIPSKOE-NSHDSACASA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788695203 1023928043 /nfs/dbraw/zinc/92/80/43/1023928043.db2.gz ZEISVZNECLAQSW-MNOVXSKESA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccccc1 ZINC000093867480 1023942546 /nfs/dbraw/zinc/94/25/46/1023942546.db2.gz KWNPYCAOAQBURP-UTKZUKDTSA-N 1 1 322.452 3.716 20 10 DHCDMO CCc1noc(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000268129317 1024073039 /nfs/dbraw/zinc/07/30/39/1024073039.db2.gz BXFKKTMXHFONPV-UHFFFAOYSA-N 1 1 313.445 3.776 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)cc1 ZINC000130047828 1024126032 /nfs/dbraw/zinc/12/60/32/1024126032.db2.gz HUPKEJNBJRIXTB-KRWDZBQOSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882880072 1024157164 /nfs/dbraw/zinc/15/71/64/1024157164.db2.gz AOBOZNTUYVGZID-SNVBAGLBSA-N 1 1 323.339 3.538 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)cc1 ZINC000130673073 1024197101 /nfs/dbraw/zinc/19/71/01/1024197101.db2.gz FHOIQZMBGODVAP-UHFFFAOYSA-N 1 1 323.234 3.740 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000883049443 1024222828 /nfs/dbraw/zinc/22/28/28/1024222828.db2.gz MTRQIISNDFBFFH-AWEZNQCLSA-N 1 1 311.372 3.642 20 10 DHCDMO CN1CCC[C@@H]([NH2+]Cc2cc(F)cc(F)c2O)c2ccccc21 ZINC000883136986 1024256507 /nfs/dbraw/zinc/25/65/07/1024256507.db2.gz SZDSQQMRPKMIKX-MRXNPFEDSA-N 1 1 318.367 3.731 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000883186851 1024277771 /nfs/dbraw/zinc/27/77/71/1024277771.db2.gz AKGREEYZTNSCIO-MRXNPFEDSA-N 1 1 304.340 3.696 20 10 DHCDMO COCC[N@@H+](Cc1c(O)ccc2ccncc21)[C@H]1CC[C@H](C)C1 ZINC000790476863 1024309645 /nfs/dbraw/zinc/30/96/45/1024309645.db2.gz FDVWZHALFPJFEF-HOCLYGCPSA-N 1 1 314.429 3.577 20 10 DHCDMO CC(C)OCC[C@@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001172450289 1033207589 /nfs/dbraw/zinc/20/75/89/1033207589.db2.gz WPWPGQYFUNWAQO-GFCCVEGCSA-N 1 1 322.836 3.887 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1c[nH]c2ccccc12 ZINC000790944645 1024401739 /nfs/dbraw/zinc/40/17/39/1024401739.db2.gz IYJARDUHBFOUBZ-UHFFFAOYSA-N 1 1 318.779 3.998 20 10 DHCDMO C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)N1CCCC[C@H]1C ZINC000790948856 1024402025 /nfs/dbraw/zinc/40/20/25/1024402025.db2.gz ISLXJMGWCUOIHU-VXGBXAGGSA-N 1 1 314.832 3.537 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1COc2ccccc2C1 ZINC000790946449 1024403000 /nfs/dbraw/zinc/40/30/00/1024403000.db2.gz BNXRLRFMFYRPII-NSHDSACASA-N 1 1 321.779 3.526 20 10 DHCDMO C[C@](CO)([NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790967191 1024408884 /nfs/dbraw/zinc/40/88/84/1024408884.db2.gz GJGPXEDMPDFNCW-MRXNPFEDSA-N 1 1 315.816 3.606 20 10 DHCDMO CC(C)(O)c1ccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790989397 1024411836 /nfs/dbraw/zinc/41/18/36/1024411836.db2.gz CKOSKCUBFBWPGL-UHFFFAOYSA-N 1 1 323.795 3.702 20 10 DHCDMO COc1cccc(O)c1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC000883383015 1024415670 /nfs/dbraw/zinc/41/56/70/1024415670.db2.gz RMQZTNYTIFLYFJ-MAUKXSAKSA-N 1 1 301.361 3.516 20 10 DHCDMO CC(C)(C[NH2+]Cc1c(O)ccc(Cl)c1F)[C@H]1CCCCO1 ZINC000790976573 1024421924 /nfs/dbraw/zinc/42/19/24/1024421924.db2.gz IGFUZXRHKGVJBG-CQSZACIVSA-N 1 1 315.816 3.870 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCC[C@@H]1CCCC[C@H]1O ZINC000790976997 1024422272 /nfs/dbraw/zinc/42/22/72/1024422272.db2.gz DHYYVWNCFAQZKP-SMDDNHRTSA-N 1 1 315.816 3.606 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000790980857 1024423439 /nfs/dbraw/zinc/42/34/39/1024423439.db2.gz QDCQPDXEOUUEMG-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790980664 1024423680 /nfs/dbraw/zinc/42/36/80/1024423680.db2.gz PQZVJCMYTRVPND-HZMBPMFUSA-N 1 1 315.816 3.868 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1O ZINC000271168924 1024463370 /nfs/dbraw/zinc/46/33/70/1024463370.db2.gz PGFTUPLQUIFRQU-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1O ZINC000271168926 1024464569 /nfs/dbraw/zinc/46/45/69/1024464569.db2.gz PGFTUPLQUIFRQU-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310167923 1024494859 /nfs/dbraw/zinc/49/48/59/1024494859.db2.gz SPAAPPAZLFVEPJ-HKUYNNGSSA-N 1 1 324.468 3.701 20 10 DHCDMO CC[C@@H]([NH2+]Cc1c(C)cc(C)nc1OC)c1ccc(F)cc1O ZINC000796740273 1024680425 /nfs/dbraw/zinc/68/04/25/1024680425.db2.gz CKPIZGQCVIZTQZ-MRXNPFEDSA-N 1 1 318.392 3.793 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1nc(C(F)(F)F)cs1 ZINC000279116086 1024744314 /nfs/dbraw/zinc/74/43/14/1024744314.db2.gz WNIFPTBUIRTCRK-SSDOTTSWSA-N 1 1 320.311 3.857 20 10 DHCDMO COC(C)(C)C[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792841091 1024813325 /nfs/dbraw/zinc/81/33/25/1024813325.db2.gz ZEUVJFSBEWDWDO-UHFFFAOYSA-N 1 1 318.383 3.628 20 10 DHCDMO c1cc2c(cc1CN[C@@H]1CC[N@H+](C3CCCCC3)C1)CCCO2 ZINC001203181281 1033240166 /nfs/dbraw/zinc/24/01/66/1033240166.db2.gz SIFPMLZOCKHZLG-GOSISDBHSA-N 1 1 314.473 3.508 20 10 DHCDMO c1cc2c(cc1C[NH2+][C@@H]1CCN(C3CCCCC3)C1)CCCO2 ZINC001203181281 1033240178 /nfs/dbraw/zinc/24/01/78/1033240178.db2.gz SIFPMLZOCKHZLG-GOSISDBHSA-N 1 1 314.473 3.508 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)cc1F ZINC000793609665 1025128156 /nfs/dbraw/zinc/12/81/56/1025128156.db2.gz QYFIXSSLUXFPAN-RBUKOAKNSA-N 1 1 320.452 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)cc1C(C)C ZINC000884483364 1025136665 /nfs/dbraw/zinc/13/66/65/1025136665.db2.gz RINXOFHVHNQEPZ-HNAYVOBHSA-N 1 1 303.446 3.825 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCOC[C@@H](C3CCC3)C1)CCCC2 ZINC000793742609 1025159567 /nfs/dbraw/zinc/15/95/67/1025159567.db2.gz BXLDYUBPXZMVQY-IBGZPJMESA-N 1 1 315.457 3.520 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000793787615 1025161672 /nfs/dbraw/zinc/16/16/72/1025161672.db2.gz DIFAGXMARXHKOP-CYBMUJFWSA-N 1 1 302.443 3.515 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1c(O)cccc1F ZINC000886491978 1025650220 /nfs/dbraw/zinc/65/02/20/1025650220.db2.gz YQXLBNRORCYXBA-NWDGAFQWSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1c(O)cccc1F ZINC000886496660 1025651494 /nfs/dbraw/zinc/65/14/94/1025651494.db2.gz BYFYFVZMDIFWAE-SMDDNHRTSA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1c(O)cccc1F ZINC000886495406 1025652617 /nfs/dbraw/zinc/65/26/17/1025652617.db2.gz XANYMZVIRVWLMZ-JTQLQIEISA-N 1 1 311.303 3.984 20 10 DHCDMO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1c(O)cccc1F ZINC000886509889 1025660815 /nfs/dbraw/zinc/66/08/15/1025660815.db2.gz IFKJWQLGRXZUME-AWEZNQCLSA-N 1 1 314.404 3.851 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000886512346 1025668325 /nfs/dbraw/zinc/66/83/25/1025668325.db2.gz CQBSFXVUUGCPED-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc2c1OCCCO2)c1c(O)cccc1F ZINC000886553706 1025701468 /nfs/dbraw/zinc/70/14/68/1025701468.db2.gz UAXBJQOFPOGRSX-LBPRGKRZSA-N 1 1 317.360 3.543 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1c(O)cccc1F ZINC000886557203 1025704260 /nfs/dbraw/zinc/70/42/60/1025704260.db2.gz WAJFEHNZIJFFRL-WNDFPBNNSA-N 1 1 321.417 3.681 20 10 DHCDMO CCCCn1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(C)n1 ZINC000886561711 1025707051 /nfs/dbraw/zinc/70/70/51/1025707051.db2.gz HCLKOQPSPRMJHR-ZDUSSCGKSA-N 1 1 305.397 3.687 20 10 DHCDMO CCSc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccn1 ZINC000886594039 1025728065 /nfs/dbraw/zinc/72/80/65/1025728065.db2.gz FCOIXGRIIPFWPT-LLVKDONJSA-N 1 1 306.406 3.889 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000886615781 1025739697 /nfs/dbraw/zinc/73/96/97/1025739697.db2.gz NOGXPQXIQFSAFW-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1OCCc2sccc21)c1c(O)cccc1F ZINC000886613937 1025740513 /nfs/dbraw/zinc/74/05/13/1025740513.db2.gz ISZRCJNGUAALGW-PSVSLLHZSA-N 1 1 321.417 3.946 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886617790 1025745028 /nfs/dbraw/zinc/74/50/28/1025745028.db2.gz YRHNHLXYHXNLAB-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886623916 1025748236 /nfs/dbraw/zinc/74/82/36/1025748236.db2.gz SRPPVBFFDDTXGA-KBPBESRZSA-N 1 1 302.393 3.988 20 10 DHCDMO CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886637756 1025755315 /nfs/dbraw/zinc/75/53/15/1025755315.db2.gz DXFNIPMXLFHXOH-AGRHKRQWSA-N 1 1 317.404 3.940 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Br)ccc1O ZINC000806179224 1025836138 /nfs/dbraw/zinc/83/61/38/1025836138.db2.gz BJYVSPBJVKMNEL-UFBFGSQYSA-N 1 1 320.177 3.993 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886776843 1025897437 /nfs/dbraw/zinc/89/74/37/1025897437.db2.gz QXRPSHNRZFCNFO-SUMWQHHRSA-N 1 1 307.409 3.921 20 10 DHCDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000093838692 1026128722 /nfs/dbraw/zinc/12/87/22/1026128722.db2.gz XFPRQQOTOXARRL-GOSISDBHSA-N 1 1 302.462 3.535 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(O)ccc3ccncc32)no1 ZINC000747448119 1026184506 /nfs/dbraw/zinc/18/45/06/1026184506.db2.gz BNTGMVGRUVBJRV-KRWDZBQOSA-N 1 1 309.369 3.574 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1c1cccs1 ZINC000808221350 1026230837 /nfs/dbraw/zinc/23/08/37/1026230837.db2.gz FPUUIMGNSAXNAJ-INIZCTEOSA-N 1 1 317.410 3.766 20 10 DHCDMO CCOC1CC([N@@H+](C)Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000808213833 1026234427 /nfs/dbraw/zinc/23/44/27/1026234427.db2.gz QTQUREMQOHGGGL-UHFFFAOYSA-N 1 1 321.461 3.698 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CC[C@H](O)c2ccccc2)C2CC2)cc1 ZINC000808711066 1026360477 /nfs/dbraw/zinc/36/04/77/1026360477.db2.gz UJLQJCGISHZVDR-NRFANRHFSA-N 1 1 324.468 3.841 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1COc2ccc(F)cc2C1)c1ccc(F)cc1O ZINC000808730061 1026382459 /nfs/dbraw/zinc/38/24/59/1026382459.db2.gz SAXDIRLDRKHYNO-HOCLYGCPSA-N 1 1 319.351 3.715 20 10 DHCDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(Cl)ccc1O ZINC000809688483 1026595860 /nfs/dbraw/zinc/59/58/60/1026595860.db2.gz KHJZBCAYQMBLCY-UHFFFAOYSA-N 1 1 320.776 3.628 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000809767338 1026605095 /nfs/dbraw/zinc/60/50/95/1026605095.db2.gz ZXSIHLAKKGMCDW-UHFFFAOYSA-N 1 1 324.468 3.797 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000809758638 1026617411 /nfs/dbraw/zinc/61/74/11/1026617411.db2.gz SBVIQPCGXQSESQ-KBPBESRZSA-N 1 1 309.837 3.684 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1F ZINC000809758488 1026618337 /nfs/dbraw/zinc/61/83/37/1026618337.db2.gz OGPIRNWUKUIANZ-NVXWUHKLSA-N 1 1 320.452 3.530 20 10 DHCDMO CC[C@@H]([NH2+]CC1([C@@H](C)CCO)CCC1)c1ccc(F)cc1O ZINC000796856871 1026690697 /nfs/dbraw/zinc/69/06/97/1026690697.db2.gz NJRAPUJSOLCSET-XJKSGUPXSA-N 1 1 309.425 3.761 20 10 DHCDMO CCC[N@H+](CC)C[C@H](C)N[C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810263069 1026722020 /nfs/dbraw/zinc/72/20/20/1026722020.db2.gz KSCKOWYKBGVYQH-KCQAQPDRSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810263069 1026722028 /nfs/dbraw/zinc/72/20/28/1026722028.db2.gz KSCKOWYKBGVYQH-KCQAQPDRSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@H+](CC)C[C@H](C)N[C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810263072 1026722847 /nfs/dbraw/zinc/72/28/47/1026722847.db2.gz KSCKOWYKBGVYQH-YDHLFZDLSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@H](C)N[C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810263072 1026722857 /nfs/dbraw/zinc/72/28/57/1026722857.db2.gz KSCKOWYKBGVYQH-YDHLFZDLSA-N 1 1 308.441 3.790 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(Cl)c(F)cc2[O-])s1 ZINC000295390507 1027250155 /nfs/dbraw/zinc/25/01/55/1027250155.db2.gz PUMQDQCWENHTNL-UHFFFAOYSA-N 1 1 314.813 3.624 20 10 DHCDMO Cc1cnc(CC[N@@H+](C)Cc2cc(Cl)c(F)cc2O)s1 ZINC000295390507 1027250169 /nfs/dbraw/zinc/25/01/69/1027250169.db2.gz PUMQDQCWENHTNL-UHFFFAOYSA-N 1 1 314.813 3.624 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(Cl)c(F)cc2O)s1 ZINC000295390507 1027250178 /nfs/dbraw/zinc/25/01/78/1027250178.db2.gz PUMQDQCWENHTNL-UHFFFAOYSA-N 1 1 314.813 3.624 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000773889528 1027677684 /nfs/dbraw/zinc/67/76/84/1027677684.db2.gz XCDHULMWRUXARB-AWEZNQCLSA-N 1 1 300.368 3.917 20 10 DHCDMO C[C@@H]1C[C@@H](C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCO1 ZINC000778995693 1027734180 /nfs/dbraw/zinc/73/41/80/1027734180.db2.gz FRSJEOZTMHZCNS-WBVHZDCISA-N 1 1 302.462 3.532 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000364504984 1027832326 /nfs/dbraw/zinc/83/23/26/1027832326.db2.gz PNLMXLYBKKVVQE-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000364504984 1027832337 /nfs/dbraw/zinc/83/23/37/1027832337.db2.gz PNLMXLYBKKVVQE-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO CCc1nccn1[C@@H]1CCC[N@H+]([C@H](CC)c2ccccc2O)C1 ZINC000364622941 1027856501 /nfs/dbraw/zinc/85/65/01/1027856501.db2.gz MLHLWJXPJVYNJZ-NVXWUHKLSA-N 1 1 313.445 3.939 20 10 DHCDMO CSC[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000814178937 1027915204 /nfs/dbraw/zinc/91/52/04/1027915204.db2.gz JRLRITADKCADLX-JTQLQIEISA-N 1 1 303.830 3.760 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000814178937 1027915219 /nfs/dbraw/zinc/91/52/19/1027915219.db2.gz JRLRITADKCADLX-JTQLQIEISA-N 1 1 303.830 3.760 20 10 DHCDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(O)cc1C ZINC000814229884 1027965068 /nfs/dbraw/zinc/96/50/68/1027965068.db2.gz GJZREZLEYRAKHX-SFHVURJKSA-N 1 1 312.413 3.687 20 10 DHCDMO Cc1cc(C[N@@H+](C)CC2CCOCC2)ccc1N1CCCCC1 ZINC000828589721 1028030351 /nfs/dbraw/zinc/03/03/51/1028030351.db2.gz KLKGVSMTNUZQHI-UHFFFAOYSA-N 1 1 316.489 3.844 20 10 DHCDMO CC[C@H]([NH2+]C[C@]1(C)CCO[C@@H]1C1CC1)c1ccc(F)cc1O ZINC000367584970 1028208222 /nfs/dbraw/zinc/20/82/22/1028208222.db2.gz CAJUSTPDFDWLBS-JQHSSLGASA-N 1 1 307.409 3.777 20 10 DHCDMO C[C@@H](c1nccn1-c1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000367807282 1028242199 /nfs/dbraw/zinc/24/21/99/1028242199.db2.gz SGWXGSVWPPTYGK-HNNXBMFYSA-N 1 1 307.397 3.771 20 10 DHCDMO C[C@@H](c1nccn1-c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000367807282 1028242211 /nfs/dbraw/zinc/24/22/11/1028242211.db2.gz SGWXGSVWPPTYGK-HNNXBMFYSA-N 1 1 307.397 3.771 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@H+]2[C@H](CC)c2ccccc2O)no1 ZINC000368030910 1028283149 /nfs/dbraw/zinc/28/31/49/1028283149.db2.gz QKHWLAOHRMXLAH-KGLIPLIRSA-N 1 1 301.390 3.626 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@@H+]2[C@H](CC)c2ccccc2O)no1 ZINC000368030910 1028283169 /nfs/dbraw/zinc/28/31/69/1028283169.db2.gz QKHWLAOHRMXLAH-KGLIPLIRSA-N 1 1 301.390 3.626 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCCC[C@@H]2C[C@H](C)O)ccc1N(C)C ZINC000815118500 1028367707 /nfs/dbraw/zinc/36/77/07/1028367707.db2.gz WJGZWDXRRHULPL-FUHWJXTLSA-N 1 1 304.478 3.577 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000815102768 1028380254 /nfs/dbraw/zinc/38/02/54/1028380254.db2.gz LDTMEGJJCABHKE-AWEZNQCLSA-N 1 1 300.368 3.835 20 10 DHCDMO C[C@@H]([NH2+]CCN1CCCCC1)c1cccc(C(F)(F)F)c1O ZINC000815556852 1028542127 /nfs/dbraw/zinc/54/21/27/1028542127.db2.gz GNWKUBWMSCHIDX-GFCCVEGCSA-N 1 1 316.367 3.548 20 10 DHCDMO CCC[C@](C)(O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815579688 1028552158 /nfs/dbraw/zinc/55/21/58/1028552158.db2.gz SHOQTFANWFTKDS-YGRLFVJLSA-N 1 1 305.340 3.613 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC=CO1)c1cccc(C(F)(F)F)c1O ZINC000815618209 1028571724 /nfs/dbraw/zinc/57/17/24/1028571724.db2.gz GTKUOQDBGMDUAD-WDEREUQCSA-N 1 1 301.308 3.754 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)CC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000815621940 1028574246 /nfs/dbraw/zinc/57/42/46/1028574246.db2.gz HPGINCOJASJSDM-JQWIXIFHSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625464 1028577030 /nfs/dbraw/zinc/57/70/30/1028577030.db2.gz FAVROVWPGPHSRD-PTRXPTGYSA-N 1 1 305.365 3.813 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625463 1028577242 /nfs/dbraw/zinc/57/72/42/1028577242.db2.gz FAVROVWPGPHSRD-HOTUBEGUSA-N 1 1 305.365 3.813 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000815627557 1028578284 /nfs/dbraw/zinc/57/82/84/1028578284.db2.gz DDAVFNJZONAEOI-HZMBPMFUSA-N 1 1 317.351 3.613 20 10 DHCDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000779165601 1028585597 /nfs/dbraw/zinc/58/55/97/1028585597.db2.gz JRDFTPJMDYHKIT-IBGZPJMESA-N 1 1 311.425 3.795 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@@H]2CCO)cc1 ZINC000779202603 1028703973 /nfs/dbraw/zinc/70/39/73/1028703973.db2.gz PZBXTZGOVMVFOR-GOSISDBHSA-N 1 1 304.478 3.660 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000371410876 1028704059 /nfs/dbraw/zinc/70/40/59/1028704059.db2.gz IAMFXYCKSCJMHR-INIZCTEOSA-N 1 1 319.408 3.715 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)cc1 ZINC000371411184 1028706088 /nfs/dbraw/zinc/70/60/88/1028706088.db2.gz MEGCOABJZMWLPC-GOSISDBHSA-N 1 1 324.472 3.702 20 10 DHCDMO C[C@@H]1CCSCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000189918854 1028711794 /nfs/dbraw/zinc/71/17/94/1028711794.db2.gz RPSOLLRZYKRBDU-GFCCVEGCSA-N 1 1 309.475 3.723 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H]2CN2CCCCC2)ccc2ccccc21 ZINC000816494481 1028899002 /nfs/dbraw/zinc/89/90/02/1028899002.db2.gz NFIFDHBPFFAOBZ-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(CN2CCC[C@H]2C[NH+]2CCCCC2)ccc2ccccc21 ZINC000816494481 1028899018 /nfs/dbraw/zinc/89/90/18/1028899018.db2.gz NFIFDHBPFFAOBZ-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)ccc2ccccc21 ZINC000816499322 1028904831 /nfs/dbraw/zinc/90/48/31/1028904831.db2.gz LJZGGLQHYJOLBM-QGZVFWFLSA-N 1 1 307.397 3.996 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@@H](N3CCCCC3)C2)ccc2ccccc21 ZINC000816503544 1028908469 /nfs/dbraw/zinc/90/84/69/1028908469.db2.gz CAHFEZUCNZWDSR-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(CN2CC[C@@H]([NH+]3CCCCC3)C2)ccc2ccccc21 ZINC000816503544 1028908475 /nfs/dbraw/zinc/90/84/75/1028908475.db2.gz CAHFEZUCNZWDSR-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)ccc1F ZINC000816499699 1028909175 /nfs/dbraw/zinc/90/91/75/1028909175.db2.gz YFGAIDBFMSSBKH-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CCCO[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816508156 1028913252 /nfs/dbraw/zinc/91/32/52/1028913252.db2.gz DJTUYQFEYBXPIT-ZDUSSCGKSA-N 1 1 315.816 3.966 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816508156 1028913271 /nfs/dbraw/zinc/91/32/71/1028913271.db2.gz DJTUYQFEYBXPIT-ZDUSSCGKSA-N 1 1 315.816 3.966 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000816516226 1028920368 /nfs/dbraw/zinc/92/03/68/1028920368.db2.gz YNLNVXHBAGAZCQ-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO CC(C)C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816560773 1028944576 /nfs/dbraw/zinc/94/45/76/1028944576.db2.gz ZXONJXUZCNSELG-OLZOCXBDSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCSCC(F)(F)F ZINC000816559013 1028946730 /nfs/dbraw/zinc/94/67/30/1028946730.db2.gz UVXMDOULEKJMCU-UHFFFAOYSA-N 1 1 317.735 3.570 20 10 DHCDMO C[C@@H](CC[NH2+]Cc1ccc2ccccc2c1[O-])[NH+]1CCCCC1 ZINC000816567916 1028949999 /nfs/dbraw/zinc/94/99/99/1028949999.db2.gz PEYWXFNJOSDJOO-INIZCTEOSA-N 1 1 312.457 3.900 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000816573893 1028951384 /nfs/dbraw/zinc/95/13/84/1028951384.db2.gz PFJPKLLSPRNYKZ-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000816573893 1028951397 /nfs/dbraw/zinc/95/13/97/1028951397.db2.gz PFJPKLLSPRNYKZ-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594755 1028955110 /nfs/dbraw/zinc/95/51/10/1028955110.db2.gz OGSDGCXSWYGKJE-IONNQARKSA-N 1 1 311.706 3.957 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594755 1028955121 /nfs/dbraw/zinc/95/51/21/1028955121.db2.gz OGSDGCXSWYGKJE-IONNQARKSA-N 1 1 311.706 3.957 20 10 DHCDMO CCCC[N@@H+](Cc1cnn(C)c1Cl)Cc1ccccc1O ZINC000816601217 1028954547 /nfs/dbraw/zinc/95/45/47/1028954547.db2.gz VJVWOPMUSRTXQC-UHFFFAOYSA-N 1 1 307.825 3.581 20 10 DHCDMO C[N@H+]1CCN(Cc2cc(Cl)cc(F)c2O)c2ccccc2C1 ZINC000816618161 1028962767 /nfs/dbraw/zinc/96/27/67/1028962767.db2.gz QBHHKYYWWMGQAD-UHFFFAOYSA-N 1 1 320.795 3.637 20 10 DHCDMO CN(C)c1ccccc1C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816612999 1028964785 /nfs/dbraw/zinc/96/47/85/1028964785.db2.gz DZBJTLWJOUSMHO-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816612999 1028964797 /nfs/dbraw/zinc/96/47/97/1028964797.db2.gz DZBJTLWJOUSMHO-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CCc1ccc([C@@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)cc1 ZINC000816619856 1028967173 /nfs/dbraw/zinc/96/71/73/1028967173.db2.gz YHZGDOYNVADHEL-QGZVFWFLSA-N 1 1 311.425 3.953 20 10 DHCDMO Oc1c(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)ccc2ccccc21 ZINC000816656306 1028979761 /nfs/dbraw/zinc/97/97/61/1028979761.db2.gz NIHZCQSAOXOCEB-FQEVSTJZSA-N 1 1 323.436 3.936 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1 ZINC000816665985 1028983729 /nfs/dbraw/zinc/98/37/29/1028983729.db2.gz BJSYJKAGHNZZTH-VQTJNVASSA-N 1 1 314.473 3.676 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)cc1F ZINC000816630675 1028984430 /nfs/dbraw/zinc/98/44/30/1028984430.db2.gz NSQXRRJSODULCN-GOSISDBHSA-N 1 1 320.452 3.551 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000817281611 1029113280 /nfs/dbraw/zinc/11/32/80/1029113280.db2.gz NATSXJIYHKQSFM-AWEZNQCLSA-N 1 1 300.368 3.917 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000817412229 1029152802 /nfs/dbraw/zinc/15/28/02/1029152802.db2.gz GSYMNPSIUWXFCI-GFCCVEGCSA-N 1 1 317.351 3.955 20 10 DHCDMO OCC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000817418699 1029154565 /nfs/dbraw/zinc/15/45/65/1029154565.db2.gz CHBAJONWVSMAGO-GOSISDBHSA-N 1 1 316.489 3.661 20 10 DHCDMO Cc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817938051 1029281331 /nfs/dbraw/zinc/28/13/31/1029281331.db2.gz CKTWTVSTCDOSLU-OXQOHEQNSA-N 1 1 311.473 3.720 20 10 DHCDMO Cc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)c1 ZINC000817938348 1029282467 /nfs/dbraw/zinc/28/24/67/1029282467.db2.gz JEENDUJWLWOCOT-UZLBHIALSA-N 1 1 311.473 3.720 20 10 DHCDMO Cc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)c1 ZINC000817938347 1029283247 /nfs/dbraw/zinc/28/32/47/1029283247.db2.gz JEENDUJWLWOCOT-OXQOHEQNSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)s1 ZINC000817938784 1029285169 /nfs/dbraw/zinc/28/51/69/1029285169.db2.gz SIIWKQFJUXCEKF-SMDDNHRTSA-N 1 1 323.893 3.818 20 10 DHCDMO CC[NH2+]CCCN[C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817943629 1029287464 /nfs/dbraw/zinc/28/74/64/1029287464.db2.gz PZGCYLJAOIVSQW-QGZVFWFLSA-N 1 1 303.494 3.717 20 10 DHCDMO CC[C@H]([NH2+]CCC[NH2+]C(C)C)c1ccc(C(F)(F)F)cc1[O-] ZINC000817951777 1029295783 /nfs/dbraw/zinc/29/57/83/1029295783.db2.gz ANNWTCHTILQDGX-AWEZNQCLSA-N 1 1 318.383 3.840 20 10 DHCDMO CCCNCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817963246 1029300892 /nfs/dbraw/zinc/30/08/92/1029300892.db2.gz SUJBRQNSPJYEDG-IBGZPJMESA-N 1 1 312.457 3.655 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000817969222 1029307045 /nfs/dbraw/zinc/30/70/45/1029307045.db2.gz SEHKJIKAFNGZIO-KRWDZBQOSA-N 1 1 316.832 3.890 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817969023 1029307912 /nfs/dbraw/zinc/30/79/12/1029307912.db2.gz POQLSNCHMKFIMQ-OCCSQVGLSA-N 1 1 316.367 3.594 20 10 DHCDMO C[C@H]([NH2+][C@@H]1COc2cccc(F)c21)c1ccc(N(C)C)cc1 ZINC000374674881 1029426937 /nfs/dbraw/zinc/42/69/37/1029426937.db2.gz BTWBDTUHLYQSMQ-BLLLJJGKSA-N 1 1 300.377 3.676 20 10 DHCDMO Cc1ncc([C@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)s1 ZINC000865702787 1029980985 /nfs/dbraw/zinc/98/09/85/1029980985.db2.gz RCHDZJQTHHPYIO-VIFPVBQESA-N 1 1 311.401 3.647 20 10 DHCDMO CCOc1ccc(O)c(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000865822635 1030039569 /nfs/dbraw/zinc/03/95/69/1030039569.db2.gz MPMSNQZSAGOBPJ-INIZCTEOSA-N 1 1 307.340 3.730 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccccn2)C2CC2)c1O ZINC000290454587 1030057245 /nfs/dbraw/zinc/05/72/45/1030057245.db2.gz MOFALRMFXZGYHD-UHFFFAOYSA-N 1 1 318.804 3.614 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](CC)c2ccncc2)c1 ZINC000290617026 1030129283 /nfs/dbraw/zinc/12/92/83/1030129283.db2.gz XAIJJCLLLBRNBQ-KRWDZBQOSA-N 1 1 300.402 3.769 20 10 DHCDMO CC(C)CO[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000120964982 1030177392 /nfs/dbraw/zinc/17/73/92/1030177392.db2.gz PEQQTCDIUJQRKB-INIZCTEOSA-N 1 1 321.461 3.642 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@@H](C)O[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000866446315 1030299975 /nfs/dbraw/zinc/29/99/75/1030299975.db2.gz FKRYJWRFCIMGGT-QYTUQVAYSA-N 1 1 303.324 3.628 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C)C[C@H]3C)cc2)CC1 ZINC000823510305 1030319271 /nfs/dbraw/zinc/31/92/71/1030319271.db2.gz ZKIFEZAYCKLUNW-IAGOWNOFSA-N 1 1 316.489 3.922 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CC=C(c2cccc(C)c2)CC1 ZINC000780780659 1030453271 /nfs/dbraw/zinc/45/32/71/1030453271.db2.gz YGYMHVAAOCQXOP-UHFFFAOYSA-N 1 1 309.409 3.999 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc4c(c3)OCCCCO4)ccc21 ZINC000824104695 1030467310 /nfs/dbraw/zinc/46/73/10/1030467310.db2.gz ZDJAKAAKXQYKBQ-UHFFFAOYSA-N 1 1 323.396 3.737 20 10 DHCDMO Cc1ccc([C@@H](C)[N@H+]2CCOc3ccc(N)cc3C2)c(O)c1C ZINC000925755165 1030483461 /nfs/dbraw/zinc/48/34/61/1030483461.db2.gz TXRXRGHVCBWEPB-CQSZACIVSA-N 1 1 312.413 3.547 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1O ZINC000291443776 1030505386 /nfs/dbraw/zinc/50/53/86/1030505386.db2.gz CBNVFMNKJJKEKF-VIFPVBQESA-N 1 1 305.752 3.531 20 10 DHCDMO C[N@H+](Cc1cn2ccccc2n1)Cc1ccc(N2CCCC2)cc1 ZINC001136880997 1030567504 /nfs/dbraw/zinc/56/75/04/1030567504.db2.gz VZIQFHMXFKOPJM-UHFFFAOYSA-N 1 1 320.440 3.567 20 10 DHCDMO C[N@@H+](Cc1cn2ccccc2n1)Cc1ccc(N2CCCC2)cc1 ZINC001136880997 1030567510 /nfs/dbraw/zinc/56/75/10/1030567510.db2.gz VZIQFHMXFKOPJM-UHFFFAOYSA-N 1 1 320.440 3.567 20 10 DHCDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000824715535 1030619113 /nfs/dbraw/zinc/61/91/13/1030619113.db2.gz LFZPAEJHACPSKR-TZMCWYRMSA-N 1 1 300.368 3.915 20 10 DHCDMO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000825005747 1030686290 /nfs/dbraw/zinc/68/62/90/1030686290.db2.gz REWBQIVNOMFUDE-INIZCTEOSA-N 1 1 312.461 3.744 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1cncc(Cl)c1 ZINC001136994490 1030735559 /nfs/dbraw/zinc/73/55/59/1030735559.db2.gz YGODNFRPQQKTKX-UHFFFAOYSA-N 1 1 315.848 3.967 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccncc2)c(O)c(C(C)(C)C)c1 ZINC000825501448 1030827253 /nfs/dbraw/zinc/82/72/53/1030827253.db2.gz PKUWJTUNBGNCQO-UHFFFAOYSA-N 1 1 314.429 3.725 20 10 DHCDMO CC(C)[N@@H+](CCc1nccs1)Cc1cc2c(cc1O)CCC2 ZINC000179195659 1030852207 /nfs/dbraw/zinc/85/22/07/1030852207.db2.gz XEEWRHGEBUBSAQ-UHFFFAOYSA-N 1 1 316.470 3.791 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cn(C)cn2)c(C)n1-c1ccccc1 ZINC000926763659 1030910736 /nfs/dbraw/zinc/91/07/36/1030910736.db2.gz DKCQDGBDDZPJEA-OAHLLOKOSA-N 1 1 308.429 3.678 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@@H]1CCc3cc(Cl)ccc3C1)CC2 ZINC001171135792 1031226222 /nfs/dbraw/zinc/22/62/22/1031226222.db2.gz OYFPHKNXWSOJKL-QGZVFWFLSA-N 1 1 313.828 3.961 20 10 DHCDMO C[C@@H]1CCCC[N@@H+](Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144298336 1031435964 /nfs/dbraw/zinc/43/59/64/1031435964.db2.gz BTLBNOKPRQOAKH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298336 1031435974 /nfs/dbraw/zinc/43/59/74/1031435974.db2.gz BTLBNOKPRQOAKH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298336 1031435982 /nfs/dbraw/zinc/43/59/82/1031435982.db2.gz BTLBNOKPRQOAKH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299499 1031439505 /nfs/dbraw/zinc/43/95/05/1031439505.db2.gz YJTUCDMRRIBZJE-VIFPVBQESA-N 1 1 302.187 3.668 20 10 DHCDMO C[C@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299499 1031439510 /nfs/dbraw/zinc/43/95/10/1031439510.db2.gz YJTUCDMRRIBZJE-VIFPVBQESA-N 1 1 302.187 3.668 20 10 DHCDMO COC/C(C)=C\C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929184128 1031459557 /nfs/dbraw/zinc/45/95/57/1031459557.db2.gz BSMKDXVGKRCEDX-BOPFTXTBSA-N 1 1 302.462 3.701 20 10 DHCDMO CCc1cccc(NCc2cc(Br)ccc2O)[nH+]1 ZINC001171177634 1031552014 /nfs/dbraw/zinc/55/20/14/1031552014.db2.gz GDCZGAHFNIQNTE-UHFFFAOYSA-N 1 1 307.191 3.724 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001144509359 1031664901 /nfs/dbraw/zinc/66/49/01/1031664901.db2.gz UPWPHYJQMBXFOE-MRXNPFEDSA-N 1 1 317.360 3.670 20 10 DHCDMO COCCCC[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841894745 1031693014 /nfs/dbraw/zinc/69/30/14/1031693014.db2.gz STMYUDUOOXKJBP-UHFFFAOYSA-N 1 1 318.383 3.630 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)cc1C ZINC000873097431 1031709876 /nfs/dbraw/zinc/70/98/76/1031709876.db2.gz QSQMZAACFMDXQM-CQSZACIVSA-N 1 1 316.449 3.876 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293957524 1031722254 /nfs/dbraw/zinc/72/22/54/1031722254.db2.gz PPRANMTYQSCCQQ-AWEZNQCLSA-N 1 1 323.799 3.862 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293957524 1031722268 /nfs/dbraw/zinc/72/22/68/1031722268.db2.gz PPRANMTYQSCCQQ-AWEZNQCLSA-N 1 1 323.799 3.862 20 10 DHCDMO C[C@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)C[C@]1(F)Cl ZINC000846032075 1031823913 /nfs/dbraw/zinc/82/39/13/1031823913.db2.gz CQDKSWNNAPBOJC-QWHCGFSZSA-N 1 1 310.171 3.979 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2CC3(CCC3)C2)c1 ZINC000846107284 1031857933 /nfs/dbraw/zinc/85/79/33/1031857933.db2.gz RGHULAVSBXMTMV-UHFFFAOYSA-N 1 1 310.235 3.885 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1O ZINC000846104839 1031874733 /nfs/dbraw/zinc/87/47/33/1031874733.db2.gz MRBKFNMVPGQJGS-AWEZNQCLSA-N 1 1 317.763 3.675 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846105812 1031879075 /nfs/dbraw/zinc/87/90/75/1031879075.db2.gz YPYMCFKEHVCBTA-ZDUSSCGKSA-N 1 1 305.727 3.806 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846105812 1031879078 /nfs/dbraw/zinc/87/90/78/1031879078.db2.gz YPYMCFKEHVCBTA-ZDUSSCGKSA-N 1 1 305.727 3.806 20 10 DHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001142525105 1031897885 /nfs/dbraw/zinc/89/78/85/1031897885.db2.gz XNEYWBXMWPVPIN-AWEZNQCLSA-N 1 1 303.352 3.735 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001142525105 1031897896 /nfs/dbraw/zinc/89/78/96/1031897896.db2.gz XNEYWBXMWPVPIN-AWEZNQCLSA-N 1 1 303.352 3.735 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001142525105 1031897911 /nfs/dbraw/zinc/89/79/11/1031897911.db2.gz XNEYWBXMWPVPIN-AWEZNQCLSA-N 1 1 303.352 3.735 20 10 DHCDMO Oc1ccc(C2CC[NH+](Cc3cc(F)c(F)cc3O)CC2)cc1 ZINC001142527273 1031911735 /nfs/dbraw/zinc/91/17/35/1031911735.db2.gz QYYVNQCKSPJKPT-UHFFFAOYSA-N 1 1 319.351 3.756 20 10 DHCDMO Cc1ccc(C[N@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c(O)c1 ZINC000877563842 1033357322 /nfs/dbraw/zinc/35/73/22/1033357322.db2.gz SNCYXWWULCBZCS-INIZCTEOSA-N 1 1 305.805 3.519 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(OCC(F)F)cc1)C2 ZINC000877702566 1033417950 /nfs/dbraw/zinc/41/79/50/1033417950.db2.gz BULBCWGQBYDSBO-UHFFFAOYSA-N 1 1 305.324 3.552 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C2Cc3cc(F)c(F)cc3C2)cc1 ZINC001173482275 1033741391 /nfs/dbraw/zinc/74/13/91/1033741391.db2.gz CJDDNFQQEUOZCF-UHFFFAOYSA-N 1 1 316.395 3.630 20 10 DHCDMO C[C@@]1(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCCS1 ZINC000862212086 1033781661 /nfs/dbraw/zinc/78/16/61/1033781661.db2.gz GMNYWQMXVDUDSV-AEFFLSMTSA-N 1 1 321.486 3.659 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2oc(C)nc2C)cc1F ZINC000862280385 1033810348 /nfs/dbraw/zinc/81/03/48/1033810348.db2.gz ZUFKNJULDCDOPF-UHFFFAOYSA-N 1 1 305.397 3.567 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862442027 1033856960 /nfs/dbraw/zinc/85/69/60/1033856960.db2.gz GDIJTWZYQFOJLC-AOOOYVTPSA-N 1 1 319.779 3.777 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(C)ccc3O)C2)cc1F ZINC000862541894 1033883881 /nfs/dbraw/zinc/88/38/81/1033883881.db2.gz YTLDRXLUNGAXNM-HNNXBMFYSA-N 1 1 315.388 3.838 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(Cc2ccccc2)no1 ZINC000879650959 1034075509 /nfs/dbraw/zinc/07/55/09/1034075509.db2.gz AACPIZSIMBKGKR-KBPBESRZSA-N 1 1 323.396 3.778 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)Cc2scnc2C)c(O)c1 ZINC000179428780 1034305721 /nfs/dbraw/zinc/30/57/21/1034305721.db2.gz OOQYKVYONFONLN-UHFFFAOYSA-N 1 1 306.431 3.578 20 10 DHCDMO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000184412168 1034471883 /nfs/dbraw/zinc/47/18/83/1034471883.db2.gz JTILBKMPDVFCIX-INIZCTEOSA-N 1 1 310.445 3.660 20 10 DHCDMO CC1CCN(c2ccc(C[NH2+]Cc3cn(C4CC4)cn3)cc2)CC1 ZINC000865456651 1034655701 /nfs/dbraw/zinc/65/57/01/1034655701.db2.gz PINXMAKNTAIAHN-UHFFFAOYSA-N 1 1 324.472 3.744 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193071712 1034829085 /nfs/dbraw/zinc/82/90/85/1034829085.db2.gz NJJILHPMGIPEPN-UWVGGRQHSA-N 1 1 304.217 3.919 20 10 DHCDMO CC[C@H](CCO)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192945011 1034824785 /nfs/dbraw/zinc/82/47/85/1034824785.db2.gz XCUVPNHRRJBNDK-NXEZZACHSA-N 1 1 306.233 3.758 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2CC=CCC2)c1 ZINC001177542834 1035379738 /nfs/dbraw/zinc/37/97/38/1035379738.db2.gz TZJWKJSBIOVMCR-GFCCVEGCSA-N 1 1 310.235 3.909 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](c3ccnc(C)n3)C2)cc1 ZINC000773746591 1035432374 /nfs/dbraw/zinc/43/23/74/1035432374.db2.gz MBKXBOGYLLCMHX-SFHVURJKSA-N 1 1 324.472 3.621 20 10 DHCDMO CCN(C)c1ccc(C[N@H+](C)Cc2nc3ccccc3n2C)cc1 ZINC000773797634 1035463161 /nfs/dbraw/zinc/46/31/61/1035463161.db2.gz ZCAVKBFJCJUPAY-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2nc3ccccc3n2C)cc1 ZINC000773797634 1035463166 /nfs/dbraw/zinc/46/31/66/1035463166.db2.gz ZCAVKBFJCJUPAY-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001180012271 1035566200 /nfs/dbraw/zinc/56/62/00/1035566200.db2.gz ZGNAPKGNGWSTGF-UHFFFAOYSA-N 1 1 313.401 3.601 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1 ZINC001180430600 1035671303 /nfs/dbraw/zinc/67/13/03/1035671303.db2.gz OXGYBJXYIJKICO-SJLPKXTDSA-N 1 1 305.462 3.745 20 10 DHCDMO Cc1ccc([C@@H]2CC[N@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001180820879 1035764793 /nfs/dbraw/zinc/76/47/93/1035764793.db2.gz SVMKDGMCLRXUDM-CQSZACIVSA-N 1 1 303.352 3.968 20 10 DHCDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001180820879 1035764810 /nfs/dbraw/zinc/76/48/10/1035764810.db2.gz SVMKDGMCLRXUDM-CQSZACIVSA-N 1 1 303.352 3.968 20 10 DHCDMO C[N@H+](CCc1ccc(Cl)cc1)Cc1c(O)ccc(F)c1F ZINC001233334982 1035928594 /nfs/dbraw/zinc/92/85/94/1035928594.db2.gz CEUCODAVILLLMA-UHFFFAOYSA-N 1 1 311.759 3.998 20 10 DHCDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1c(O)ccc(F)c1F ZINC001233334982 1035928606 /nfs/dbraw/zinc/92/86/06/1035928606.db2.gz CEUCODAVILLLMA-UHFFFAOYSA-N 1 1 311.759 3.998 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)ccc1N1CCCCC1 ZINC001195023154 1036106523 /nfs/dbraw/zinc/10/65/23/1036106523.db2.gz RCLWTBGCOBWWSO-QUCCMNQESA-N 1 1 314.473 3.596 20 10 DHCDMO COc1ccccc1C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775643452 1036163818 /nfs/dbraw/zinc/16/38/18/1036163818.db2.gz YGFLHWXUDDCINF-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000775646532 1036194969 /nfs/dbraw/zinc/19/49/69/1036194969.db2.gz ZHGDHEIBQNIDRP-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)N(C)C1CC1 ZINC000774160830 1036207028 /nfs/dbraw/zinc/20/70/28/1036207028.db2.gz BRPYQBRKCZQCPR-ZJUUUORDSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774189358 1036216874 /nfs/dbraw/zinc/21/68/74/1036216874.db2.gz WPRQZPCUPGCLKM-XPTSAGLGSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCC[C@@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000774189438 1036217652 /nfs/dbraw/zinc/21/76/52/1036217652.db2.gz XMJAHRBYHJXNDL-HJIKLVIJSA-N 1 1 304.217 3.653 20 10 DHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001205696891 1036220554 /nfs/dbraw/zinc/22/05/54/1036220554.db2.gz PZTUPUHCBPAMJV-UHFFFAOYSA-N 1 1 321.852 3.717 20 10 DHCDMO Cc1cc([C@@H]2CCCN2Cc2cc(Cl)cc(F)c2[O-])on1 ZINC000775655520 1036256887 /nfs/dbraw/zinc/25/68/87/1036256887.db2.gz GELQLBYCZUHXRQ-ZDUSSCGKSA-N 1 1 310.756 3.818 20 10 DHCDMO C[C@H]([NH2+][C@H](CCO)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774252173 1036258154 /nfs/dbraw/zinc/25/81/54/1036258154.db2.gz JRUMSMCPQXROKI-ISVAXAHUSA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCOc3ccccc3C2)c1O ZINC000775659233 1036263143 /nfs/dbraw/zinc/26/31/43/1036263143.db2.gz HAAZFWVUIACFMU-UHFFFAOYSA-N 1 1 303.789 3.749 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCOc3ccccc3C2)c1O ZINC000775659233 1036263160 /nfs/dbraw/zinc/26/31/60/1036263160.db2.gz HAAZFWVUIACFMU-UHFFFAOYSA-N 1 1 303.789 3.749 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000775690161 1036467154 /nfs/dbraw/zinc/46/71/54/1036467154.db2.gz JYDVVCFXGLYJFH-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](CCc2cccc(F)c2)C2CC2)c1 ZINC000775699849 1036472980 /nfs/dbraw/zinc/47/29/80/1036472980.db2.gz IMXBDQWOILXCDM-UHFFFAOYSA-N 1 1 315.388 3.747 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000775713909 1036526339 /nfs/dbraw/zinc/52/63/39/1036526339.db2.gz LMHZKZBZGWGMHR-HIFRSBDPSA-N 1 1 315.388 3.918 20 10 DHCDMO CCN1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715931 1036533506 /nfs/dbraw/zinc/53/35/06/1036533506.db2.gz MIHRYYSLKIBPLM-XJKSGUPXSA-N 1 1 310.869 3.659 20 10 DHCDMO CCN1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715931 1036533514 /nfs/dbraw/zinc/53/35/14/1036533514.db2.gz MIHRYYSLKIBPLM-XJKSGUPXSA-N 1 1 310.869 3.659 20 10 DHCDMO Oc1ccc([C@H]2CC[N@H+](Cc3cc(Cl)c(F)cc3O)C2)cc1 ZINC001183156612 1036540808 /nfs/dbraw/zinc/54/08/08/1036540808.db2.gz OAJHGNGCSSROHU-LBPRGKRZSA-N 1 1 321.779 3.880 20 10 DHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C2)cc1 ZINC001183156612 1036540824 /nfs/dbraw/zinc/54/08/24/1036540824.db2.gz OAJHGNGCSSROHU-LBPRGKRZSA-N 1 1 321.779 3.880 20 10 DHCDMO COc1cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c(O)cc1C ZINC000774670839 1036658030 /nfs/dbraw/zinc/65/80/30/1036658030.db2.gz MQVWWHIGAYIDIZ-UHFFFAOYSA-N 1 1 309.409 3.757 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)CC(C)(C)O)cc1 ZINC000775762604 1036705865 /nfs/dbraw/zinc/70/58/65/1036705865.db2.gz BKLSYTPHGICIBW-UHFFFAOYSA-N 1 1 312.457 3.526 20 10 DHCDMO Cc1csc(C[C@H]2CC[N@@H+](Cc3ccc(Cl)cc3O)C2)n1 ZINC001183971254 1036721879 /nfs/dbraw/zinc/72/18/79/1036721879.db2.gz FXYGHAOFCXREKO-GFCCVEGCSA-N 1 1 322.861 3.875 20 10 DHCDMO C[C@@H]([NH2+]CCCN(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000151943279 1036741637 /nfs/dbraw/zinc/74/16/37/1036741637.db2.gz HXTHUVFJGUJHAZ-QGZVFWFLSA-N 1 1 303.494 3.669 20 10 DHCDMO COc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)ccn1 ZINC000762916849 1037064876 /nfs/dbraw/zinc/06/48/76/1037064876.db2.gz IWZJRVKRXXNYLA-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccnc1Cl ZINC000104945280 1037229448 /nfs/dbraw/zinc/22/94/48/1037229448.db2.gz ZOGYAQVTFXJUHV-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccnc1Cl ZINC000104945280 1037229458 /nfs/dbraw/zinc/22/94/58/1037229458.db2.gz ZOGYAQVTFXJUHV-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@@H]1CCOC1 ZINC000776001807 1037294478 /nfs/dbraw/zinc/29/44/78/1037294478.db2.gz BOJIDLZYHNUEFP-SJORKVTESA-N 1 1 311.425 3.992 20 10 DHCDMO COc1c(O)c(C[NH2+]CC2CCCCCCC2)ccc1[N+](=O)[O-] ZINC000774973511 1037316162 /nfs/dbraw/zinc/31/61/62/1037316162.db2.gz AJZAMQXZCNYCHT-UHFFFAOYSA-N 1 1 322.405 3.759 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(CC)CC)cc1)C1CCOCC1 ZINC001203942461 1037337557 /nfs/dbraw/zinc/33/75/57/1037337557.db2.gz RFRAIORMPWJTQU-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775012024 1037382219 /nfs/dbraw/zinc/38/22/19/1037382219.db2.gz OURVQGBHROKICF-STQMWFEESA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775012023 1037382870 /nfs/dbraw/zinc/38/28/70/1037382870.db2.gz OURVQGBHROKICF-QWHCGFSZSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCC(C)(C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000775033998 1037445295 /nfs/dbraw/zinc/44/52/95/1037445295.db2.gz NVTZUXOCLTUMCD-YPMHNXCESA-N 1 1 322.405 3.613 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1F ZINC000775134723 1037682321 /nfs/dbraw/zinc/68/23/21/1037682321.db2.gz DSIRYHLRYITJOI-GFCCVEGCSA-N 1 1 304.331 3.666 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3cccs3)C2)c1 ZINC000164504235 1038205668 /nfs/dbraw/zinc/20/56/68/1038205668.db2.gz KNLNDFLZTNEPQT-OAHLLOKOSA-N 1 1 303.427 3.644 20 10 DHCDMO CO[C@@H](CC(C)C)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190436839 1038316709 /nfs/dbraw/zinc/31/67/09/1038316709.db2.gz MCZNNKMCTRLIHT-IBGZPJMESA-N 1 1 304.478 3.778 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)Cc1cc(C)[nH]n1)c1cc(Cl)ccc1O ZINC000775522633 1038633740 /nfs/dbraw/zinc/63/37/40/1038633740.db2.gz WIXXXSZYAFOYIZ-MEBBXXQBSA-N 1 1 307.825 3.749 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCO2 ZINC000170789162 1038966561 /nfs/dbraw/zinc/96/65/61/1038966561.db2.gz WSSOPQGOZRNMKS-GHMZBOCLSA-N 1 1 303.333 3.672 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(O)cc1O)Cc1cccc(F)c1F ZINC001232263568 1039001631 /nfs/dbraw/zinc/00/16/31/1039001631.db2.gz RQNRDDQWJWXTBY-UHFFFAOYSA-N 1 1 313.731 3.661 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(O)cc1O)Cc1cccc(F)c1F ZINC001232263568 1039001643 /nfs/dbraw/zinc/00/16/43/1039001643.db2.gz RQNRDDQWJWXTBY-UHFFFAOYSA-N 1 1 313.731 3.661 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000761191416 1040561180 /nfs/dbraw/zinc/56/11/80/1040561180.db2.gz TZDBIOGQZNFMCG-OAHLLOKOSA-N 1 1 318.804 3.786 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)c(O)c1 ZINC000092729621 185336798 /nfs/dbraw/zinc/33/67/98/185336798.db2.gz CIMGMNBAHWWNSX-INIZCTEOSA-N 1 1 315.417 3.631 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)c(O)c1 ZINC000092729621 185336799 /nfs/dbraw/zinc/33/67/99/185336799.db2.gz CIMGMNBAHWWNSX-INIZCTEOSA-N 1 1 315.417 3.631 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](COC)c2ccco2)cc1 ZINC000080239827 192015907 /nfs/dbraw/zinc/01/59/07/192015907.db2.gz SZARQNQGBVQVHV-QGZVFWFLSA-N 1 1 302.418 3.603 20 10 DHCDMO C[C@H]([NH2+]CCC1(O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000284195994 131057490 /nfs/dbraw/zinc/05/74/90/131057490.db2.gz BJBGKDGQMPKXJL-VIFPVBQESA-N 1 1 304.217 3.655 20 10 DHCDMO CCC[N@@H+](Cc1cnc(C(C)(C)C)nc1)Cc1ccccc1O ZINC000284218092 131060573 /nfs/dbraw/zinc/06/05/73/131060573.db2.gz CQCANCISNIWBDI-UHFFFAOYSA-N 1 1 313.445 3.892 20 10 DHCDMO C[C@]12CC[N@@H+](Cc3cc(F)ccc3O)C[C@H]1C2(Cl)Cl ZINC000284380398 131075446 /nfs/dbraw/zinc/07/54/46/131075446.db2.gz OKZDVAUNNXPPBI-OLZOCXBDSA-N 1 1 304.192 3.547 20 10 DHCDMO C[C@H]([NH2+][C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000286892142 131254556 /nfs/dbraw/zinc/25/45/56/131254556.db2.gz DCSJTRCCGVPGKL-SJCJKPOMSA-N 1 1 320.383 3.624 20 10 DHCDMO COc1cccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c1O ZINC000289499320 131391594 /nfs/dbraw/zinc/39/15/94/131391594.db2.gz SQHIVODZIAZHHX-UHFFFAOYSA-N 1 1 313.397 3.519 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c1 ZINC000294010998 131791536 /nfs/dbraw/zinc/79/15/36/131791536.db2.gz UHNXKQABTOXYPC-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c2nccn21 ZINC000297908986 132039909 /nfs/dbraw/zinc/03/99/09/132039909.db2.gz WMPFUBOBCBXADM-VQIMIIECSA-N 1 1 324.472 3.915 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[C@@H](CO)C1)c1cc(Cl)c(Cl)cc1O ZINC000296514608 335145961 /nfs/dbraw/zinc/14/59/61/335145961.db2.gz PQKRTWBDKQWZDS-AEJSXWLSSA-N 1 1 304.217 3.511 20 10 DHCDMO CC[C@H]([NH2+]Cc1nc(C)n2c1CCCC2)c1ccc(F)cc1O ZINC000368616588 336849291 /nfs/dbraw/zinc/84/92/91/336849291.db2.gz DQODLHWYWZPHBN-HNNXBMFYSA-N 1 1 317.408 3.613 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)c1 ZINC000377624213 337056725 /nfs/dbraw/zinc/05/67/25/337056725.db2.gz KLRJKGFPUHMXEH-DEYYWGMASA-N 1 1 312.413 3.940 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000175659874 337146987 /nfs/dbraw/zinc/14/69/87/337146987.db2.gz HIQAHYBMQYIZRH-MRXNPFEDSA-N 1 1 323.408 3.515 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000179556279 337170255 /nfs/dbraw/zinc/17/02/55/337170255.db2.gz KBAMQOUQGQNLDH-HNNXBMFYSA-N 1 1 308.381 3.913 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1ccc(F)cc1O ZINC000527953274 337774087 /nfs/dbraw/zinc/77/40/87/337774087.db2.gz VUDDYGGLBMFEML-XJKSGUPXSA-N 1 1 306.425 3.589 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nccnc2C)cc1F ZINC000187989894 520911954 /nfs/dbraw/zinc/91/19/54/520911954.db2.gz KPUWJIDPHJHYJJ-CQSZACIVSA-N 1 1 316.424 3.621 20 10 DHCDMO C[N@@H+](Cc1ccnc(-c2ccc(F)cc2)n1)Cc1ccccc1O ZINC000157252141 523451889 /nfs/dbraw/zinc/45/18/89/523451889.db2.gz SZAMIVMDGGIJNG-UHFFFAOYSA-N 1 1 323.371 3.620 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](c3nccs3)C2)cc1C ZINC000156543102 525315972 /nfs/dbraw/zinc/31/59/72/525315972.db2.gz QSBJNYJWPVMFPM-AWEZNQCLSA-N 1 1 302.443 3.845 20 10 DHCDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)cc1O ZINC000368482634 525593044 /nfs/dbraw/zinc/59/30/44/525593044.db2.gz NVBWUJYGJREPPQ-PUTJDCORSA-N 1 1 305.324 3.843 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000192956480 525629480 /nfs/dbraw/zinc/62/94/80/525629480.db2.gz RMRCAKIPCJYHDS-GARJFASQSA-N 1 1 318.244 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(F)cc1O ZINC000186354960 525695053 /nfs/dbraw/zinc/69/50/53/525695053.db2.gz VAVJYOITHPVARW-UMPQAUOISA-N 1 1 305.393 3.530 20 10 DHCDMO Cc1csc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000268005965 526341976 /nfs/dbraw/zinc/34/19/76/526341976.db2.gz FHLMPYINLXWRHW-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO Cc1csc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000268005965 526341981 /nfs/dbraw/zinc/34/19/81/526341981.db2.gz FHLMPYINLXWRHW-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(F)cc1O ZINC000285535312 535803415 /nfs/dbraw/zinc/80/34/15/535803415.db2.gz BWMFJIJGCWLGKG-MRXNPFEDSA-N 1 1 316.376 3.601 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319306 535804742 /nfs/dbraw/zinc/80/47/42/535804742.db2.gz DIEPMFUUKGWGBT-BLLLJJGKSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(F)cc1O ZINC000285640598 535806002 /nfs/dbraw/zinc/80/60/02/535806002.db2.gz LUBKRMVBWNRIMD-QGZVFWFLSA-N 1 1 303.377 3.919 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286128837 535908298 /nfs/dbraw/zinc/90/82/98/535908298.db2.gz OKXFKLQFQPKVJD-YJBOKZPZSA-N 1 1 317.404 3.738 20 10 DHCDMO COCCc1cc[nH+]c(N[C@H](C)c2cc(Cl)ccc2O)c1 ZINC000287430599 536831768 /nfs/dbraw/zinc/83/17/68/536831768.db2.gz KMUIOYQKJCZZFL-LLVKDONJSA-N 1 1 306.793 3.803 20 10 DHCDMO Cc1noc(C)c1C[C@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293604789 1013102368 /nfs/dbraw/zinc/10/23/68/1013102368.db2.gz LILIAEDBVWATOT-QMMMGPOBSA-N 1 1 312.772 3.510 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000894425015 1013357175 /nfs/dbraw/zinc/35/71/75/1013357175.db2.gz QHDCZQXGUNCVJN-UHFFFAOYSA-N 1 1 318.367 3.520 20 10 DHCDMO Cn1cncc1CCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000846803723 1032087969 /nfs/dbraw/zinc/08/79/69/1032087969.db2.gz GIDWNWXGEFRPOE-UHFFFAOYSA-N 1 1 313.445 3.503 20 10 DHCDMO COc1ccc(C[N@H+]2CC3(CC=CC3)[C@H]2C(C)C)c(O)c1OC ZINC000895121189 1014472081 /nfs/dbraw/zinc/47/20/81/1014472081.db2.gz JRTHEIFJMPFEPS-GOSISDBHSA-N 1 1 317.429 3.586 20 10 DHCDMO C[C@H]([NH2+]CC1=CCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000834859888 1014829459 /nfs/dbraw/zinc/82/94/59/1014829459.db2.gz LIMDYCWTLNPBDK-VIFPVBQESA-N 1 1 302.201 3.696 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(F)cc(F)c1O ZINC000834883798 1014938965 /nfs/dbraw/zinc/93/89/65/1014938965.db2.gz HOSRIDXEDMUNTR-MADCSZMMSA-N 1 1 310.171 3.905 20 10 DHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC000896529002 1015612933 /nfs/dbraw/zinc/61/29/33/1015612933.db2.gz VRDBVWYLSRSRNM-NSHDSACASA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC000896529002 1015612935 /nfs/dbraw/zinc/61/29/35/1015612935.db2.gz VRDBVWYLSRSRNM-NSHDSACASA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC000896529002 1015612938 /nfs/dbraw/zinc/61/29/38/1015612938.db2.gz VRDBVWYLSRSRNM-NSHDSACASA-N 1 1 324.396 3.582 20 10 DHCDMO COc1ccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c(O)c1OC ZINC000891802114 1015636470 /nfs/dbraw/zinc/63/64/70/1015636470.db2.gz NXOFKYLCHZSPIB-LBPRGKRZSA-N 1 1 317.385 3.728 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1 ZINC000216158919 1015674784 /nfs/dbraw/zinc/67/47/84/1015674784.db2.gz ZMDPNQSTEYYOAM-UHFFFAOYSA-N 1 1 321.424 3.827 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c1 ZINC000093637678 1015780829 /nfs/dbraw/zinc/78/08/29/1015780829.db2.gz QGJBINGLCDNEHJ-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO COc1ccc(C[N@H+]2CCCC23CCCCC3)c(O)c1OC ZINC000892125806 1016267419 /nfs/dbraw/zinc/26/74/19/1016267419.db2.gz NENJGXNPCYLRKR-UHFFFAOYSA-N 1 1 305.418 3.708 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C)[C@H]3C)cc2)CC1 ZINC000294960558 1032225094 /nfs/dbraw/zinc/22/50/94/1032225094.db2.gz KXTYABFLRMSRRS-HZPDHXFCSA-N 1 1 302.462 3.532 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2snnc2C)cc1 ZINC000929185478 1032472251 /nfs/dbraw/zinc/47/22/51/1032472251.db2.gz SOHNWWJANYQTRN-AWEZNQCLSA-N 1 1 318.490 3.886 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)c2snnc2C)cc1 ZINC000929185478 1032472256 /nfs/dbraw/zinc/47/22/56/1032472256.db2.gz SOHNWWJANYQTRN-AWEZNQCLSA-N 1 1 318.490 3.886 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000092973936 1032517988 /nfs/dbraw/zinc/51/79/88/1032517988.db2.gz QZYQPIXWCSSJRW-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000092973936 1032517999 /nfs/dbraw/zinc/51/79/99/1032517999.db2.gz QZYQPIXWCSSJRW-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2OC)c1O ZINC000093008319 1032520175 /nfs/dbraw/zinc/52/01/75/1032520175.db2.gz FBGUUWYKVCJETM-MRXNPFEDSA-N 1 1 313.397 3.747 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c1 ZINC000093453562 1032537685 /nfs/dbraw/zinc/53/76/85/1032537685.db2.gz CRTVXAQWEWWDJT-SFHVURJKSA-N 1 1 312.413 3.831 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C(C)C)C3)cc2)CC1 ZINC000828030180 1012372961 /nfs/dbraw/zinc/37/29/61/1012372961.db2.gz BOHCNOPRLWGDSB-GOSISDBHSA-N 1 1 316.489 3.780 20 10 DHCDMO Oc1cccc2c1C[N@H+](Cc1ccccc1OC(F)(F)F)CC2 ZINC001204428342 1012632966 /nfs/dbraw/zinc/63/29/66/1012632966.db2.gz JDZBEOGFLWDWES-UHFFFAOYSA-N 1 1 323.314 3.849 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccccc1OC(F)(F)F)CC2 ZINC001204428342 1012632974 /nfs/dbraw/zinc/63/29/74/1012632974.db2.gz JDZBEOGFLWDWES-UHFFFAOYSA-N 1 1 323.314 3.849 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)Cc2nc3c(s2)CCCC3)cc1C ZINC000083115181 1012710147 /nfs/dbraw/zinc/71/01/47/1012710147.db2.gz RVTDQBKNJWBEJB-UHFFFAOYSA-N 1 1 316.470 3.976 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2nc3c(s2)CCCC3)cc1C ZINC000083115181 1012710153 /nfs/dbraw/zinc/71/01/53/1012710153.db2.gz RVTDQBKNJWBEJB-UHFFFAOYSA-N 1 1 316.470 3.976 20 10 DHCDMO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)n1 ZINC000757673204 1032701480 /nfs/dbraw/zinc/70/14/80/1032701480.db2.gz AMRPKBJOZMEVMK-WPRPVWTQSA-N 1 1 312.385 3.890 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1O ZINC000186138141 1017907504 /nfs/dbraw/zinc/90/75/04/1017907504.db2.gz BYNJFFAKPOEOKP-GFCCVEGCSA-N 1 1 303.381 3.694 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Cl)c1 ZINC000841030182 1018041341 /nfs/dbraw/zinc/04/13/41/1018041341.db2.gz UHCPNFJZFXVACR-GFCCVEGCSA-N 1 1 304.821 3.664 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCCC(F)(F)CC1 ZINC000702765123 1018239337 /nfs/dbraw/zinc/23/93/37/1018239337.db2.gz CRFMDPMFTYDABQ-UHFFFAOYSA-N 1 1 320.177 3.776 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000766093277 1018278731 /nfs/dbraw/zinc/27/87/31/1018278731.db2.gz KHOLFZSMJIAPEL-OAHLLOKOSA-N 1 1 300.450 3.771 20 10 DHCDMO C[C@H](NCC(C)(C)[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764535135 1018307238 /nfs/dbraw/zinc/30/72/38/1018307238.db2.gz ZNVQKUPPUAQCKF-HNNXBMFYSA-N 1 1 321.484 3.807 20 10 DHCDMO CC[NH+](CC)CCN[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764542668 1018309857 /nfs/dbraw/zinc/30/98/57/1018309857.db2.gz AAQHNOCJTJQGQZ-MRXNPFEDSA-N 1 1 321.484 3.808 20 10 DHCDMO CC(=O)Nc1cccc2c1CC[N@@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000178863425 1018383592 /nfs/dbraw/zinc/38/35/92/1018383592.db2.gz OLLWTTWTHSDBBK-UHFFFAOYSA-N 1 1 324.424 3.526 20 10 DHCDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000764930458 1018431954 /nfs/dbraw/zinc/43/19/54/1018431954.db2.gz SQTOMHQVLNFZIZ-ULQDDVLXSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000764930458 1018431957 /nfs/dbraw/zinc/43/19/57/1018431957.db2.gz SQTOMHQVLNFZIZ-ULQDDVLXSA-N 1 1 303.494 3.666 20 10 DHCDMO Cc1cc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414291 1018469092 /nfs/dbraw/zinc/46/90/92/1018469092.db2.gz UWGNBDZJMYBSKG-TZIWHRDSSA-N 1 1 323.484 3.811 20 10 DHCDMO Cc1cc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414291 1018469114 /nfs/dbraw/zinc/46/91/14/1018469114.db2.gz UWGNBDZJMYBSKG-TZIWHRDSSA-N 1 1 323.484 3.811 20 10 DHCDMO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858164876 1032788806 /nfs/dbraw/zinc/78/88/06/1032788806.db2.gz GPDBLUMVFCXAME-BBATYDOGSA-N 1 1 318.367 3.643 20 10 DHCDMO CCC(C)(C)[N@@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC000715711039 1018946349 /nfs/dbraw/zinc/94/63/49/1018946349.db2.gz BQRZIDKFIXBAIL-UHFFFAOYSA-N 1 1 304.203 3.914 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000715719892 1018955864 /nfs/dbraw/zinc/95/58/64/1018955864.db2.gz VOAOOJGOXKQTGD-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000715719892 1018955856 /nfs/dbraw/zinc/95/58/56/1018955856.db2.gz VOAOOJGOXKQTGD-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H](CO)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278657890 1019003645 /nfs/dbraw/zinc/00/36/45/1019003645.db2.gz ILPPRTBRSZVMJP-ZJUUUORDSA-N 1 1 306.233 3.758 20 10 DHCDMO CC(C)c1csc(C[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000921856758 1019003922 /nfs/dbraw/zinc/00/39/22/1019003922.db2.gz ZDMVYPKDRQNJBW-UHFFFAOYSA-N 1 1 302.443 3.881 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCCO2 ZINC000170789229 1019434556 /nfs/dbraw/zinc/43/45/56/1019434556.db2.gz RNPVKFWRNYJRAZ-VXGBXAGGSA-N 1 1 317.360 3.714 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000091958292 1019496966 /nfs/dbraw/zinc/49/69/66/1019496966.db2.gz VTOHHIYIOVPTIC-HOCLYGCPSA-N 1 1 321.804 3.727 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cc3n(n2)CCC3)c(C)n1-c1ccccc1 ZINC000858294612 1032836209 /nfs/dbraw/zinc/83/62/09/1032836209.db2.gz KIASVNWISUSEPO-UHFFFAOYSA-N 1 1 320.440 3.527 20 10 DHCDMO CC(C)(C)c1cc(CN2CCC([NH3+])CC2)c(O)c(C(C)(C)C)c1 ZINC000843047342 1019850384 /nfs/dbraw/zinc/85/03/84/1019850384.db2.gz MBVBMRZPZBELPA-UHFFFAOYSA-N 1 1 318.505 3.910 20 10 DHCDMO CN1CCCc2cc(C[NH2+][C@H]3CCCc4scnc43)ccc21 ZINC000858357465 1032861140 /nfs/dbraw/zinc/86/11/40/1032861140.db2.gz GPAHJYNFXCGDBS-HNNXBMFYSA-N 1 1 313.470 3.693 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](c2ncccn2)C2CC2)cc1 ZINC000922583234 1020143458 /nfs/dbraw/zinc/14/34/58/1020143458.db2.gz RXJCXXHKBDIHMP-SFHVURJKSA-N 1 1 310.445 3.564 20 10 DHCDMO CCc1cc(C[N@@H+](C)CCn2cccn2)c(O)c(C(C)(C)C)c1 ZINC000732185686 1020208960 /nfs/dbraw/zinc/20/89/60/1020208960.db2.gz BPWDIBHTDVCVRA-UHFFFAOYSA-N 1 1 315.461 3.581 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000179558649 1020406307 /nfs/dbraw/zinc/40/63/07/1020406307.db2.gz BBQHQXXYEUGRNS-HXUWFJFHSA-N 1 1 304.393 3.799 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc(C)n(C)n2)cc1F ZINC000282451090 1020518328 /nfs/dbraw/zinc/51/83/28/1020518328.db2.gz ZTUSLSNBZBAFKE-AWEZNQCLSA-N 1 1 318.440 3.565 20 10 DHCDMO C[C@@H](NCC[N@H+]1[C@H](C)CCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000765855163 1020520526 /nfs/dbraw/zinc/52/05/26/1020520526.db2.gz UWONQNWBCMMYRX-IXDOHACOSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000765855163 1020520531 /nfs/dbraw/zinc/52/05/31/1020520531.db2.gz UWONQNWBCMMYRX-IXDOHACOSA-N 1 1 303.494 3.666 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cccc(Cl)c1[O-] ZINC000858490191 1032916203 /nfs/dbraw/zinc/91/62/03/1032916203.db2.gz CTVWVHZYGQTULU-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ccn(C(C)C)n2)cc1 ZINC000735169944 1020701135 /nfs/dbraw/zinc/70/11/35/1020701135.db2.gz VFTPZBFOPBHKAE-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccn(C(C)C)n2)cc1 ZINC000735169944 1020701141 /nfs/dbraw/zinc/70/11/41/1020701141.db2.gz VFTPZBFOPBHKAE-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCN1CCCCC1)C1CCCC1 ZINC000736946983 1020837529 /nfs/dbraw/zinc/83/75/29/1020837529.db2.gz ZGCCAITXLKGVHU-UHFFFAOYSA-N 1 1 302.462 3.623 20 10 DHCDMO Oc1ccc2ccccc2c1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000738267842 1020867347 /nfs/dbraw/zinc/86/73/47/1020867347.db2.gz FKFPOSJDBWBXHQ-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CCCN(C2CCCC2)CC1 ZINC000738267842 1020867357 /nfs/dbraw/zinc/86/73/57/1020867357.db2.gz FKFPOSJDBWBXHQ-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCCN(C2CCCC2)CC1 ZINC000738267842 1020867362 /nfs/dbraw/zinc/86/73/62/1020867362.db2.gz FKFPOSJDBWBXHQ-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2nccn2C)c(C)n1-c1ccccc1 ZINC000858544018 1032941247 /nfs/dbraw/zinc/94/12/47/1032941247.db2.gz XTWXCUPACBJODB-HNNXBMFYSA-N 1 1 308.429 3.678 20 10 DHCDMO C[N@@H+](Cc1ccc(Oc2ccccc2)nn1)Cc1ccccc1O ZINC000766248072 1020931827 /nfs/dbraw/zinc/93/18/27/1020931827.db2.gz FAVMGJIVBFMRMJ-UHFFFAOYSA-N 1 1 321.380 3.607 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2C[C@H](C)C[C@H]2C)c1O ZINC000740859202 1020953921 /nfs/dbraw/zinc/95/39/21/1020953921.db2.gz JHRQIDJWSYWAEU-CHWSQXEVSA-N 1 1 313.397 3.562 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1(C)C ZINC000740863622 1020957293 /nfs/dbraw/zinc/95/72/93/1020957293.db2.gz VMNBLDQLJOGMBZ-QZTJIDSGSA-N 1 1 303.446 3.516 20 10 DHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cs1 ZINC000264521942 1032950284 /nfs/dbraw/zinc/95/02/84/1032950284.db2.gz AIAUHUKCCFCBAU-CYBMUJFWSA-N 1 1 301.459 3.903 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1)CCC2 ZINC000742165942 1021094200 /nfs/dbraw/zinc/09/42/00/1021094200.db2.gz LWIMMTORZBOZNU-LJQANCHMSA-N 1 1 315.457 3.805 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCN(c3ccccc3)CC2)cc1C ZINC000917486370 1021279035 /nfs/dbraw/zinc/27/90/35/1021279035.db2.gz YHAQIUIWOMZRDS-UHFFFAOYSA-N 1 1 310.441 3.721 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)OC[C@H]2c2ccccc2)cc1C ZINC000743408856 1021288863 /nfs/dbraw/zinc/28/88/63/1021288863.db2.gz OZLQBUBXEKDNAR-LPHOPBHVSA-N 1 1 311.425 3.971 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2[nH]cnc2c1 ZINC001137049109 1021313164 /nfs/dbraw/zinc/31/31/64/1021313164.db2.gz ZFQYQLKMZKMRNS-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2nc[nH]c2c1 ZINC001137049109 1021313183 /nfs/dbraw/zinc/31/31/83/1021313183.db2.gz ZFQYQLKMZKMRNS-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2nc[nH]c2c1 ZINC001137049109 1021313201 /nfs/dbraw/zinc/31/32/01/1021313201.db2.gz ZFQYQLKMZKMRNS-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc1 ZINC000918066669 1021437519 /nfs/dbraw/zinc/43/75/19/1021437519.db2.gz IAHQXDGXEKYCQS-UHFFFAOYSA-N 1 1 310.441 3.579 20 10 DHCDMO COCc1csc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000850377337 1021499774 /nfs/dbraw/zinc/49/97/74/1021499774.db2.gz FILRKKCFPVZNOJ-UHFFFAOYSA-N 1 1 315.797 3.682 20 10 DHCDMO Cc1cc(O)c(CN[C@@H]2CC[N@@H+](C3CCCCC3)C2)cc1C ZINC000850382039 1021501212 /nfs/dbraw/zinc/50/12/12/1021501212.db2.gz NGMNHUKZJIJPKF-QGZVFWFLSA-N 1 1 302.462 3.506 20 10 DHCDMO Cc1cc(O)c(CN[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1C ZINC000850382039 1021501216 /nfs/dbraw/zinc/50/12/16/1021501216.db2.gz NGMNHUKZJIJPKF-QGZVFWFLSA-N 1 1 302.462 3.506 20 10 DHCDMO CCOc1ccc(CNc2ccc(OCC)c(C)[nH+]2)c(O)c1 ZINC000850411169 1021517366 /nfs/dbraw/zinc/51/73/66/1021517366.db2.gz PNLIEZYYJXTQMV-UHFFFAOYSA-N 1 1 302.374 3.505 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COC(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000850481252 1021557155 /nfs/dbraw/zinc/55/71/55/1021557155.db2.gz FGYNIEKKNUQWGP-ZJUUUORDSA-N 1 1 303.324 3.629 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)C1(CO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000850516539 1021572444 /nfs/dbraw/zinc/57/24/44/1021572444.db2.gz WYHMJPQTLFGPBB-IUCAKERBSA-N 1 1 304.217 3.511 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(F)cc1O ZINC000850541907 1021595033 /nfs/dbraw/zinc/59/50/33/1021595033.db2.gz DNFGJNKQXOCYCK-IAGOWNOFSA-N 1 1 301.361 3.965 20 10 DHCDMO C[C@H]([NH2+]CC1CCC(O)CC1)c1cccc(C(F)(F)F)c1O ZINC000850552637 1021600791 /nfs/dbraw/zinc/60/07/91/1021600791.db2.gz PBCAILCDHIUCFW-UNXYVOJBSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000850581819 1021622320 /nfs/dbraw/zinc/62/23/20/1021622320.db2.gz GVPZOVUWSUHYNG-ZDUSSCGKSA-N 1 1 322.880 3.818 20 10 DHCDMO CO[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001237087324 1021671457 /nfs/dbraw/zinc/67/14/57/1021671457.db2.gz VCYDDNRFBHROLJ-VHSXEESVSA-N 1 1 304.217 3.698 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001237087324 1021671459 /nfs/dbraw/zinc/67/14/59/1021671459.db2.gz VCYDDNRFBHROLJ-VHSXEESVSA-N 1 1 304.217 3.698 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCc1cccs1)C[C@H]1CCCO1 ZINC000109761871 1021744735 /nfs/dbraw/zinc/74/47/35/1021744735.db2.gz ZKGONFFMDRHMQU-MRXNPFEDSA-N 1 1 317.454 3.677 20 10 DHCDMO CO[C@@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C1CCC1 ZINC000851840373 1022020008 /nfs/dbraw/zinc/02/00/08/1022020008.db2.gz DYKMNPJQBRXTLU-IBGZPJMESA-N 1 1 315.413 3.803 20 10 DHCDMO CCN(C)c1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000766472737 1022122497 /nfs/dbraw/zinc/12/24/97/1022122497.db2.gz BCSPGSXRKCRPGA-WDYCEAGBSA-N 1 1 303.494 3.666 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)ccc1N(C)C ZINC000852596357 1022146800 /nfs/dbraw/zinc/14/68/00/1022146800.db2.gz LFCJBAFWWOUNDB-UYAOXDASSA-N 1 1 316.489 3.842 20 10 DHCDMO C[C@H](CC[NH2+][C@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183541069 1022180298 /nfs/dbraw/zinc/18/02/98/1022180298.db2.gz QMDWPXZUOFGKRC-IAGOWNOFSA-N 1 1 312.457 3.953 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[O-] ZINC000853241909 1022241700 /nfs/dbraw/zinc/24/17/00/1022241700.db2.gz YSFTWMVCEBYGTK-QAPCUYQASA-N 1 1 320.452 3.694 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000853565023 1022294643 /nfs/dbraw/zinc/29/46/43/1022294643.db2.gz YMTBGPRAAZPXIN-CYBMUJFWSA-N 1 1 309.425 3.967 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(C)s2)c1 ZINC000756461167 1022398068 /nfs/dbraw/zinc/39/80/68/1022398068.db2.gz WGCAKIKXPKNEGL-NEPJUHHUSA-N 1 1 319.426 3.961 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CC(=O)OC(C)C)C2)cc1C ZINC000183799541 1022412239 /nfs/dbraw/zinc/41/22/39/1022412239.db2.gz IFYUYNKSFZVPEZ-MRXNPFEDSA-N 1 1 319.445 3.563 20 10 DHCDMO C[C@@H](NCC1([NH3+])CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000854222663 1022433016 /nfs/dbraw/zinc/43/30/16/1022433016.db2.gz JPYXMVSGQLQBPA-MRXNPFEDSA-N 1 1 301.478 3.599 20 10 DHCDMO COc1ccc(O)c(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC000179610696 1022488809 /nfs/dbraw/zinc/48/88/09/1022488809.db2.gz PJPCPLNSZRRMMM-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC000179610696 1022488820 /nfs/dbraw/zinc/48/88/20/1022488820.db2.gz PJPCPLNSZRRMMM-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2cc(OC)ccc2O)C2CC2)cc1 ZINC000179609930 1022489261 /nfs/dbraw/zinc/48/92/61/1022489261.db2.gz GWSZOILHGBDXGB-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO COc1cc2c(cc1F)C[N@@H+](Cc1cc(C)cc(C)c1O)CC2 ZINC000776782595 1022572985 /nfs/dbraw/zinc/57/29/85/1022572985.db2.gz QYBVUTWOOVQRPE-UHFFFAOYSA-N 1 1 315.388 3.715 20 10 DHCDMO Cc1cccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)c1O ZINC000180242665 1022670787 /nfs/dbraw/zinc/67/07/87/1022670787.db2.gz UNTBENZDZFCWBJ-IBGZPJMESA-N 1 1 311.425 3.573 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccnc(F)c1)C1CCCC1 ZINC000859138097 1033078032 /nfs/dbraw/zinc/07/80/32/1033078032.db2.gz BWCJGROILJLDGA-UHFFFAOYSA-N 1 1 300.377 3.871 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccc(Cl)o1)C[C@@H]1CCCO1 ZINC000768162558 1022907939 /nfs/dbraw/zinc/90/79/39/1022907939.db2.gz QDIOEFAUXPXDAR-AWEZNQCLSA-N 1 1 321.804 3.820 20 10 DHCDMO CCOc1cncc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)c1 ZINC000857011344 1022920644 /nfs/dbraw/zinc/92/06/44/1022920644.db2.gz BTEHQWPSSBEMEL-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc(N2CCOCC2)cc1 ZINC000768249458 1022932873 /nfs/dbraw/zinc/93/28/73/1022932873.db2.gz GRIKNVQTSLGZDM-UHFFFAOYSA-N 1 1 314.429 3.527 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCO[C@@H]1C1CC1)c1cc(F)cc(F)c1O ZINC000768291747 1022940382 /nfs/dbraw/zinc/94/03/82/1022940382.db2.gz FPYHXXCGEKGEAM-HKJPBSJPSA-N 1 1 311.372 3.526 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)c1O ZINC000768329453 1022947125 /nfs/dbraw/zinc/94/71/25/1022947125.db2.gz FCORUHFDXRAJAQ-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c(O)cc1C ZINC000768453355 1022966926 /nfs/dbraw/zinc/96/69/26/1022966926.db2.gz VOXJBYULXYPVRK-AWEZNQCLSA-N 1 1 315.388 3.838 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC3(CCCCC3)C2)cc1OC ZINC000768447074 1022968141 /nfs/dbraw/zinc/96/81/41/1022968141.db2.gz MBICBHOSIRSDEY-UHFFFAOYSA-N 1 1 319.445 3.956 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C(C)C)CC2)cc1OC ZINC000768445040 1022968666 /nfs/dbraw/zinc/96/86/66/1022968666.db2.gz DPDUOUAAPDXJRR-CQSZACIVSA-N 1 1 307.434 3.668 20 10 DHCDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768447395 1022969130 /nfs/dbraw/zinc/96/91/30/1022969130.db2.gz OSGNHUGWNUXBRO-ZFWWWQNUSA-N 1 1 307.434 3.810 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1F)Cc1c(O)cccc1OC ZINC000768486071 1022970971 /nfs/dbraw/zinc/97/09/71/1022970971.db2.gz HBAMAIUSIZQNJX-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OC[C@H]2O ZINC000768464740 1022974415 /nfs/dbraw/zinc/97/44/15/1022974415.db2.gz TVBUPNFPPVOXCN-MAUKXSAKSA-N 1 1 319.445 3.609 20 10 DHCDMO CCC[N@@H+](CCc1cccs1)Cc1c(O)cccc1OC ZINC000768523284 1022981011 /nfs/dbraw/zinc/98/10/11/1022981011.db2.gz FIOBQWYNDZEHKJ-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@]2(C)Cc2ccccc2)c1O ZINC000768534556 1022982771 /nfs/dbraw/zinc/98/27/71/1022982771.db2.gz FPIBOSMAODDMMH-FQEVSTJZSA-N 1 1 311.425 3.998 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 ZINC000768914261 1023054721 /nfs/dbraw/zinc/05/47/21/1023054721.db2.gz UPPLFUDZKMDQNX-ZNMIVQPWSA-N 1 1 322.880 3.883 20 10 DHCDMO Cc1cc(O)c(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1C ZINC000768913728 1023054828 /nfs/dbraw/zinc/05/48/28/1023054828.db2.gz QXSSKBIGDASPQG-SCTDSRPQSA-N 1 1 316.489 3.846 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCc2ccccc2F)c1 ZINC000769020918 1023070084 /nfs/dbraw/zinc/07/00/84/1023070084.db2.gz IZWKNTKZEDSPHL-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO COc1cccc(C[N@H+]2CCCC[C@H]2Cc2ccccc2)c1O ZINC000769229522 1023102900 /nfs/dbraw/zinc/10/29/00/1023102900.db2.gz MJGMWNKYOQYQPR-SFHVURJKSA-N 1 1 311.425 3.998 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1 ZINC000769244762 1023107139 /nfs/dbraw/zinc/10/71/39/1023107139.db2.gz ORGZKVYQURJIIV-QUCCMNQESA-N 1 1 311.425 3.789 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769338064 1023127094 /nfs/dbraw/zinc/12/70/94/1023127094.db2.gz KKUATQNHCXDJMH-OAHLLOKOSA-N 1 1 315.388 3.920 20 10 DHCDMO CCC[N@H+](Cc1cc(OCC)ccc1O)C[C@@H]1CCCCO1 ZINC000769339577 1023128449 /nfs/dbraw/zinc/12/84/49/1023128449.db2.gz SMZVCPMXHUVCGA-KRWDZBQOSA-N 1 1 307.434 3.572 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)C1CC(C)(C)N(O)C(C)(C)C1 ZINC001170005822 1023130428 /nfs/dbraw/zinc/13/04/28/1023130428.db2.gz VBISQMFZFRKSNV-UHFFFAOYSA-N 1 1 306.450 3.625 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c(O)c1 ZINC000769383792 1023137710 /nfs/dbraw/zinc/13/77/10/1023137710.db2.gz JQBYNNSWCMMARI-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO C[C@@]1(c2ccccc2)C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769399879 1023139432 /nfs/dbraw/zinc/13/94/32/1023139432.db2.gz WOHDAOJGPPYFDP-SFHVURJKSA-N 1 1 317.816 3.793 20 10 DHCDMO C[C@@]1(c2ccccc2)C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769399879 1023139436 /nfs/dbraw/zinc/13/94/36/1023139436.db2.gz WOHDAOJGPPYFDP-SFHVURJKSA-N 1 1 317.816 3.793 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC2(CCCC2)C1 ZINC000301719302 1033108125 /nfs/dbraw/zinc/10/81/25/1033108125.db2.gz FHODINBGEQZWDO-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)cc1 ZINC000769485214 1023152496 /nfs/dbraw/zinc/15/24/96/1023152496.db2.gz LVPPEHIMCUQWHN-HXUWFJFHSA-N 1 1 316.489 3.925 20 10 DHCDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769452264 1023155614 /nfs/dbraw/zinc/15/56/14/1023155614.db2.gz UVDQUBFFVYESRR-IAGOWNOFSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769446717 1023156406 /nfs/dbraw/zinc/15/64/06/1023156406.db2.gz SGLGHFQVKWKELC-GOSISDBHSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769446717 1023156409 /nfs/dbraw/zinc/15/64/09/1023156409.db2.gz SGLGHFQVKWKELC-GOSISDBHSA-N 1 1 317.816 3.928 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCOC(C)(C)C2)cc1F ZINC000769462584 1023159709 /nfs/dbraw/zinc/15/97/09/1023159709.db2.gz HSBUIQYBZJGSKZ-UHFFFAOYSA-N 1 1 308.441 3.673 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000769493030 1023166077 /nfs/dbraw/zinc/16/60/77/1023166077.db2.gz QYMNNYMJHFYUOI-GOSISDBHSA-N 1 1 319.445 3.715 20 10 DHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000769498013 1023166279 /nfs/dbraw/zinc/16/62/79/1023166279.db2.gz JKSIYMGAWWSQDT-LJQANCHMSA-N 1 1 313.441 3.782 20 10 DHCDMO C[N@@H+](CCOCC1CC1)Cc1cc(-c2ccccc2)ccc1O ZINC000769523259 1023173614 /nfs/dbraw/zinc/17/36/14/1023173614.db2.gz DERZUCAUVBTNPT-UHFFFAOYSA-N 1 1 311.425 3.918 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC000770376153 1023301033 /nfs/dbraw/zinc/30/10/33/1023301033.db2.gz VDPRMTCLFPHKME-RTBURBONSA-N 1 1 316.489 3.781 20 10 DHCDMO CCn1nc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c2ccccc21 ZINC000770611112 1023333043 /nfs/dbraw/zinc/33/30/43/1023333043.db2.gz KHXJAAPNIVFVSL-UHFFFAOYSA-N 1 1 322.456 3.754 20 10 DHCDMO CCN1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788506639 1023898122 /nfs/dbraw/zinc/89/81/22/1023898122.db2.gz XBRWHCWYPXAUGA-RYUDHWBXSA-N 1 1 316.367 3.546 20 10 DHCDMO CSC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000788793258 1023939848 /nfs/dbraw/zinc/93/98/48/1023939848.db2.gz BOMHTEUUQDRXRD-VIFPVBQESA-N 1 1 305.365 3.957 20 10 DHCDMO COCC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CCC1 ZINC000788820727 1023941020 /nfs/dbraw/zinc/94/10/20/1023941020.db2.gz DAORVQSKJMIREW-NSHDSACASA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccccc1 ZINC000093867481 1023941825 /nfs/dbraw/zinc/94/18/25/1023941825.db2.gz KWNPYCAOAQBURP-UWJYYQICSA-N 1 1 322.452 3.716 20 10 DHCDMO Fc1cc(C[N@@H+](C2CC2)C2CCCC2)ccc1N1CCOCC1 ZINC000130217631 1024143148 /nfs/dbraw/zinc/14/31/48/1024143148.db2.gz UJFWFGAGMHUEFM-UHFFFAOYSA-N 1 1 318.436 3.569 20 10 DHCDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1F ZINC000882880645 1024156721 /nfs/dbraw/zinc/15/67/21/1024156721.db2.gz CAHFUBDNZSGKED-SECBINFHSA-N 1 1 311.303 3.669 20 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ICSXAGLFUZFGED-UHFFFAOYSA-N 1 1 312.797 3.591 20 10 DHCDMO CCc1cnccc1[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790980662 1024424054 /nfs/dbraw/zinc/42/40/54/1024424054.db2.gz BOZJVLXOCLJIEI-JTQLQIEISA-N 1 1 308.784 3.993 20 10 DHCDMO Cc1ccc(NCc2c(O)ccc(Cl)c2F)c(N(C)C)[nH+]1 ZINC000790982868 1024426013 /nfs/dbraw/zinc/42/60/13/1024426013.db2.gz LENSJSHZHHGXPF-UHFFFAOYSA-N 1 1 309.772 3.566 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC3(C2)CCOCC3)cc1 ZINC000271228186 1024473615 /nfs/dbraw/zinc/47/36/15/1024473615.db2.gz SESNLAYWKJRZJL-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000271444495 1024508414 /nfs/dbraw/zinc/50/84/14/1024508414.db2.gz SOQUMUBQGXZZIW-KRWDZBQOSA-N 1 1 307.397 3.616 20 10 DHCDMO C[N@H+](Cc1ccccc1O)C[C@@H](O)Cc1ccc2ccccc2c1 ZINC000791475425 1024509013 /nfs/dbraw/zinc/50/90/13/1024509013.db2.gz OVDUKDOULMXKLD-FQEVSTJZSA-N 1 1 321.420 3.581 20 10 DHCDMO CC(C)COC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccco1 ZINC000101597044 1024516999 /nfs/dbraw/zinc/51/69/99/1024516999.db2.gz GXBNKMWQTOIFMX-GOSISDBHSA-N 1 1 316.445 3.849 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC000792167360 1024641198 /nfs/dbraw/zinc/64/11/98/1024641198.db2.gz PLFVXWPOUIVMLL-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000792174176 1024643528 /nfs/dbraw/zinc/64/35/28/1024643528.db2.gz RRNAQZUBSRLVAJ-CQSZACIVSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000792174176 1024643535 /nfs/dbraw/zinc/64/35/35/1024643535.db2.gz RRNAQZUBSRLVAJ-CQSZACIVSA-N 1 1 313.800 3.576 20 10 DHCDMO COCC[C@@H]1CCCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173967 1024644137 /nfs/dbraw/zinc/64/41/37/1024644137.db2.gz AITHJGGMEWAMON-LBPRGKRZSA-N 1 1 315.816 3.823 20 10 DHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173967 1024644143 /nfs/dbraw/zinc/64/41/43/1024644143.db2.gz AITHJGGMEWAMON-LBPRGKRZSA-N 1 1 315.816 3.823 20 10 DHCDMO C[N@@H+](CCC1CCOCC1)Cc1ccc(N2CCCC2)cc1 ZINC001202660587 1024786676 /nfs/dbraw/zinc/78/66/76/1024786676.db2.gz HVGMABXEAYDBGC-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)c(O)c1C ZINC000793569289 1025103858 /nfs/dbraw/zinc/10/38/58/1025103858.db2.gz MUXCNQPOCPTNIO-AWEZNQCLSA-N 1 1 309.413 3.779 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1O ZINC000793573489 1025124831 /nfs/dbraw/zinc/12/48/31/1025124831.db2.gz OOKYRQVUCXUGBS-SFHVURJKSA-N 1 1 312.413 3.687 20 10 DHCDMO OCC[C@@H]1CCCCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000793609675 1025129033 /nfs/dbraw/zinc/12/90/33/1025129033.db2.gz RCWSPMFTUBYZKR-IBGZPJMESA-N 1 1 316.489 3.804 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)cc1C(C)C ZINC000884483362 1025135453 /nfs/dbraw/zinc/13/54/53/1025135453.db2.gz RINXOFHVHNQEPZ-BEFAXECRSA-N 1 1 303.446 3.825 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)cc2O)o1 ZINC000877395895 1033294206 /nfs/dbraw/zinc/29/42/06/1033294206.db2.gz OYQYHLHUSNVBPM-MRXNPFEDSA-N 1 1 301.386 3.777 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000893995484 1025639561 /nfs/dbraw/zinc/63/95/61/1025639561.db2.gz LWLBQVFRGHZCBY-QGZVFWFLSA-N 1 1 319.351 3.634 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000893995484 1025639566 /nfs/dbraw/zinc/63/95/66/1025639566.db2.gz LWLBQVFRGHZCBY-QGZVFWFLSA-N 1 1 319.351 3.634 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000893986123 1025642295 /nfs/dbraw/zinc/64/22/95/1025642295.db2.gz KDYKUGQAJMCALL-UHFFFAOYSA-N 1 1 311.372 3.594 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1c(O)cccc1F ZINC000886502835 1025659087 /nfs/dbraw/zinc/65/90/87/1025659087.db2.gz QCBGVQOYFMQRRK-CQSZACIVSA-N 1 1 314.404 3.982 20 10 DHCDMO CCOc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccc1OC ZINC000886528556 1025680218 /nfs/dbraw/zinc/68/02/18/1025680218.db2.gz NYWILQIURCYZFX-LBPRGKRZSA-N 1 1 319.376 3.789 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccccc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886542979 1025691311 /nfs/dbraw/zinc/69/13/11/1025691311.db2.gz ITMYBZHDPDREDI-IIYDPXPESA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1c(O)cccc1F ZINC000886547312 1025693833 /nfs/dbraw/zinc/69/38/33/1025693833.db2.gz IZXKZPNGMAHXOM-YGRLFVJLSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1c(O)cccc1F ZINC000886555364 1025705007 /nfs/dbraw/zinc/70/50/07/1025705007.db2.gz QSDHSNFDFCWLRQ-ACJLOTCBSA-N 1 1 315.388 3.696 20 10 DHCDMO CCSc1cc(C[NH2+][C@@H](C)c2c(O)cccc2F)ccn1 ZINC000886594040 1025728151 /nfs/dbraw/zinc/72/81/51/1025728151.db2.gz FCOIXGRIIPFWPT-NSHDSACASA-N 1 1 306.406 3.889 20 10 DHCDMO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886615633 1025740141 /nfs/dbraw/zinc/74/01/41/1025740141.db2.gz KLMSOXUDPJZIGY-VHSXEESVSA-N 1 1 309.303 3.539 20 10 DHCDMO C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)ccc1O ZINC000248490949 1025967641 /nfs/dbraw/zinc/96/76/41/1025967641.db2.gz IJERLEQERFCPBV-HUUCEWRRSA-N 1 1 308.441 3.837 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1ccc(F)cc1O ZINC000289929205 1026238121 /nfs/dbraw/zinc/23/81/21/1026238121.db2.gz VJRSPDYFXFLCPW-PIGZYNQJSA-N 1 1 321.417 3.732 20 10 DHCDMO CCc1cnc(C[N@H+](C)Cc2c(O)ccc3ccncc32)s1 ZINC000747471103 1026240924 /nfs/dbraw/zinc/24/09/24/1026240924.db2.gz DPAZFBXOSYIFKM-UHFFFAOYSA-N 1 1 313.426 3.591 20 10 DHCDMO CCc1cnc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)s1 ZINC000747471103 1026240935 /nfs/dbraw/zinc/24/09/35/1026240935.db2.gz DPAZFBXOSYIFKM-UHFFFAOYSA-N 1 1 313.426 3.591 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)NCC[N@H+](C)C2CCCC2)c1O ZINC000808691516 1026349764 /nfs/dbraw/zinc/34/97/64/1026349764.db2.gz IRYYCFHKZKOLBU-CYBMUJFWSA-N 1 1 310.869 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)NCC[N@@H+](C)C2CCCC2)c1O ZINC000808691516 1026349774 /nfs/dbraw/zinc/34/97/74/1026349774.db2.gz IRYYCFHKZKOLBU-CYBMUJFWSA-N 1 1 310.869 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)c1O ZINC000808707084 1026359008 /nfs/dbraw/zinc/35/90/08/1026359008.db2.gz ZZCUTRSCDJDZNA-HZMBPMFUSA-N 1 1 305.809 3.805 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)[C@@H](C)c2cccnc2)c(O)c1 ZINC000809766090 1026619597 /nfs/dbraw/zinc/61/95/97/1026619597.db2.gz UQYQBFSJAHTOJA-AWEZNQCLSA-N 1 1 300.402 3.769 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](CC)c2ccncc2)c(O)c1 ZINC000809765537 1026620316 /nfs/dbraw/zinc/62/03/16/1026620316.db2.gz NZXNUEHUZIASQG-KRWDZBQOSA-N 1 1 300.402 3.769 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2oc(C)nc2C)cc1 ZINC000809933211 1026641981 /nfs/dbraw/zinc/64/19/81/1026641981.db2.gz VZRUHVSQNLMXRF-UHFFFAOYSA-N 1 1 301.434 3.770 20 10 DHCDMO COc1ccc(O)c(CNc2cc(C)[nH+]c3c(OC)cccc23)c1 ZINC000811805252 1027086851 /nfs/dbraw/zinc/08/68/51/1027086851.db2.gz NZTKMRCWYHNWAJ-UHFFFAOYSA-N 1 1 324.380 3.878 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000812295649 1027247195 /nfs/dbraw/zinc/24/71/95/1027247195.db2.gz GEYDJFUIGHCNAL-MRXNPFEDSA-N 1 1 313.445 3.642 20 10 DHCDMO COCC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CCCC1 ZINC000747791484 1027296150 /nfs/dbraw/zinc/29/61/50/1027296150.db2.gz MNBQLKBVROWIGK-UHFFFAOYSA-N 1 1 321.461 3.786 20 10 DHCDMO C[C@@H]1C[C@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)CCO1 ZINC000778985419 1027718590 /nfs/dbraw/zinc/71/85/90/1027718590.db2.gz SYRAMOQQLSUAKX-HZPDHXFCSA-N 1 1 315.413 3.803 20 10 DHCDMO C[C@@H](CN[C@@H](C)c1ccc(N2CCCCCC2)cc1)C[NH+](C)C ZINC000813877529 1027747148 /nfs/dbraw/zinc/74/71/48/1027747148.db2.gz YSYGEIZFKKYOMK-ROUUACIJSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)CN(C)C ZINC000813877529 1027747166 /nfs/dbraw/zinc/74/71/66/1027747166.db2.gz YSYGEIZFKKYOMK-ROUUACIJSA-N 1 1 317.521 3.915 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c(O)c1 ZINC000814171024 1027924005 /nfs/dbraw/zinc/92/40/05/1027924005.db2.gz HNFVFZVFEXWHHG-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(O)c1 ZINC000814171025 1027925991 /nfs/dbraw/zinc/92/59/91/1027925991.db2.gz HNFVFZVFEXWHHG-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1ccc(F)cc1O ZINC000527953270 1027987531 /nfs/dbraw/zinc/98/75/31/1027987531.db2.gz VUDDYGGLBMFEML-CJNGLKHVSA-N 1 1 306.425 3.589 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC=C(c3cncc(F)c3)CC2)cc1 ZINC000365855041 1028020655 /nfs/dbraw/zinc/02/06/55/1028020655.db2.gz TVUWTPIUIVYOKB-UHFFFAOYSA-N 1 1 311.404 3.576 20 10 DHCDMO Cc1nc([C@H]2CCCC[N@@H+]2Cc2c(O)ccc3ccccc32)no1 ZINC000367474343 1028191629 /nfs/dbraw/zinc/19/16/29/1028191629.db2.gz FKVLZZUWAXCLHS-QGZVFWFLSA-N 1 1 323.396 3.964 20 10 DHCDMO Cc1nc([C@H]2CCCC[N@H+]2Cc2c(O)ccc3ccccc32)no1 ZINC000367474343 1028191634 /nfs/dbraw/zinc/19/16/34/1028191634.db2.gz FKVLZZUWAXCLHS-QGZVFWFLSA-N 1 1 323.396 3.964 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@H+]2[C@@H](CC)c2ccccc2O)no1 ZINC000368030909 1028282814 /nfs/dbraw/zinc/28/28/14/1028282814.db2.gz QKHWLAOHRMXLAH-KBPBESRZSA-N 1 1 301.390 3.626 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@@H+]2[C@@H](CC)c2ccccc2O)no1 ZINC000368030909 1028282836 /nfs/dbraw/zinc/28/28/36/1028282836.db2.gz QKHWLAOHRMXLAH-KBPBESRZSA-N 1 1 301.390 3.626 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)ccc1N(C)C ZINC000815060546 1028342906 /nfs/dbraw/zinc/34/29/06/1028342906.db2.gz ABHJXLGMXWAZDC-SFHVURJKSA-N 1 1 316.470 3.696 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](c3ccsc3)C2)ccc1N(C)C ZINC000815060546 1028342919 /nfs/dbraw/zinc/34/29/19/1028342919.db2.gz ABHJXLGMXWAZDC-SFHVURJKSA-N 1 1 316.470 3.696 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC000815078641 1028351228 /nfs/dbraw/zinc/35/12/28/1028351228.db2.gz DUYHEHCWXIQLIA-SFHVURJKSA-N 1 1 312.461 3.738 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(N(C)CC)cc1)C2 ZINC000815116792 1028363008 /nfs/dbraw/zinc/36/30/08/1028363008.db2.gz FEVLMQYHLMJTAE-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1 ZINC000815119412 1028366191 /nfs/dbraw/zinc/36/61/91/1028366191.db2.gz WYGAYCAXEHEWLK-MOPGFXCFSA-N 1 1 314.473 3.676 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1 ZINC000815119413 1028367059 /nfs/dbraw/zinc/36/70/59/1028367059.db2.gz WYGAYCAXEHEWLK-OALUTQOASA-N 1 1 314.473 3.676 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@H](c3nccs3)C2)c1 ZINC000368798715 1028411715 /nfs/dbraw/zinc/41/17/15/1028411715.db2.gz SQCHVCQFJPKZAZ-OLZOCXBDSA-N 1 1 318.442 3.798 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCCC[C@H]1O ZINC000779154449 1028458667 /nfs/dbraw/zinc/45/86/67/1028458667.db2.gz SQIYBTPOSNMPKJ-UYAOXDASSA-N 1 1 316.489 3.660 20 10 DHCDMO C[C@@H]([NH2+]Cc1nccs1)c1cccc(C(F)(F)F)c1O ZINC000815563065 1028544944 /nfs/dbraw/zinc/54/49/44/1028544944.db2.gz SRXMPBIRUQKQDB-MRVPVSSYSA-N 1 1 302.321 3.718 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000369928994 1028546960 /nfs/dbraw/zinc/54/69/60/1028546960.db2.gz GFCAPGQSFIOAQB-RDJZCZTQSA-N 1 1 303.427 3.978 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)on1 ZINC000815576672 1028550840 /nfs/dbraw/zinc/55/08/40/1028550840.db2.gz WBKPXUKWPKUGRU-SECBINFHSA-N 1 1 300.280 3.558 20 10 DHCDMO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815578605 1028551652 /nfs/dbraw/zinc/55/16/52/1028551652.db2.gz RTVGKUMGBSLKFV-YGRLFVJLSA-N 1 1 319.367 3.859 20 10 DHCDMO CO[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1(C)C ZINC000815587470 1028556022 /nfs/dbraw/zinc/55/60/22/1028556022.db2.gz KUBTYQCMBCDWKV-JIMOISOXSA-N 1 1 317.351 3.875 20 10 DHCDMO C[C@H]([NH2+]CCc1cscn1)c1cccc(C(F)(F)F)c1O ZINC000815589253 1028559583 /nfs/dbraw/zinc/55/95/83/1028559583.db2.gz MWXPEXWCONCFBF-VIFPVBQESA-N 1 1 316.348 3.761 20 10 DHCDMO C[C@H]([NH2+]CC1(O)CCCCC1)c1cccc(C(F)(F)F)c1O ZINC000815573004 1028566931 /nfs/dbraw/zinc/56/69/31/1028566931.db2.gz VJWWVZHCQRETSO-NSHDSACASA-N 1 1 317.351 3.757 20 10 DHCDMO CC[C@H](C)N(C)CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815574274 1028567006 /nfs/dbraw/zinc/56/70/06/1028567006.db2.gz KRXDWKKMQXAGKR-NWDGAFQWSA-N 1 1 318.383 3.792 20 10 DHCDMO CC[C@@H](C)N(C)CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815574276 1028567059 /nfs/dbraw/zinc/56/70/59/1028567059.db2.gz KRXDWKKMQXAGKR-VXGBXAGGSA-N 1 1 318.383 3.792 20 10 DHCDMO CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628197 1028577139 /nfs/dbraw/zinc/57/71/39/1028577139.db2.gz UEFAFOXAWBTVCG-VXGBXAGGSA-N 1 1 318.383 3.790 20 10 DHCDMO CC(C)N(C)C[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628196 1028578033 /nfs/dbraw/zinc/57/80/33/1028578033.db2.gz UEFAFOXAWBTVCG-RYUDHWBXSA-N 1 1 318.383 3.790 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccc(F)cc1O ZINC000815648173 1028591959 /nfs/dbraw/zinc/59/19/59/1028591959.db2.gz GHNPGQJWMQGLKR-WMLDXEAASA-N 1 1 309.425 3.761 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000371326624 1028690088 /nfs/dbraw/zinc/69/00/88/1028690088.db2.gz JORIOCGVDQNCKM-RBUKOAKNSA-N 1 1 314.473 3.535 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H](c3cccs3)C[C@@H]2C)c1O ZINC000371397867 1028700374 /nfs/dbraw/zinc/70/03/74/1028700374.db2.gz FMGICWYLPPAPRE-JSGCOSHPSA-N 1 1 303.427 3.840 20 10 DHCDMO C[C@H]1CCSCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000189918870 1028711144 /nfs/dbraw/zinc/71/11/44/1028711144.db2.gz RPSOLLRZYKRBDU-LBPRGKRZSA-N 1 1 309.475 3.723 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H](c3ccsc3)C[C@@H]2C)c1O ZINC000372405583 1028852096 /nfs/dbraw/zinc/85/20/96/1028852096.db2.gz WMYDBIAFEUPKJA-WFASDCNBSA-N 1 1 303.427 3.840 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@H](C)Cc1ccsc1 ZINC000190259820 1028866499 /nfs/dbraw/zinc/86/64/99/1028866499.db2.gz JGAUFAWAUQQTKY-CYBMUJFWSA-N 1 1 305.443 3.915 20 10 DHCDMO C[N@@H+](Cc1conc1Cc1ccccc1)Cc1ccccc1O ZINC000816493100 1028898298 /nfs/dbraw/zinc/89/82/98/1028898298.db2.gz PCPCFMTXSLJFGT-UHFFFAOYSA-N 1 1 308.381 3.603 20 10 DHCDMO Oc1c(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)ccc2ccccc21 ZINC000816499321 1028905409 /nfs/dbraw/zinc/90/54/09/1028905409.db2.gz LJZGGLQHYJOLBM-KRWDZBQOSA-N 1 1 307.397 3.996 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)[C@H](CCO)c1ccccc1 ZINC000816512833 1028911369 /nfs/dbraw/zinc/91/13/69/1028911369.db2.gz WLMXLAUWPBWKSN-MRXNPFEDSA-N 1 1 323.795 3.740 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@H](CCO)c1ccccc1 ZINC000816512833 1028911385 /nfs/dbraw/zinc/91/13/85/1028911385.db2.gz WLMXLAUWPBWKSN-MRXNPFEDSA-N 1 1 323.795 3.740 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@@H](C3CCOCC3)C2)ccc2ccccc21 ZINC000816516532 1028917496 /nfs/dbraw/zinc/91/74/96/1028917496.db2.gz IQFPDLXOTFKEDW-QGZVFWFLSA-N 1 1 311.425 3.794 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000816536269 1028924223 /nfs/dbraw/zinc/92/42/23/1028924223.db2.gz QFYXXFNQGCCETE-SECBINFHSA-N 1 1 324.739 3.944 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCOc2ccccc21 ZINC000816549595 1028928533 /nfs/dbraw/zinc/92/85/33/1028928533.db2.gz SQDGNJANJOWSHY-LLVKDONJSA-N 1 1 321.779 3.841 20 10 DHCDMO CC(C)C[N@@H+](CCN(C)C)Cc1ccc2ccccc2c1O ZINC000816610501 1028960089 /nfs/dbraw/zinc/96/00/89/1028960089.db2.gz MSDNZCMJKPHFKX-UHFFFAOYSA-N 1 1 300.446 3.565 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](c3csc(C)c3)C2)c1O ZINC000373565513 1029079815 /nfs/dbraw/zinc/07/98/15/1029079815.db2.gz BYTTVAHKTIQUKN-CYBMUJFWSA-N 1 1 303.427 3.760 20 10 DHCDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000817413276 1029152416 /nfs/dbraw/zinc/15/24/16/1029152416.db2.gz VNFLLCQQTPOTMC-HZPDHXFCSA-N 1 1 311.425 3.510 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000817412230 1029152706 /nfs/dbraw/zinc/15/27/06/1029152706.db2.gz GSYMNPSIUWXFCI-LBPRGKRZSA-N 1 1 317.351 3.955 20 10 DHCDMO C[C@H](C[C@H]1CCCCC[NH2+]1)NCc1ccc(N2CCCC2)cc1 ZINC000817898135 1029268936 /nfs/dbraw/zinc/26/89/36/1029268936.db2.gz DKLMRHWCVUKGPJ-IEBWSBKVSA-N 1 1 315.505 3.687 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC000374302967 1029284122 /nfs/dbraw/zinc/28/41/22/1029284122.db2.gz REJLYOLNHGMKPA-OAHLLOKOSA-N 1 1 318.442 3.975 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC000374302967 1029284136 /nfs/dbraw/zinc/28/41/36/1029284136.db2.gz REJLYOLNHGMKPA-OAHLLOKOSA-N 1 1 318.442 3.975 20 10 DHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817940264 1029284451 /nfs/dbraw/zinc/28/44/51/1029284451.db2.gz FCYIJLZAFHMYEL-DLBZAZTESA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)cc1 ZINC000817937987 1029285371 /nfs/dbraw/zinc/28/53/71/1029285371.db2.gz AXJVOYQKTMBSSQ-ACJLOTCBSA-N 1 1 317.864 3.757 20 10 DHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cccc(OC)c1O ZINC000191190670 1029309493 /nfs/dbraw/zinc/30/94/93/1029309493.db2.gz XYLHNSCVUXGZOT-UHFFFAOYSA-N 1 1 310.397 3.904 20 10 DHCDMO C[C@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817971171 1029310703 /nfs/dbraw/zinc/31/07/03/1029310703.db2.gz JWUOMTHYUJIDGG-VYDXJSESSA-N 1 1 319.468 3.607 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970186 1029310828 /nfs/dbraw/zinc/31/08/28/1029310828.db2.gz NNUYGKQKUGTAFG-SCRDCRAPSA-N 1 1 316.367 3.722 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[NH2+]CC[C@@H]1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969044 1029312005 /nfs/dbraw/zinc/31/20/05/1029312005.db2.gz QHHWXTFLGUGIIW-XDTLVQLUSA-N 1 1 317.260 3.738 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977037 1029317058 /nfs/dbraw/zinc/31/70/58/1029317058.db2.gz ZQLMTHKNYCCYDW-RISCZKNCSA-N 1 1 318.383 3.969 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc2ccccc2c1[O-] ZINC000817985268 1029323925 /nfs/dbraw/zinc/32/39/25/1029323925.db2.gz ITHFUHNJQNGXLY-HOCLYGCPSA-N 1 1 310.441 3.871 20 10 DHCDMO C[C@H](N[C@@H]1CCCC[C@H]1[NH3+])c1ccc(N2CCCCC2)cc1 ZINC000818619007 1029422911 /nfs/dbraw/zinc/42/29/11/1029422911.db2.gz XGNYYZSIIAWCOG-KFKAGJAMSA-N 1 1 301.478 3.597 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(N2CCCCC2)cc1 ZINC000818619007 1029422918 /nfs/dbraw/zinc/42/29/18/1029422918.db2.gz XGNYYZSIIAWCOG-KFKAGJAMSA-N 1 1 301.478 3.597 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](O)c2ccccc2C1 ZINC000373822015 1029825159 /nfs/dbraw/zinc/82/51/59/1029825159.db2.gz WLXNYRPXQDWFMH-INIZCTEOSA-N 1 1 321.779 3.624 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1C ZINC000291011984 1030286934 /nfs/dbraw/zinc/28/69/34/1030286934.db2.gz WXKDBDPPGYYPJR-MSOLQXFVSA-N 1 1 301.430 3.543 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(F)cc1O ZINC000866478656 1030313997 /nfs/dbraw/zinc/31/39/97/1030313997.db2.gz JWFLYVHFULHWKJ-GOSISDBHSA-N 1 1 315.388 3.845 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1cccc(C)c1O ZINC000291123693 1030344989 /nfs/dbraw/zinc/34/49/89/1030344989.db2.gz VFORZCUWJZEDEQ-UHFFFAOYSA-N 1 1 300.402 3.677 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccc(Cl)cc1O ZINC000866530906 1030350799 /nfs/dbraw/zinc/35/07/99/1030350799.db2.gz NRWNOSHSOGBYAC-STQMWFEESA-N 1 1 309.837 3.903 20 10 DHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)s1 ZINC000772876177 1030383086 /nfs/dbraw/zinc/38/30/86/1030383086.db2.gz SDZQMHYRRBAADT-JTQLQIEISA-N 1 1 307.438 3.816 20 10 DHCDMO Cc1cc(C)c([C@H](C)[N@H+]2CCOc3ccc(N)cc3C2)c(O)c1 ZINC000925755461 1030482572 /nfs/dbraw/zinc/48/25/72/1030482572.db2.gz WBZWXRKWIRWHJU-AWEZNQCLSA-N 1 1 312.413 3.547 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(Br)cc(C)c1O)C(F)F ZINC000824508188 1030579400 /nfs/dbraw/zinc/57/94/00/1030579400.db2.gz BOZTXQMYLPTKME-JTQLQIEISA-N 1 1 308.166 3.596 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(Br)cc(C)c1O)C(F)F ZINC000824508189 1030580380 /nfs/dbraw/zinc/58/03/80/1030580380.db2.gz BOZTXQMYLPTKME-SNVBAGLBSA-N 1 1 308.166 3.596 20 10 DHCDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000825090704 1030725505 /nfs/dbraw/zinc/72/55/05/1030725505.db2.gz DZIYDRXWEHKQAP-LJQANCHMSA-N 1 1 316.489 3.660 20 10 DHCDMO Cc1nc(CN(Cc2ccccc2O)[C@H](C)c2ccccc2)n[nH]1 ZINC000292657549 1031117950 /nfs/dbraw/zinc/11/79/50/1031117950.db2.gz AWBRJPITHJPNJV-CQSZACIVSA-N 1 1 322.412 3.582 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](Cc2cnn(CC)c2)C(C)C)cc1 ZINC000844422986 1031118983 /nfs/dbraw/zinc/11/89/83/1031118983.db2.gz JTMDDTPDNKWLAO-UHFFFAOYSA-N 1 1 314.477 3.770 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccc(N(C)C)c(C)c2)C(C)C)cn1 ZINC000844424011 1031122151 /nfs/dbraw/zinc/12/21/51/1031122151.db2.gz WERWUFURIHJZHR-UHFFFAOYSA-N 1 1 314.477 3.688 20 10 DHCDMO CC[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144300214 1031432107 /nfs/dbraw/zinc/43/21/07/1031432107.db2.gz XNHWKHBQSKHKJJ-JTQLQIEISA-N 1 1 302.187 3.668 20 10 DHCDMO CC[C@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144300214 1031432100 /nfs/dbraw/zinc/43/21/00/1031432100.db2.gz XNHWKHBQSKHKJJ-JTQLQIEISA-N 1 1 302.187 3.668 20 10 DHCDMO C[N@H+](Cc1cc(Br)c(F)cc1O)C1CC(F)(F)C1 ZINC001144298940 1031438808 /nfs/dbraw/zinc/43/88/08/1031438808.db2.gz MHWLGJWABJSWMM-UHFFFAOYSA-N 1 1 324.140 3.523 20 10 DHCDMO C[N@@H+](Cc1cc(Br)c(F)cc1O)C1CC(F)(F)C1 ZINC001144298940 1031438817 /nfs/dbraw/zinc/43/88/17/1031438817.db2.gz MHWLGJWABJSWMM-UHFFFAOYSA-N 1 1 324.140 3.523 20 10 DHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299035 1031439957 /nfs/dbraw/zinc/43/99/57/1031439957.db2.gz PKWBEFNLMVUDJD-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299035 1031439962 /nfs/dbraw/zinc/43/99/62/1031439962.db2.gz PKWBEFNLMVUDJD-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO CC[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306506 1031456354 /nfs/dbraw/zinc/45/63/54/1031456354.db2.gz DVWDAXPDJDRJMV-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306506 1031456359 /nfs/dbraw/zinc/45/63/59/1031456359.db2.gz DVWDAXPDJDRJMV-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)O[C@H](C)C2)cc1C ZINC000872815973 1031666685 /nfs/dbraw/zinc/66/66/85/1031666685.db2.gz FFTSONKLSVZAAV-IUODEOHRSA-N 1 1 317.351 3.551 20 10 DHCDMO CC(C)[N@@H+](Cc1c(O)cc(O)cc1O)[C@@H](C)c1ccccc1 ZINC001144515651 1031675586 /nfs/dbraw/zinc/67/55/86/1031675586.db2.gz CVRFFRQGWJOOSH-ZDUSSCGKSA-N 1 1 301.386 3.775 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000873260764 1031779469 /nfs/dbraw/zinc/77/94/69/1031779469.db2.gz HDESRKBOHULUJM-AEIGPULVSA-N 1 1 308.853 3.617 20 10 DHCDMO C[C@@]1(CC[NH2+]Cc2cc(Cl)c(F)cc2O)C[C@@]1(F)Cl ZINC000846029273 1031820788 /nfs/dbraw/zinc/82/07/88/1031820788.db2.gz IJQODVQTIGZFTH-OLZOCXBDSA-N 1 1 310.171 3.979 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000897746240 1031828802 /nfs/dbraw/zinc/82/88/02/1031828802.db2.gz AOGUKPZRSKVHCR-FGWVZKOKSA-N 1 1 301.814 3.701 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2(C3CCC3)CC2)c1 ZINC000846054461 1031849126 /nfs/dbraw/zinc/84/91/26/1031849126.db2.gz BNJQKNFCMNYQPB-UHFFFAOYSA-N 1 1 310.235 3.885 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2cc(Cl)cc(C)c2O)C(C)C)cn1 ZINC000846055627 1031849553 /nfs/dbraw/zinc/84/95/53/1031849553.db2.gz NPQCQRIWLORUFF-UHFFFAOYSA-N 1 1 321.852 3.981 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1ccccc1F)[C@@H](C)O)c1ccc(F)cc1O ZINC000846181894 1031914347 /nfs/dbraw/zinc/91/43/47/1031914347.db2.gz FOVZEUCZNWCNEG-VOZBZGINSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@H]1CN(Cc2cc(F)c(F)cc2O)CC[N@H+]1C1CCCCC1 ZINC001142534308 1031955922 /nfs/dbraw/zinc/95/59/22/1031955922.db2.gz DXFDZTCZSNFNSR-ZDUSSCGKSA-N 1 1 324.415 3.509 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000877516612 1033331930 /nfs/dbraw/zinc/33/19/30/1033331930.db2.gz GYAPVKDWLIOIKB-HSALFYBXSA-N 1 1 323.436 3.705 20 10 DHCDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877575134 1033363593 /nfs/dbraw/zinc/36/35/93/1033363593.db2.gz IGPFVJHFTPHQIR-DLBZAZTESA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1C ZINC000877674939 1033407110 /nfs/dbraw/zinc/40/71/10/1033407110.db2.gz XMWIZLKMMSSYSE-RBUKOAKNSA-N 1 1 311.425 3.707 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@H](C(F)(F)F)O1 ZINC000877824115 1033473679 /nfs/dbraw/zinc/47/36/79/1033473679.db2.gz OVVLNYMMSORTJT-TVQRCGJNSA-N 1 1 323.742 3.587 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCc2ncsc2C1 ZINC001173140557 1033565808 /nfs/dbraw/zinc/56/58/08/1033565808.db2.gz HWYGNTCNPWKPGB-INIZCTEOSA-N 1 1 315.486 3.589 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl ZINC000826049736 1033751113 /nfs/dbraw/zinc/75/11/13/1033751113.db2.gz YJJYOJTZWURZMP-DJIMGWMZSA-N 1 1 323.864 3.870 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000862485490 1033866779 /nfs/dbraw/zinc/86/67/79/1033866779.db2.gz NOTJSFFSEUKLAF-GDBMZVCRSA-N 1 1 319.445 3.500 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1F ZINC000862540975 1033882616 /nfs/dbraw/zinc/88/26/16/1033882616.db2.gz MUFSCNQQNDYFGT-INIZCTEOSA-N 1 1 314.404 3.587 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1nc(C2CC2)no1 ZINC000174374783 1033928169 /nfs/dbraw/zinc/92/81/69/1033928169.db2.gz ARUDSTWSCSZOFS-GFCCVEGCSA-N 1 1 301.390 3.626 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(C2CC2)no1 ZINC000174374783 1033928174 /nfs/dbraw/zinc/92/81/74/1033928174.db2.gz ARUDSTWSCSZOFS-GFCCVEGCSA-N 1 1 301.390 3.626 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@@H](C)[C@H]3C)cc2)CC1 ZINC000842163103 1034220875 /nfs/dbraw/zinc/22/08/75/1034220875.db2.gz JZXSWYSVEPEGLB-GVDBMIGSSA-N 1 1 316.489 3.778 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H]2CCc3ccccc32)cc1OC ZINC000179476107 1034312639 /nfs/dbraw/zinc/31/26/39/1034312639.db2.gz LSTZAZNNTNSZAG-INIZCTEOSA-N 1 1 313.397 3.529 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000179577785 1034319363 /nfs/dbraw/zinc/31/93/63/1034319363.db2.gz ZJNUSTFCZVIMCR-UHFFFAOYSA-N 1 1 313.241 3.709 20 10 DHCDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183730446 1034417135 /nfs/dbraw/zinc/41/71/35/1034417135.db2.gz MZCXMNVSRAMLET-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000184998435 1034518005 /nfs/dbraw/zinc/51/80/05/1034518005.db2.gz LSJMPBKVLYXVSN-HUUCEWRRSA-N 1 1 314.404 3.708 20 10 DHCDMO CC[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccc(C)cc1O ZINC000794814822 1034523444 /nfs/dbraw/zinc/52/34/44/1034523444.db2.gz UCPPCTXSXYIRAP-INIZCTEOSA-N 1 1 322.412 3.727 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(F)cc2O)o1 ZINC000185548076 1034556661 /nfs/dbraw/zinc/55/66/61/1034556661.db2.gz LUROQLKHYMCTGT-IAQYHMDHSA-N 1 1 307.365 3.725 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)cc1 ZINC000773765444 1035442940 /nfs/dbraw/zinc/44/29/40/1035442940.db2.gz KBNMZJXKNDFVRW-INIZCTEOSA-N 1 1 312.457 3.911 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cnc(OC)s2)cc1 ZINC001180359508 1035653762 /nfs/dbraw/zinc/65/37/62/1035653762.db2.gz OQNJQKKWITYGQG-UHFFFAOYSA-N 1 1 319.474 3.630 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnc(OC)s2)cc1 ZINC001180359508 1035653773 /nfs/dbraw/zinc/65/37/73/1035653773.db2.gz OQNJQKKWITYGQG-UHFFFAOYSA-N 1 1 319.474 3.630 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCC[C@H]2Cc2ccccc2)c(O)c1 ZINC001180524518 1035697510 /nfs/dbraw/zinc/69/75/10/1035697510.db2.gz YHFRYIXDJCMTEP-KRWDZBQOSA-N 1 1 311.425 3.916 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC001181526225 1035935524 /nfs/dbraw/zinc/93/55/24/1035935524.db2.gz VKYNBMIHMBVCCT-KBPBESRZSA-N 1 1 309.837 3.684 20 10 DHCDMO CC(C)[C@H](CO)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)C(C)C ZINC001181891533 1036034421 /nfs/dbraw/zinc/03/44/21/1036034421.db2.gz BJPSTHZRNNUFKS-LRDDRELGSA-N 1 1 317.832 3.563 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774109205 1036168009 /nfs/dbraw/zinc/16/80/09/1036168009.db2.gz BVZFLSNCEOUKQV-VIFPVBQESA-N 1 1 305.249 3.690 20 10 DHCDMO CCN(CC)CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774112671 1036171551 /nfs/dbraw/zinc/17/15/51/1036171551.db2.gz SCFWAGLFMHCEPU-SNVBAGLBSA-N 1 1 305.249 3.691 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1cccc(Cl)c1[O-] ZINC000775644876 1036182011 /nfs/dbraw/zinc/18/20/11/1036182011.db2.gz WFXCBYYOLLXIDO-UHFFFAOYSA-N 1 1 311.834 3.756 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC001182327332 1036225329 /nfs/dbraw/zinc/22/53/29/1036225329.db2.gz RTWFYMAARNGKMG-HNNXBMFYSA-N 1 1 315.841 3.904 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC001182327332 1036225346 /nfs/dbraw/zinc/22/53/46/1036225346.db2.gz RTWFYMAARNGKMG-HNNXBMFYSA-N 1 1 315.841 3.904 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(OC)ccc1O ZINC000775653232 1036241862 /nfs/dbraw/zinc/24/18/62/1036241862.db2.gz ANZBQHURGMAVSP-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)on1 ZINC000775656064 1036251169 /nfs/dbraw/zinc/25/11/69/1036251169.db2.gz OAKZJZRYKVDNFA-AWEZNQCLSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cccc(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1O ZINC000775659301 1036263877 /nfs/dbraw/zinc/26/38/77/1036263877.db2.gz VHYPLTLUUOWFGU-SOLBZPMBSA-N 1 1 302.462 3.538 20 10 DHCDMO C[C@H]([NH2+]CC1(CCO)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774257951 1036264190 /nfs/dbraw/zinc/26/41/90/1036264190.db2.gz QCBQBLPYIZZTBR-JTQLQIEISA-N 1 1 318.244 3.902 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1cc(F)cc(F)c1O ZINC000774441505 1036332107 /nfs/dbraw/zinc/33/21/07/1036332107.db2.gz JRDHVWHMMNOAFH-NSHDSACASA-N 1 1 318.367 3.795 20 10 DHCDMO CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000774499354 1036359950 /nfs/dbraw/zinc/35/99/50/1036359950.db2.gz XFUSMQKJUBCNBS-QGZVFWFLSA-N 1 1 322.880 3.961 20 10 DHCDMO COc1ccc(O)c(C[N@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000775702629 1036483137 /nfs/dbraw/zinc/48/31/37/1036483137.db2.gz UDWYPMKXUYSURP-UHFFFAOYSA-N 1 1 315.388 3.952 20 10 DHCDMO Cc1cc(Cl)cc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1O ZINC000775726713 1036576895 /nfs/dbraw/zinc/57/68/95/1036576895.db2.gz XPGHGLCLBVPHRN-OAHLLOKOSA-N 1 1 322.880 3.518 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccccc1OC ZINC001183443940 1036594759 /nfs/dbraw/zinc/59/47/59/1036594759.db2.gz LSFQXKCYWNWOTR-OAHLLOKOSA-N 1 1 307.340 3.920 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1O ZINC000775738356 1036595664 /nfs/dbraw/zinc/59/56/64/1036595664.db2.gz BDRDKCLYSLYCJU-UONOGXRCSA-N 1 1 309.837 3.603 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(Cl)cc1 ZINC000774639911 1036605291 /nfs/dbraw/zinc/60/52/91/1036605291.db2.gz MVHAIQUASZYYNK-GOSISDBHSA-N 1 1 319.832 3.991 20 10 DHCDMO C[C@H]1CCOCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000774650721 1036630246 /nfs/dbraw/zinc/63/02/46/1036630246.db2.gz ROBOOJXTIYGECP-ZDUSSCGKSA-N 1 1 311.381 3.902 20 10 DHCDMO CSC1(C[NH2+]Cc2cc(F)c(F)cc2O)CCCCC1 ZINC001183842393 1036681670 /nfs/dbraw/zinc/68/16/70/1036681670.db2.gz BXKFZAOFHQAZFV-UHFFFAOYSA-N 1 1 301.402 3.826 20 10 DHCDMO CC(C)[C@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000775764963 1036722055 /nfs/dbraw/zinc/72/20/55/1036722055.db2.gz MHFSQBBFRWMFTB-MRXNPFEDSA-N 1 1 317.433 3.815 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@H](C3CCCC3)C2)c(O)c1OC ZINC001184351516 1036822899 /nfs/dbraw/zinc/82/28/99/1036822899.db2.gz QFYLGRLDJDSZJK-HNNXBMFYSA-N 1 1 319.445 3.812 20 10 DHCDMO Oc1ccccc1CNCC1([NH+]2CCCCC2)CCCCC1 ZINC000238096340 1037039446 /nfs/dbraw/zinc/03/94/46/1037039446.db2.gz MREYTZTYIVIFND-UHFFFAOYSA-N 1 1 302.462 3.671 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cccnc2)c(O)c(C(C)(C)C)c1 ZINC000915825956 1037242177 /nfs/dbraw/zinc/24/21/77/1037242177.db2.gz KOBNJBMQHYFEPK-UHFFFAOYSA-N 1 1 314.429 3.725 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H]2COCc2ccccc2)cc1 ZINC001203934139 1037252965 /nfs/dbraw/zinc/25/29/65/1037252965.db2.gz OBXULMPVRBOJRA-FQEVSTJZSA-N 1 1 310.441 3.544 20 10 DHCDMO CCCCCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774958394 1037276156 /nfs/dbraw/zinc/27/61/56/1037276156.db2.gz YAXPHJHKKJOZBK-GFCCVEGCSA-N 1 1 310.394 3.758 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1 ZINC000776015581 1037310162 /nfs/dbraw/zinc/31/01/62/1037310162.db2.gz WIQNNVIFMUJHHC-OAQYLSRUSA-N 1 1 322.452 3.774 20 10 DHCDMO CCCC[C@H](CCC)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775035344 1037454929 /nfs/dbraw/zinc/45/49/29/1037454929.db2.gz YWVZZQDLRYHBEE-ZDUSSCGKSA-N 1 1 310.394 3.758 20 10 DHCDMO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(Cl)ccc1O ZINC001203663747 1037651010 /nfs/dbraw/zinc/65/10/10/1037651010.db2.gz GCKXWUNUJHLZPB-UHFFFAOYSA-N 1 1 303.789 3.750 20 10 DHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775137805 1037692615 /nfs/dbraw/zinc/69/26/15/1037692615.db2.gz QJKUZVRGZYIFNM-MRVPVSSYSA-N 1 1 311.706 3.959 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@]3(CCOC3)C2)c(O)c(C(C)(C)C)c1 ZINC000151285854 1037818545 /nfs/dbraw/zinc/81/85/45/1037818545.db2.gz OLMOXBMGSYJNOO-LJQANCHMSA-N 1 1 303.446 3.611 20 10 DHCDMO Oc1c(CNc2cccn3cc[nH+]c23)cc(Cl)c2cccnc12 ZINC001168521749 1037979568 /nfs/dbraw/zinc/97/95/68/1037979568.db2.gz IYGWZUJAONXSNF-UHFFFAOYSA-N 1 1 324.771 3.854 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H](C)CC2CCCCC2)ccc1[N+](=O)[O-] ZINC000775204826 1038001633 /nfs/dbraw/zinc/00/16/33/1038001633.db2.gz DNCGSBATZUXXOM-LBPRGKRZSA-N 1 1 322.405 3.758 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3ccccc3F)C2)c1 ZINC000164274944 1038111105 /nfs/dbraw/zinc/11/11/05/1038111105.db2.gz OEQPGXFIFHVNNF-SFHVURJKSA-N 1 1 315.388 3.722 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CC2)cc1 ZINC001190447081 1038320677 /nfs/dbraw/zinc/32/06/77/1038320677.db2.gz RJPCULLUTHFAMG-XLIONFOSSA-N 1 1 314.473 3.644 20 10 DHCDMO CC[C@@H]([NH2+]Cc1csc(N(C)C)n1)c1ccc(N(C)C)cc1 ZINC000157096467 1038506148 /nfs/dbraw/zinc/50/61/48/1038506148.db2.gz DEFXDADFADAODN-MRXNPFEDSA-N 1 1 318.490 3.516 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000760881004 1038956623 /nfs/dbraw/zinc/95/66/23/1038956623.db2.gz LAGUCBZKLAGBLR-NEPJUHHUSA-N 1 1 304.463 3.714 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@](C)(F)C2)cc1Cl ZINC001232263779 1039009844 /nfs/dbraw/zinc/00/98/44/1039009844.db2.gz AAPONBZYLQKKOG-HNNXBMFYSA-N 1 1 301.789 3.768 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(O)c1C ZINC000760899124 1039036950 /nfs/dbraw/zinc/03/69/50/1039036950.db2.gz XDAKZRVPHDWTSK-INIZCTEOSA-N 1 1 304.478 3.782 20 10 DHCDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000157824067 1039601853 /nfs/dbraw/zinc/60/18/53/1039601853.db2.gz HTNCZTGPCOVZOT-HNNXBMFYSA-N 1 1 316.470 3.778 20 10 DHCDMO CCC[N@@H+](Cc1c(C)nn(CC)c1C)Cc1ccccc1O ZINC000092704990 185334294 /nfs/dbraw/zinc/33/42/94/185334294.db2.gz MYOIJOLURXFFNV-UHFFFAOYSA-N 1 1 301.434 3.638 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@H](C)c1cccc(O)c1 ZINC000091975176 193135029 /nfs/dbraw/zinc/13/50/29/193135029.db2.gz YNJMLFRGEDNBFP-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cccc(OCC)c2O)CC1 ZINC000093317108 193230277 /nfs/dbraw/zinc/23/02/77/193230277.db2.gz GJTXSHMVFQLNHP-INIZCTEOSA-N 1 1 307.434 3.572 20 10 DHCDMO CCc1ccc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)s1 ZINC000273301196 130105250 /nfs/dbraw/zinc/10/52/50/130105250.db2.gz BOCJGFMBEIYSMX-LLVKDONJSA-N 1 1 319.426 3.654 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1C ZINC000273533114 130133732 /nfs/dbraw/zinc/13/37/32/130133732.db2.gz WSZZNOWUSNEFIJ-OAHLLOKOSA-N 1 1 304.478 3.923 20 10 DHCDMO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)CCO2 ZINC000274359300 130229157 /nfs/dbraw/zinc/22/91/57/130229157.db2.gz IAGJGQDODYDHAC-ZBEGNZNMSA-N 1 1 317.360 3.714 20 10 DHCDMO COc1ccc(C[NH2+]Cc2ccn(Cc3ccccc3)n2)cc1C ZINC000284029448 131042662 /nfs/dbraw/zinc/04/26/62/131042662.db2.gz OARWSUJVVGCXMF-UHFFFAOYSA-N 1 1 321.424 3.538 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1O ZINC000284215487 131060377 /nfs/dbraw/zinc/06/03/77/131060377.db2.gz CMJOHGZAILRORR-OCCSQVGLSA-N 1 1 300.229 3.716 20 10 DHCDMO Cc1noc([C@H]2CCC[N@H+]2Cc2c(O)ccc3ccccc32)n1 ZINC000285206624 131147296 /nfs/dbraw/zinc/14/72/96/131147296.db2.gz SZDXLKGQHYWXIF-MRXNPFEDSA-N 1 1 309.369 3.574 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)c(OC)c1)c1ccc(F)cc1O ZINC000285769474 131200449 /nfs/dbraw/zinc/20/04/49/131200449.db2.gz SSWRSBNROFWNQW-OAHLLOKOSA-N 1 1 319.376 3.789 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(F)cc1O ZINC000287357701 131276624 /nfs/dbraw/zinc/27/66/24/131276624.db2.gz HCEMMLPNWKIKLR-RDJZCZTQSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(N(C)C)cc1 ZINC000297151457 132002088 /nfs/dbraw/zinc/00/20/88/132002088.db2.gz CJDPDURQTBRUFR-NSHDSACASA-N 1 1 307.800 3.791 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(-c2cc[nH]n2)cc1)c1ccc(F)cc1O ZINC000320564867 335083955 /nfs/dbraw/zinc/08/39/55/335083955.db2.gz OUCNKGWSKISQMG-GFCCVEGCSA-N 1 1 311.360 3.772 20 10 DHCDMO C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc2ccccc2c1[O-] ZINC000185356444 333369671 /nfs/dbraw/zinc/36/96/71/333369671.db2.gz KKZDRAKZUGAQRA-HNNXBMFYSA-N 1 1 312.457 3.928 20 10 DHCDMO CC[N@@H+](CCc1cccs1)Cc1cc(OC)c(OC)cc1O ZINC000271091851 334018521 /nfs/dbraw/zinc/01/85/21/334018521.db2.gz LIMUYQBHKVRXLL-UHFFFAOYSA-N 1 1 321.442 3.536 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccc(F)cc1O ZINC000286207563 334151675 /nfs/dbraw/zinc/15/16/75/334151675.db2.gz RWPTZLULYMKNFJ-MGPLVRAMSA-N 1 1 306.381 3.808 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1COc2cccc(F)c21)c1ccc(F)cc1O ZINC000367620534 336826794 /nfs/dbraw/zinc/82/67/94/336826794.db2.gz YFCUKPDANWSEQX-UONOGXRCSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COc2cccc(F)c21)c1ccc(N(C)C)cc1 ZINC000374674885 336994647 /nfs/dbraw/zinc/99/46/47/336994647.db2.gz BTWBDTUHLYQSMQ-MLGOLLRUSA-N 1 1 300.377 3.676 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCCn2cc(C)nc21)c1ccc(F)cc1O ZINC000375843571 337021029 /nfs/dbraw/zinc/02/10/29/337021029.db2.gz YBDDBPDVINHUGQ-CZUORRHYSA-N 1 1 317.408 3.655 20 10 DHCDMO Oc1ccc(Cl)c(F)c1CN1CCC[C@H]1c1nccs1 ZINC000377014679 337045338 /nfs/dbraw/zinc/04/53/38/337045338.db2.gz NUJSGWDIJPTZNR-NSHDSACASA-N 1 1 312.797 3.978 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC2(C1)CCOCC2 ZINC000377242752 337049244 /nfs/dbraw/zinc/04/92/44/337049244.db2.gz HYFGIMREKJCIPK-UHFFFAOYSA-N 1 1 314.473 3.679 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@H]2c2nccs2)c1 ZINC000377641557 337057185 /nfs/dbraw/zinc/05/71/85/337057185.db2.gz AVBUBJAKGIZWHX-FZMZJTMJSA-N 1 1 304.415 3.755 20 10 DHCDMO Cc1csc(C2CC[NH+](Cc3cccc(F)c3O)CC2)n1 ZINC000378488399 337074069 /nfs/dbraw/zinc/07/40/69/337074069.db2.gz AMGQSFXBXKOJNA-UHFFFAOYSA-N 1 1 306.406 3.676 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1noc(-c2ccccc2)n1 ZINC000183562745 337192268 /nfs/dbraw/zinc/19/22/68/337192268.db2.gz VMFWGGQNAVLECS-CHWSQXEVSA-N 1 1 309.369 3.854 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](c1nnc(C)[nH]1)c1ccccc1)c1ccccc1O ZINC000185210271 337203383 /nfs/dbraw/zinc/20/33/83/337203383.db2.gz DGHHCYUEFXBOBO-SJLPKXTDSA-N 1 1 322.412 3.649 20 10 DHCDMO COc1cccc([C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)OC)c1 ZINC000527929611 337776345 /nfs/dbraw/zinc/77/63/45/337776345.db2.gz STLLUMPTRKSIEF-KPZWWZAWSA-N 1 1 319.376 3.578 20 10 DHCDMO CC(C)COC[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccco1 ZINC000180561478 519755192 /nfs/dbraw/zinc/75/51/92/519755192.db2.gz VJURYQPEEGJMAM-OAHLLOKOSA-N 1 1 307.365 3.628 20 10 DHCDMO CC[N@H+](Cc1cccc(F)c1O)[C@@H]1CCCc2cccnc21 ZINC000365002904 521350186 /nfs/dbraw/zinc/35/01/86/521350186.db2.gz PTHAVALKGGOZSY-MRXNPFEDSA-N 1 1 300.377 3.826 20 10 DHCDMO CC[N@@H+](Cc1cccc(F)c1O)[C@@H]1CCCc2cccnc21 ZINC000365002904 521350192 /nfs/dbraw/zinc/35/01/92/521350192.db2.gz PTHAVALKGGOZSY-MRXNPFEDSA-N 1 1 300.377 3.826 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(N(CC)CC)c(F)c1)c1nccn1C ZINC000182918724 522650015 /nfs/dbraw/zinc/65/00/15/522650015.db2.gz QVFCWNZRAVPRCJ-INIZCTEOSA-N 1 1 318.440 3.646 20 10 DHCDMO COc1cc(O)c(C[N@@H+]([C@H](C)c2ccco2)C2CC2)cc1OC ZINC000179849993 522772987 /nfs/dbraw/zinc/77/29/87/522772987.db2.gz LJGLAHKQHPSEBQ-GFCCVEGCSA-N 1 1 317.385 3.728 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000156389360 523155759 /nfs/dbraw/zinc/15/57/59/523155759.db2.gz QJKRWEJDFVNQER-IPELMVKDSA-N 1 1 311.425 3.791 20 10 DHCDMO CCn1nccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000156480060 523722659 /nfs/dbraw/zinc/72/26/59/523722659.db2.gz MWLOWPMTMDTPAA-UHFFFAOYSA-N 1 1 312.461 3.525 20 10 DHCDMO CCn1nccc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000156480060 523722664 /nfs/dbraw/zinc/72/26/64/523722664.db2.gz MWLOWPMTMDTPAA-UHFFFAOYSA-N 1 1 312.461 3.525 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@H](c2ccsc2)O1 ZINC000180223338 524988499 /nfs/dbraw/zinc/98/84/99/524988499.db2.gz KAVPSZNBLCOJHS-BDJLRTHQSA-N 1 1 307.390 3.555 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@H](c2ccsc2)O1 ZINC000180223338 524988509 /nfs/dbraw/zinc/98/85/09/524988509.db2.gz KAVPSZNBLCOJHS-BDJLRTHQSA-N 1 1 307.390 3.555 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000191595551 525354358 /nfs/dbraw/zinc/35/43/58/525354358.db2.gz MXLGBPWXHXVPBQ-CQSZACIVSA-N 1 1 323.396 3.525 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(F)cc1O ZINC000297300624 535805579 /nfs/dbraw/zinc/80/55/79/535805579.db2.gz MJERQFZFFTVIHD-CYBMUJFWSA-N 1 1 312.747 3.960 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1O ZINC000285986886 535808189 /nfs/dbraw/zinc/80/81/89/535808189.db2.gz HWWVAPKCJWFLPP-CABCVRRESA-N 1 1 307.365 3.861 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1ccc(F)cc1O ZINC000285806839 535917900 /nfs/dbraw/zinc/91/79/00/535917900.db2.gz VQRAFIXCJSHDHO-HNNXBMFYSA-N 1 1 317.360 3.543 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1cccc(Cl)c1[O-] ZINC000287893450 535938308 /nfs/dbraw/zinc/93/83/08/535938308.db2.gz ZDMVIGZUKWNJIZ-ARFHVFGLSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1cccc(Cl)c1[O-] ZINC000287893450 535938311 /nfs/dbraw/zinc/93/83/11/535938311.db2.gz ZDMVIGZUKWNJIZ-ARFHVFGLSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H](COC)c1ccccc1)c1ccc(F)cc1O ZINC000286000721 535944637 /nfs/dbraw/zinc/94/46/37/535944637.db2.gz HNMDYOZIGJDLDO-DLBZAZTESA-N 1 1 303.377 3.960 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC3(C2)CCCCC3)cc1OC ZINC000160295362 1013564423 /nfs/dbraw/zinc/56/44/23/1013564423.db2.gz RUFLBQHPKDGMOH-UHFFFAOYSA-N 1 1 305.418 3.566 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000894887586 1013625927 /nfs/dbraw/zinc/62/59/27/1013625927.db2.gz GNSYEHCUMXPHCN-WCQYABFASA-N 1 1 317.351 3.872 20 10 DHCDMO C[N@H+](CCNCc1ccc(N2CCCCC2)cc1)C1CCCC1 ZINC000237162766 1013790841 /nfs/dbraw/zinc/79/08/41/1013790841.db2.gz PXLFNXSUKLERMG-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO C[N@@H+](CCNCc1ccc(N2CCCCC2)cc1)C1CCCC1 ZINC000237162766 1013790847 /nfs/dbraw/zinc/79/08/47/1013790847.db2.gz PXLFNXSUKLERMG-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172767 1025007867 /nfs/dbraw/zinc/00/78/67/1025007867.db2.gz BOZPLQMWOGUUFR-SMDDNHRTSA-N 1 1 310.235 3.919 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000796828056 1014101669 /nfs/dbraw/zinc/10/16/69/1014101669.db2.gz WGZWQDGYJCVVFS-IEBWSBKVSA-N 1 1 315.388 3.886 20 10 DHCDMO C[C@@H]1CC([NH2+]Cc2ccccc2O)C[C@@H](C)N1Cc1ccccc1 ZINC001168007545 1014433837 /nfs/dbraw/zinc/43/38/37/1014433837.db2.gz AWTPYQNQFJFCAT-IAGOWNOFSA-N 1 1 324.468 3.923 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2)c(O)c1OC ZINC000891504723 1015334510 /nfs/dbraw/zinc/33/45/10/1015334510.db2.gz YNJJKZKUFZTWJM-CYBMUJFWSA-N 1 1 301.386 3.602 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2)c(O)c1OC ZINC000891541569 1015366936 /nfs/dbraw/zinc/36/69/36/1015366936.db2.gz BQJRQLXTDZKYFB-INIZCTEOSA-N 1 1 313.397 3.747 20 10 DHCDMO CC(C)[N@H+](Cc1nccn1C1CC1)Cc1ccc(N(C)C)cc1 ZINC000891632485 1015468283 /nfs/dbraw/zinc/46/82/83/1015468283.db2.gz XWICRRRGEUQWJU-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CC(C)[N@@H+](Cc1nccn1C1CC1)Cc1ccc(N(C)C)cc1 ZINC000891632485 1015468288 /nfs/dbraw/zinc/46/82/88/1015468288.db2.gz XWICRRRGEUQWJU-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO COc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1SC ZINC000896640275 1015693350 /nfs/dbraw/zinc/69/33/50/1015693350.db2.gz ILNXIDXNPNXKTQ-UHFFFAOYSA-N 1 1 307.390 3.552 20 10 DHCDMO COc1ccccc1[C@@H]([NH2+]Cc1ccccc1O)c1ccco1 ZINC000151116232 1016021705 /nfs/dbraw/zinc/02/17/05/1016021705.db2.gz WKHABSBBNPMPAH-LJQANCHMSA-N 1 1 309.365 3.873 20 10 DHCDMO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1O ZINC000796838515 1016025569 /nfs/dbraw/zinc/02/55/69/1016025569.db2.gz IHPFYFYWJASWKE-RRQGHBQHSA-N 1 1 309.425 3.903 20 10 DHCDMO COc1ccc(CC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1F ZINC000185333165 1016863101 /nfs/dbraw/zinc/86/31/01/1016863101.db2.gz BITFUAMLFWSLSA-NSHDSACASA-N 1 1 307.340 3.572 20 10 DHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)Oc1ccccc1F ZINC000185576158 1017019604 /nfs/dbraw/zinc/01/96/04/1017019604.db2.gz QYMMLBZGARQAMM-RYUDHWBXSA-N 1 1 307.340 3.789 20 10 DHCDMO COc1ccc(O[C@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185578508 1017030803 /nfs/dbraw/zinc/03/08/03/1017030803.db2.gz CSLDRWDAXUESRZ-CHWSQXEVSA-N 1 1 319.376 3.658 20 10 DHCDMO Cc1ccnc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC000846975934 1032175323 /nfs/dbraw/zinc/17/53/23/1032175323.db2.gz SJIYDBQHKVAGJW-GOSISDBHSA-N 1 1 309.457 3.754 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C(C)C ZINC000847025049 1032182144 /nfs/dbraw/zinc/18/21/44/1032182144.db2.gz HEUMBJRVTVRGGB-UHFFFAOYSA-N 1 1 304.478 3.922 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C)[C@@H]3C)cc2)CC1 ZINC000294960549 1032224637 /nfs/dbraw/zinc/22/46/37/1032224637.db2.gz KXTYABFLRMSRRS-CVEARBPZSA-N 1 1 302.462 3.532 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c1 ZINC000093453561 1032538222 /nfs/dbraw/zinc/53/82/22/1032538222.db2.gz CRTVXAQWEWWDJT-GOSISDBHSA-N 1 1 312.413 3.831 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CCC[C@@H]1C[NH3+] ZINC001205983211 1032635539 /nfs/dbraw/zinc/63/55/39/1032635539.db2.gz OJHLLEVWQDZKBR-GHMZBOCLSA-N 1 1 317.260 3.506 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926904935 1032664900 /nfs/dbraw/zinc/66/49/00/1032664900.db2.gz KDZQUOWTIUDLKY-KWBADKCTSA-N 1 1 321.314 3.682 20 10 DHCDMO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185743358 1017136043 /nfs/dbraw/zinc/13/60/43/1017136043.db2.gz PCVPCEIWIMBCCT-BZNIZROVSA-N 1 1 301.361 3.878 20 10 DHCDMO Cc1csc(C[C@@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)n1 ZINC000897299340 1017342125 /nfs/dbraw/zinc/34/21/25/1017342125.db2.gz ZKVWIFYAOZEYSO-AWEZNQCLSA-N 1 1 302.443 3.530 20 10 DHCDMO COc1cccc2c1CC[N@@H+](Cc1cc(Cl)cc(F)c1[O-])C2 ZINC000783595116 1017401954 /nfs/dbraw/zinc/40/19/54/1017401954.db2.gz OADCSMDCLAVDAA-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cccc(OC)c2O)cc1 ZINC000125823512 1032720619 /nfs/dbraw/zinc/72/06/19/1032720619.db2.gz HRUIILKILSZLMM-ZDUSSCGKSA-N 1 1 301.386 3.602 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)[C@@H](CO)CC(C)(C)C ZINC001117789896 1017765146 /nfs/dbraw/zinc/76/51/46/1017765146.db2.gz RSEOGUWZAOZRQE-GOSISDBHSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@@H](NCC(C)(C)[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764535137 1018308976 /nfs/dbraw/zinc/30/89/76/1018308976.db2.gz ZNVQKUPPUAQCKF-OAHLLOKOSA-N 1 1 321.484 3.807 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000367378814 1018391533 /nfs/dbraw/zinc/39/15/33/1018391533.db2.gz VDFCVDUQJHECLZ-KBXCAEBGSA-N 1 1 313.397 3.535 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000367378814 1018391548 /nfs/dbraw/zinc/39/15/48/1018391548.db2.gz VDFCVDUQJHECLZ-KBXCAEBGSA-N 1 1 313.397 3.535 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000161868248 1018662587 /nfs/dbraw/zinc/66/25/87/1018662587.db2.gz ZLONLKCGGYGIOL-QGZVFWFLSA-N 1 1 310.441 3.716 20 10 DHCDMO CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000020828415 1032795088 /nfs/dbraw/zinc/79/50/88/1032795088.db2.gz GLHUIXHCARWMIP-HNNXBMFYSA-N 1 1 300.446 3.928 20 10 DHCDMO [O-]c1c(F)cc(Br)cc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000715711625 1018945620 /nfs/dbraw/zinc/94/56/20/1018945620.db2.gz GQIKMEZIXMNJPW-AOOOYVTPSA-N 1 1 314.198 3.526 20 10 DHCDMO CCCC[N@H+](Cc1nc(C(C)C)no1)Cc1ccccc1O ZINC000282540572 1019099871 /nfs/dbraw/zinc/09/98/71/1019099871.db2.gz VZMALNQLJSKQHI-UHFFFAOYSA-N 1 1 303.406 3.701 20 10 DHCDMO CCCC[N@@H+](Cc1nc(C(C)C)no1)Cc1ccccc1O ZINC000282540572 1019099887 /nfs/dbraw/zinc/09/98/87/1019099887.db2.gz VZMALNQLJSKQHI-UHFFFAOYSA-N 1 1 303.406 3.701 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC2(CCCCC2)O1 ZINC001171636111 1032836578 /nfs/dbraw/zinc/83/65/78/1032836578.db2.gz LGBXUDMUEPHMHR-MRXNPFEDSA-N 1 1 302.462 3.676 20 10 DHCDMO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727429364 1019712581 /nfs/dbraw/zinc/71/25/81/1019712581.db2.gz JRSRSKVXTWJAGM-BTYIYWSLSA-N 1 1 323.436 3.843 20 10 DHCDMO CCC[N@@H+](Cc1cccc(C(=O)OC)c1)Cc1ccccc1O ZINC000727831004 1019817816 /nfs/dbraw/zinc/81/78/16/1019817816.db2.gz BLDCVTRHNKUYGP-UHFFFAOYSA-N 1 1 313.397 3.591 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCCc2sccc2C1 ZINC000730456442 1019993187 /nfs/dbraw/zinc/99/31/87/1019993187.db2.gz AIPZTDCMKZSGPY-UHFFFAOYSA-N 1 1 310.422 3.950 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Br)ccc1F ZINC000731843555 1020156887 /nfs/dbraw/zinc/15/68/87/1020156887.db2.gz QIIQMQPLLRSEFZ-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNCc2ccc3c(c2)CCO3)C1 ZINC000732229778 1020213811 /nfs/dbraw/zinc/21/38/11/1020213811.db2.gz GGDIPLHJRRPOIU-MRXNPFEDSA-N 1 1 316.489 3.612 20 10 DHCDMO CC[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000732229778 1020213818 /nfs/dbraw/zinc/21/38/18/1020213818.db2.gz GGDIPLHJRRPOIU-MRXNPFEDSA-N 1 1 316.489 3.612 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2nc3c(s2)CCCC3)c(Cl)c1 ZINC000922697504 1020220170 /nfs/dbraw/zinc/22/01/70/1020220170.db2.gz UPSCPBKZILNUIS-UHFFFAOYSA-N 1 1 322.861 3.979 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CCCc3cccnc32)cc1F ZINC000922884815 1020349477 /nfs/dbraw/zinc/34/94/77/1020349477.db2.gz FSEUJZNWFWGJAR-INIZCTEOSA-N 1 1 317.383 3.593 20 10 DHCDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CCN1Cc1ccccc1 ZINC000179573380 1020411182 /nfs/dbraw/zinc/41/11/82/1020411182.db2.gz BUTSHQBQXOJHAN-PXNSSMCTSA-N 1 1 324.468 3.877 20 10 DHCDMO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766046145 1020606320 /nfs/dbraw/zinc/60/63/20/1020606320.db2.gz XJNGEAZSNVTCGY-YJBOKZPZSA-N 1 1 305.510 3.770 20 10 DHCDMO C[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C[C@H]1CCCO1 ZINC000738060233 1020863028 /nfs/dbraw/zinc/86/30/28/1020863028.db2.gz BQZYUFNFOMQFBE-CYBMUJFWSA-N 1 1 315.413 3.628 20 10 DHCDMO CCS[C@H]1CCCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738226256 1020865388 /nfs/dbraw/zinc/86/53/88/1020865388.db2.gz GAHQLBSRKYYPSC-KRWDZBQOSA-N 1 1 305.487 3.989 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCN(C)C[C@@H]2C(C)C)cc1C(C)C ZINC000738286736 1020866501 /nfs/dbraw/zinc/86/65/01/1020866501.db2.gz ZDRJZDRPUWNCBZ-GOSISDBHSA-N 1 1 304.478 3.596 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCN(C)C[C@H]2C(C)C)cc1C(C)C ZINC000738286737 1020867944 /nfs/dbraw/zinc/86/79/44/1020867944.db2.gz ZDRJZDRPUWNCBZ-SFHVURJKSA-N 1 1 304.478 3.596 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2c(O)ccc3ccncc32)C1(C)C ZINC000740861870 1020956233 /nfs/dbraw/zinc/95/62/33/1020956233.db2.gz SCXPEBSMSXWPHS-ZWKOTPCHSA-N 1 1 314.429 3.576 20 10 DHCDMO C[C@@H](NCC[N@@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274071 1021035761 /nfs/dbraw/zinc/03/57/61/1021035761.db2.gz SKOGRQWVUOSVNP-ZWKOTPCHSA-N 1 1 315.505 3.812 20 10 DHCDMO C[C@@H](NCC[N@H+]1CCC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274071 1021035764 /nfs/dbraw/zinc/03/57/64/1021035764.db2.gz SKOGRQWVUOSVNP-ZWKOTPCHSA-N 1 1 315.505 3.812 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)OCO2 ZINC000742173801 1021094744 /nfs/dbraw/zinc/09/47/44/1021094744.db2.gz LNBIJJGTWFRANE-AWEZNQCLSA-N 1 1 317.772 3.721 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)OCO2 ZINC000742173801 1021094749 /nfs/dbraw/zinc/09/47/49/1021094749.db2.gz LNBIJJGTWFRANE-AWEZNQCLSA-N 1 1 317.772 3.721 20 10 DHCDMO CC(C)[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCCCC1 ZINC000917395035 1021247936 /nfs/dbraw/zinc/24/79/36/1021247936.db2.gz ZRBMOBUDIKQUTF-LJQANCHMSA-N 1 1 316.489 3.612 20 10 DHCDMO CCOc1ccccc1C[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000917479130 1021270388 /nfs/dbraw/zinc/27/03/88/1021270388.db2.gz HEVZUUKBJMCRGG-UHFFFAOYSA-N 1 1 311.425 3.912 20 10 DHCDMO Cc1cc(C[NH+]2CCN(CC3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000917480227 1021271730 /nfs/dbraw/zinc/27/17/30/1021271730.db2.gz YAAFLXHTOULBLH-UHFFFAOYSA-N 1 1 316.489 3.526 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCS1 ZINC000743400704 1021285499 /nfs/dbraw/zinc/28/54/99/1021285499.db2.gz QUWQPTCRPGFOHU-OAHLLOKOSA-N 1 1 317.454 3.881 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)cc1C ZINC000743408858 1021289577 /nfs/dbraw/zinc/28/95/77/1021289577.db2.gz OZLQBUBXEKDNAR-VQIMIIECSA-N 1 1 311.425 3.971 20 10 DHCDMO CC[C@@H]([NH2+]CCc1noc2ccccc21)c1ccc(F)cc1O ZINC000850481794 1021556183 /nfs/dbraw/zinc/55/61/83/1021556183.db2.gz BPWVIDGWVQKTSZ-OAHLLOKOSA-N 1 1 314.360 3.956 20 10 DHCDMO C[C@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(Cl)c(Cl)cc1O ZINC000850482616 1021557393 /nfs/dbraw/zinc/55/73/93/1021557393.db2.gz QCXPYNRKCOJFSP-IUCAKERBSA-N 1 1 304.217 3.917 20 10 DHCDMO COC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1cccc(OC)c1 ZINC000850513076 1021567831 /nfs/dbraw/zinc/56/78/31/1021567831.db2.gz DKHUVXIOBSPNDJ-PXAZEXFGSA-N 1 1 319.376 3.578 20 10 DHCDMO C[C@H]([NH2+][C@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1O ZINC000850523707 1021577487 /nfs/dbraw/zinc/57/74/87/1021577487.db2.gz NWKSDKBUTWQPHQ-WDEREUQCSA-N 1 1 315.335 3.773 20 10 DHCDMO C[C@H]([NH2+]CC1(CC(N)=O)CCCCC1)c1ccc(Cl)cc1O ZINC000850572772 1021614896 /nfs/dbraw/zinc/61/48/96/1021614896.db2.gz GFLFINCBVAKXBO-LBPRGKRZSA-N 1 1 324.852 3.522 20 10 DHCDMO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@@]2(C1)CCCCO2 ZINC001237078621 1021633667 /nfs/dbraw/zinc/63/36/67/1021633667.db2.gz VLJDETZUCPBRBT-OAHLLOKOSA-N 1 1 316.228 3.844 20 10 DHCDMO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@@]2(C1)CCCCO2 ZINC001237078621 1021633680 /nfs/dbraw/zinc/63/36/80/1021633680.db2.gz VLJDETZUCPBRBT-OAHLLOKOSA-N 1 1 316.228 3.844 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000182430096 1021644865 /nfs/dbraw/zinc/64/48/65/1021644865.db2.gz KCJMVPNOOMIHEO-CYBMUJFWSA-N 1 1 324.380 3.907 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC000314033475 1021696644 /nfs/dbraw/zinc/69/66/44/1021696644.db2.gz ONNTWQRAFRAFIB-GFCCVEGCSA-N 1 1 303.324 3.564 20 10 DHCDMO CO[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000851716767 1021972893 /nfs/dbraw/zinc/97/28/93/1021972893.db2.gz QTZHRLYEYXVTRD-RBUKOAKNSA-N 1 1 302.462 3.676 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1cn(C)cn1)Cc1ccccc1O ZINC000851878770 1022026484 /nfs/dbraw/zinc/02/64/84/1022026484.db2.gz CPYHARCSIMYUBS-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cn(C)cn1)Cc1ccccc1O ZINC000851878770 1022026492 /nfs/dbraw/zinc/02/64/92/1022026492.db2.gz CPYHARCSIMYUBS-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C(C)C)C2CCCCC2)cc1OC ZINC000183503858 1022156426 /nfs/dbraw/zinc/15/64/26/1022156426.db2.gz HFUMXRMAWOXFAK-UHFFFAOYSA-N 1 1 307.434 3.953 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2cccs2)c1 ZINC000756378935 1022168172 /nfs/dbraw/zinc/16/81/72/1022168172.db2.gz KMVIHPGVXVIBFZ-NWDGAFQWSA-N 1 1 319.426 3.522 20 10 DHCDMO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000766548731 1022188553 /nfs/dbraw/zinc/18/85/53/1022188553.db2.gz DVCWKRRSERYJNE-GFCCVEGCSA-N 1 1 304.463 3.578 20 10 DHCDMO CC(C)CCO[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000853635422 1022300896 /nfs/dbraw/zinc/30/08/96/1022300896.db2.gz NGDXJETUPFSKNM-MRXNPFEDSA-N 1 1 314.429 3.577 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cc(F)ccc1O ZINC000363863290 1022349698 /nfs/dbraw/zinc/34/96/98/1022349698.db2.gz BAOIXSAVDMCEAM-AMIZOPFISA-N 1 1 309.287 3.594 20 10 DHCDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccccc1O)c1ccc(F)cc1 ZINC000179586926 1022476026 /nfs/dbraw/zinc/47/60/26/1022476026.db2.gz CGPXUMMEOZWVED-KRWDZBQOSA-N 1 1 313.372 3.769 20 10 DHCDMO CCC[N@@H+](CCC(=O)Nc1ccccc1)Cc1ccccc1O ZINC000103479485 1022594058 /nfs/dbraw/zinc/59/40/58/1022594058.db2.gz FJQXAKUWJIABHM-UHFFFAOYSA-N 1 1 312.413 3.633 20 10 DHCDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000179991128 1022605501 /nfs/dbraw/zinc/60/55/01/1022605501.db2.gz WONSYQPGHZCVFC-UHFFFAOYSA-N 1 1 317.404 3.960 20 10 DHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000180068127 1022628771 /nfs/dbraw/zinc/62/87/71/1022628771.db2.gz PSAXJXIZGMFHEE-CHWSQXEVSA-N 1 1 307.434 3.808 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1cscn1 ZINC000768098592 1022881525 /nfs/dbraw/zinc/88/15/25/1022881525.db2.gz KTHZINKVQGKWJP-AWEZNQCLSA-N 1 1 301.459 3.984 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2c1OCO2 ZINC000768134268 1022902417 /nfs/dbraw/zinc/90/24/17/1022902417.db2.gz RAEGWDKVNRMVEY-UHFFFAOYSA-N 1 1 312.413 3.503 20 10 DHCDMO C[N@H+](Cc1cc(Br)ccc1O)Cc1ccccc1F ZINC000768171248 1022913340 /nfs/dbraw/zinc/91/33/40/1022913340.db2.gz ACIPCCHIQFBUDQ-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(OC)c(F)c2)c1O ZINC000768199359 1022913492 /nfs/dbraw/zinc/91/34/92/1022913492.db2.gz HJKIQHSGQZQNIE-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2nc(C)ccc2O)cc1 ZINC000768208166 1022916442 /nfs/dbraw/zinc/91/64/42/1022916442.db2.gz OIWKNBYNQLOTSK-UHFFFAOYSA-N 1 1 313.445 3.574 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)CCOc2cccc(C)c2)c1O ZINC000768211725 1022923580 /nfs/dbraw/zinc/92/35/80/1022923580.db2.gz CWEWHJUEJNZRKH-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC(C)[NH+]1CCN(Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768241199 1022924677 /nfs/dbraw/zinc/92/46/77/1022924677.db2.gz MTKDJVJVZLJLCR-UHFFFAOYSA-N 1 1 310.441 3.585 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3ccccc3)C1)CCCC2 ZINC000768442684 1022968449 /nfs/dbraw/zinc/96/84/49/1022968449.db2.gz YWIUOSLRTQGDOK-OAQYLSRUSA-N 1 1 323.436 3.845 20 10 DHCDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768447386 1022969014 /nfs/dbraw/zinc/96/90/14/1022969014.db2.gz OSGNHUGWNUXBRO-DZGCQCFKSA-N 1 1 307.434 3.810 20 10 DHCDMO CCCOC1CC[NH+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237935965 1023005342 /nfs/dbraw/zinc/00/53/42/1023005342.db2.gz HNOVJXYFQDHPFK-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000768913750 1023056455 /nfs/dbraw/zinc/05/64/55/1023056455.db2.gz RTRCGMKGXNNYLI-FUHIMQAGSA-N 1 1 315.505 3.590 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCCO1 ZINC000769030126 1023071621 /nfs/dbraw/zinc/07/16/21/1023071621.db2.gz PRPNISDYBNWLPP-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)CCc2ccccc2F)c1O ZINC000769030512 1023072068 /nfs/dbraw/zinc/07/20/68/1023072068.db2.gz SIZPAYHNRYQUPF-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccccc1 ZINC000278833735 1023079177 /nfs/dbraw/zinc/07/91/77/1023079177.db2.gz JBKLQKOBXQWFPJ-CQSZACIVSA-N 1 1 316.357 3.550 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(OC)c(C)c2)c1 ZINC000769233798 1023102719 /nfs/dbraw/zinc/10/27/19/1023102719.db2.gz PYMUMNKTCVIDHI-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769326412 1023122627 /nfs/dbraw/zinc/12/26/27/1023122627.db2.gz LWORMTMEONCFKU-MRXNPFEDSA-N 1 1 312.457 3.824 20 10 DHCDMO CCC[N@H+](Cc1ccc(OCC)cc1O)C[C@@H]1CCCCO1 ZINC000769339471 1023128954 /nfs/dbraw/zinc/12/89/54/1023128954.db2.gz PYJWEKFRVSUBMT-KRWDZBQOSA-N 1 1 307.434 3.572 20 10 DHCDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769422613 1023144859 /nfs/dbraw/zinc/14/48/59/1023144859.db2.gz KQXLFZXMNIINJD-GOSISDBHSA-N 1 1 304.478 3.781 20 10 DHCDMO Oc1ccc(Br)cc1C[N@@H+]1CCc2ccsc2C1 ZINC000769427675 1023147029 /nfs/dbraw/zinc/14/70/29/1023147029.db2.gz UEQDDSHLBNUUKE-UHFFFAOYSA-N 1 1 324.243 3.775 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCc2ccsc2C1 ZINC000769427675 1023147033 /nfs/dbraw/zinc/14/70/33/1023147033.db2.gz UEQDDSHLBNUUKE-UHFFFAOYSA-N 1 1 324.243 3.775 20 10 DHCDMO CCC1(CC)CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000769398152 1023149957 /nfs/dbraw/zinc/14/99/57/1023149957.db2.gz GYBOJYLVFVDMNF-UHFFFAOYSA-N 1 1 320.452 3.674 20 10 DHCDMO CC[N@H+](Cc1c(O)cccc1Cl)C[C@H](O)c1ccc(C)cc1 ZINC000769484886 1023151771 /nfs/dbraw/zinc/15/17/71/1023151771.db2.gz WLLVTESUIZMCRD-SFHVURJKSA-N 1 1 319.832 3.910 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000769451942 1023155493 /nfs/dbraw/zinc/15/54/93/1023155493.db2.gz QFMVOBIJBPERQY-LJQANCHMSA-N 1 1 310.441 3.801 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000769451941 1023155857 /nfs/dbraw/zinc/15/58/57/1023155857.db2.gz QFMVOBIJBPERQY-IBGZPJMESA-N 1 1 310.441 3.801 20 10 DHCDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769458665 1023159216 /nfs/dbraw/zinc/15/92/16/1023159216.db2.gz XUIUVWYAPOJOBG-SFHVURJKSA-N 1 1 302.462 3.678 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCN(CC)[C@H](C)C2)cc1 ZINC000769470651 1023161761 /nfs/dbraw/zinc/16/17/61/1023161761.db2.gz NEBXSSDZPTXTAB-YLJYHZDGSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCN(CC)[C@H](C)C2)cc1 ZINC000769470651 1023161762 /nfs/dbraw/zinc/16/17/62/1023161762.db2.gz NEBXSSDZPTXTAB-YLJYHZDGSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC2CCOCC2)cc1F ZINC000769468135 1023161812 /nfs/dbraw/zinc/16/18/12/1023161812.db2.gz AQRPDDYYFJPFHA-UHFFFAOYSA-N 1 1 322.468 3.920 20 10 DHCDMO CCC[N@@H+](Cc1cc(C)ccc1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000769471640 1023163373 /nfs/dbraw/zinc/16/33/73/1023163373.db2.gz WXBWJRMFSIDTEK-JQHSSLGASA-N 1 1 303.446 3.726 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2CC(=O)c2ccccc2)cc1 ZINC000769491791 1023164902 /nfs/dbraw/zinc/16/49/02/1023164902.db2.gz CHGSIOHDDPOLBZ-FQEVSTJZSA-N 1 1 322.452 3.990 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC000769527029 1023173929 /nfs/dbraw/zinc/17/39/29/1023173929.db2.gz AAMQJFKBGDPCCP-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC000769527029 1023173936 /nfs/dbraw/zinc/17/39/36/1023173936.db2.gz AAMQJFKBGDPCCP-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCC[N@@H+](Cc1ccc2nccnc2c1)Cc1ccccc1O ZINC000876654469 1033115370 /nfs/dbraw/zinc/11/53/70/1033115370.db2.gz GUUCDYQXUPLWGU-UHFFFAOYSA-N 1 1 307.397 3.748 20 10 DHCDMO Cc1cccc(O)c1C[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000876726232 1033129175 /nfs/dbraw/zinc/12/91/75/1033129175.db2.gz WNDMYXFGAXCBNR-UHFFFAOYSA-N 1 1 321.424 3.577 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000876726232 1033129178 /nfs/dbraw/zinc/12/91/78/1033129178.db2.gz WNDMYXFGAXCBNR-UHFFFAOYSA-N 1 1 321.424 3.577 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1c(C)cccc1O)CCC2 ZINC000876730974 1033129350 /nfs/dbraw/zinc/12/93/50/1033129350.db2.gz CMGKVQWECTXZOO-OAHLLOKOSA-N 1 1 302.443 3.975 20 10 DHCDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876738824 1033130338 /nfs/dbraw/zinc/13/03/38/1033130338.db2.gz BMDQEADJAMSODI-FQEVSTJZSA-N 1 1 316.489 3.658 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(-c3ccccc3)n[nH]2)cc1 ZINC000771934070 1023489882 /nfs/dbraw/zinc/48/98/82/1023489882.db2.gz VBQZYQKUJPWWLP-UHFFFAOYSA-N 1 1 320.440 3.775 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c(O)c1 ZINC000876778661 1033141010 /nfs/dbraw/zinc/14/10/10/1033141010.db2.gz LKAANDZDTMGVCG-CXAGYDPISA-N 1 1 303.427 3.724 20 10 DHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876790858 1033144222 /nfs/dbraw/zinc/14/42/22/1033144222.db2.gz DHXPSMXPNCYOOP-MRXNPFEDSA-N 1 1 304.478 3.516 20 10 DHCDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000785793944 1023619484 /nfs/dbraw/zinc/61/94/84/1023619484.db2.gz IUINQKHPBNDSBL-IBGZPJMESA-N 1 1 312.457 3.526 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)c(O)c1 ZINC000785988318 1023648515 /nfs/dbraw/zinc/64/85/15/1023648515.db2.gz KWCJHERXZZUZOQ-UHFFFAOYSA-N 1 1 319.445 3.715 20 10 DHCDMO CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788606866 1023912948 /nfs/dbraw/zinc/91/29/48/1023912948.db2.gz AYKWASSFEOYNLP-QJPTWQEYSA-N 1 1 319.367 3.859 20 10 DHCDMO CC[C@H](O)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788663537 1023921349 /nfs/dbraw/zinc/92/13/49/1023921349.db2.gz GJQULQJHYXEBPN-MNOVXSKESA-N 1 1 305.340 3.613 20 10 DHCDMO CC[C@H]([NH2+]CCc1cccc(OC)c1)c1ccc(F)cc1O ZINC000796693005 1024015330 /nfs/dbraw/zinc/01/53/30/1024015330.db2.gz COIVBWQQWHITHF-KRWDZBQOSA-N 1 1 303.377 3.823 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)CCCOC3)cc1C(C)C ZINC000789544552 1024111244 /nfs/dbraw/zinc/11/12/44/1024111244.db2.gz HGHUOFXFSFYHFQ-IBGZPJMESA-N 1 1 303.446 3.827 20 10 DHCDMO COc1ccc([C@@H]([NH2+]Cc2cc(F)cc(F)c2O)C2CC2)cc1 ZINC000882881338 1024155902 /nfs/dbraw/zinc/15/59/02/1024155902.db2.gz IXWMFBYYQVELQP-KRWDZBQOSA-N 1 1 319.351 3.920 20 10 DHCDMO CCn1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)cn1 ZINC000278864830 1024178886 /nfs/dbraw/zinc/17/88/86/1024178886.db2.gz WOCHZPTXSQMORQ-VIFPVBQESA-N 1 1 314.216 3.766 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC000883088820 1024236754 /nfs/dbraw/zinc/23/67/54/1024236754.db2.gz RBCCIJJWYJYHNV-RDJZCZTQSA-N 1 1 319.351 3.680 20 10 DHCDMO CC(C)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1ccccc1 ZINC000883106562 1024241486 /nfs/dbraw/zinc/24/14/86/1024241486.db2.gz XFAQRFVEGAWSQV-SJLPKXTDSA-N 1 1 321.367 3.518 20 10 DHCDMO COCC[N@@H+](Cc1c(O)ccc2ccncc21)[C@H]1CC[C@@H](C)C1 ZINC000790476865 1024308159 /nfs/dbraw/zinc/30/81/59/1024308159.db2.gz FDVWZHALFPJFEF-ZBFHGGJFSA-N 1 1 314.429 3.577 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000883288404 1024352776 /nfs/dbraw/zinc/35/27/76/1024352776.db2.gz DAOOYTNZEPZGNB-SFHVURJKSA-N 1 1 323.484 3.598 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000790946447 1024402330 /nfs/dbraw/zinc/40/23/30/1024402330.db2.gz BNXRLRFMFYRPII-LLVKDONJSA-N 1 1 321.779 3.526 20 10 DHCDMO C[C@H](COc1ccccc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790962274 1024406795 /nfs/dbraw/zinc/40/67/95/1024406795.db2.gz KGRWYOIISPUFOB-LLVKDONJSA-N 1 1 309.768 3.742 20 10 DHCDMO CCC[N@@H+](Cc1cc(Br)cc(OC)c1O)C1CC1 ZINC000133227739 1024587128 /nfs/dbraw/zinc/58/71/28/1024587128.db2.gz JNYOUMHUKQMZNC-UHFFFAOYSA-N 1 1 314.223 3.538 20 10 DHCDMO COc1cc(C[N@H+]2CCSC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000792722368 1024783456 /nfs/dbraw/zinc/78/34/56/1024783456.db2.gz LMLCFCBMOPHHNJ-CYBMUJFWSA-N 1 1 323.502 3.883 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccn2)c(C(F)(F)F)c1 ZINC000793075956 1024878272 /nfs/dbraw/zinc/87/82/72/1024878272.db2.gz IEKGJPRXIYLJJP-UHFFFAOYSA-N 1 1 323.362 3.798 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000793231291 1024944890 /nfs/dbraw/zinc/94/48/90/1024944890.db2.gz MBJZJWZEFUKNNL-JQWIXIFHSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](C(C)(C)C)C2)cc1OC ZINC000793369736 1025007476 /nfs/dbraw/zinc/00/74/76/1025007476.db2.gz LCVGJENQDSMYPH-AWEZNQCLSA-N 1 1 307.434 3.668 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000793370740 1025009778 /nfs/dbraw/zinc/00/97/78/1025009778.db2.gz QXDUGPVTISIXGP-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000793370740 1025009795 /nfs/dbraw/zinc/00/97/95/1025009795.db2.gz QXDUGPVTISIXGP-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO C[C@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1ccc(N(C)C)cc1 ZINC000793566408 1025104542 /nfs/dbraw/zinc/10/45/42/1025104542.db2.gz FNJGRZAHPMDADP-AWEZNQCLSA-N 1 1 308.429 3.522 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)[C@H]1c1cccnc1 ZINC000793566314 1025106637 /nfs/dbraw/zinc/10/66/37/1025106637.db2.gz AEHPSQMKGNATOH-IBGZPJMESA-N 1 1 319.408 3.919 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000793745831 1025163482 /nfs/dbraw/zinc/16/34/82/1025163482.db2.gz TZRUDCMJCDJQBJ-QGZVFWFLSA-N 1 1 311.425 3.794 20 10 DHCDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135460216 1025235314 /nfs/dbraw/zinc/23/53/14/1025235314.db2.gz AFMYCJASUNZTIT-ZDUSSCGKSA-N 1 1 313.850 3.576 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1Cl ZINC000825949539 1033276684 /nfs/dbraw/zinc/27/66/84/1033276684.db2.gz WSVPFVLDYMQIAW-IRXDYDNUSA-N 1 1 321.848 3.888 20 10 DHCDMO CC[N@H+](Cc1nc(C(C)C)c[nH]1)Cc1ccc(N(C)C)cc1 ZINC000893870919 1025584627 /nfs/dbraw/zinc/58/46/27/1025584627.db2.gz FPDYVLHKQYUWSU-UHFFFAOYSA-N 1 1 300.450 3.621 20 10 DHCDMO CC[N@@H+](Cc1nc(C(C)C)c[nH]1)Cc1ccc(N(C)C)cc1 ZINC000893870919 1025584635 /nfs/dbraw/zinc/58/46/35/1025584635.db2.gz FPDYVLHKQYUWSU-UHFFFAOYSA-N 1 1 300.450 3.621 20 10 DHCDMO CC(C)CCOC1CC[NH+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893965691 1025630678 /nfs/dbraw/zinc/63/06/78/1025630678.db2.gz ACWBNTVHSZHAFE-UHFFFAOYSA-N 1 1 313.388 3.698 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1c(O)cccc1F ZINC000886489435 1025649664 /nfs/dbraw/zinc/64/96/64/1025649664.db2.gz ISLKTVMXJYBGNQ-DZGCQCFKSA-N 1 1 318.392 3.612 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1c(O)cccc1F ZINC000886491702 1025649751 /nfs/dbraw/zinc/64/97/51/1025649751.db2.gz MXFMUWGUPOOBCU-JTQLQIEISA-N 1 1 311.303 3.984 20 10 DHCDMO C[C@H]([NH2+]CCCn1cnc2ccccc21)c1c(O)cccc1F ZINC000886493253 1025650233 /nfs/dbraw/zinc/65/02/33/1025650233.db2.gz BNPHGPFYBTXCET-ZDUSSCGKSA-N 1 1 313.376 3.622 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1c(O)cccc1F ZINC000886491703 1025650491 /nfs/dbraw/zinc/65/04/91/1025650491.db2.gz MXFMUWGUPOOBCU-SNVBAGLBSA-N 1 1 311.303 3.984 20 10 DHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886496726 1025654718 /nfs/dbraw/zinc/65/47/18/1025654718.db2.gz FQJDXDCCYRXEGP-VXGBXAGGSA-N 1 1 316.376 3.902 20 10 DHCDMO CCOc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccc1OC ZINC000886528555 1025680855 /nfs/dbraw/zinc/68/08/55/1025680855.db2.gz NYWILQIURCYZFX-GFCCVEGCSA-N 1 1 319.376 3.789 20 10 DHCDMO COCC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(C)o1 ZINC000886586071 1025722828 /nfs/dbraw/zinc/72/28/28/1025722828.db2.gz KKAOEMKZIXVPEL-TZMCWYRMSA-N 1 1 307.365 3.861 20 10 DHCDMO CCN(CC)c1ccc(CNC2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000236914141 1025727023 /nfs/dbraw/zinc/72/70/23/1025727023.db2.gz VQFIYLJBJVZVJM-UHFFFAOYSA-N 1 1 317.521 3.932 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610957 1025736075 /nfs/dbraw/zinc/73/60/75/1025736075.db2.gz OKTNFDGXOXBQJR-IAQYHMDHSA-N 1 1 323.795 3.959 20 10 DHCDMO C[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1c(O)cccc1F ZINC000886609476 1025736602 /nfs/dbraw/zinc/73/66/02/1025736602.db2.gz UUXRFDGJADQZBU-ZDUSSCGKSA-N 1 1 300.377 3.699 20 10 DHCDMO COC[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1cccc(OC)c1 ZINC000886636777 1025751496 /nfs/dbraw/zinc/75/14/96/1025751496.db2.gz UYPXBYJMKZEFFO-MLGOLLRUSA-N 1 1 319.376 3.578 20 10 DHCDMO COc1ccc([C@@H]([NH2+][C@H](C)c2c(O)cccc2F)C2CC2)cn1 ZINC000886644971 1025758375 /nfs/dbraw/zinc/75/83/75/1025758375.db2.gz OYLSYFJXMPBVOQ-ZMZPIMSZSA-N 1 1 316.376 3.737 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886776840 1025896593 /nfs/dbraw/zinc/89/65/93/1025896593.db2.gz QXRPSHNRZFCNFO-CXAGYDPISA-N 1 1 307.409 3.921 20 10 DHCDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000093838693 1026127565 /nfs/dbraw/zinc/12/75/65/1026127565.db2.gz XFPRQQOTOXARRL-SFHVURJKSA-N 1 1 302.462 3.535 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnccc1Cl ZINC001137239377 1026130897 /nfs/dbraw/zinc/13/08/97/1026130897.db2.gz SKQDHJPZVGRHDC-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cnccc1Cl ZINC001137239377 1026130903 /nfs/dbraw/zinc/13/09/03/1026130903.db2.gz SKQDHJPZVGRHDC-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](N3CCCC3)[C@@H]2C)cc1C(C)C ZINC000808191515 1026225566 /nfs/dbraw/zinc/22/55/66/1026225566.db2.gz MSIJMAXQWMIBTI-LPHOPBHVSA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](N3CCCC3)[C@@H]2C)cc1C(C)C ZINC000808191515 1026225574 /nfs/dbraw/zinc/22/55/74/1026225574.db2.gz MSIJMAXQWMIBTI-LPHOPBHVSA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCC2(F)CCC2)c1 ZINC000808426644 1026273687 /nfs/dbraw/zinc/27/36/87/1026273687.db2.gz GPHZQAJODCINCY-UHFFFAOYSA-N 1 1 316.214 3.835 20 10 DHCDMO COc1ccc(CNc2ccc3c(c2)[nH+]cn3C)c(C)c1OC ZINC000808397743 1026277853 /nfs/dbraw/zinc/27/78/53/1026277853.db2.gz IYPHJOVLALZXPV-UHFFFAOYSA-N 1 1 311.385 3.511 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1ccc(F)cc1O ZINC000808722098 1026368614 /nfs/dbraw/zinc/36/86/14/1026368614.db2.gz YVYUTAWGRZSKFZ-ULFGMLNVSA-N 1 1 303.377 3.694 20 10 DHCDMO Cc1cccc(C[N@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)c1O ZINC000809774734 1026607818 /nfs/dbraw/zinc/60/78/18/1026607818.db2.gz YHFSPKGQVIWSNS-IRXDYDNUSA-N 1 1 313.441 3.687 20 10 DHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000809788050 1026625490 /nfs/dbraw/zinc/62/54/90/1026625490.db2.gz MGQXAAIUEHBWFB-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000809787249 1026626324 /nfs/dbraw/zinc/62/63/24/1026626324.db2.gz XDYUBWQDITVFEN-LBPRGKRZSA-N 1 1 310.235 3.777 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c1 ZINC000809789817 1026627476 /nfs/dbraw/zinc/62/74/76/1026627476.db2.gz ICHIDKZXZPQINK-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CCc1nnc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000810260565 1026721243 /nfs/dbraw/zinc/72/12/43/1026721243.db2.gz MCIOPVBIRGKVOA-SECBINFHSA-N 1 1 311.838 3.619 20 10 DHCDMO COCC1(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CCCCC1 ZINC000810261444 1026722466 /nfs/dbraw/zinc/72/24/66/1026722466.db2.gz VWKXERTUUSZQLV-LBPRGKRZSA-N 1 1 313.388 3.918 20 10 DHCDMO COc1cccc(C2(C[NH2+][C@H](C)c3ccc(F)cc3O)CC2)c1 ZINC000810242407 1026727510 /nfs/dbraw/zinc/72/75/10/1026727510.db2.gz QMYMAZLSZSGRQY-CYBMUJFWSA-N 1 1 315.388 3.922 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nccn2CC)cc1 ZINC000295363577 1027228989 /nfs/dbraw/zinc/22/89/89/1027228989.db2.gz ZRFJGTRJUDSELR-OAHLLOKOSA-N 1 1 300.450 3.600 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000812780905 1027405235 /nfs/dbraw/zinc/40/52/35/1027405235.db2.gz BEVURRSOTVRTNW-KGLIPLIRSA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1ccc(F)cc1C[NH+]1CCN(c2ccccc2Cl)CC1 ZINC000778989177 1027725692 /nfs/dbraw/zinc/72/56/92/1027725692.db2.gz STYUJLTUPDYKBN-UHFFFAOYSA-N 1 1 320.795 3.507 20 10 DHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(F)ccc1O ZINC000778995335 1027733967 /nfs/dbraw/zinc/73/39/67/1027733967.db2.gz VEPRHCUSSACJRE-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000778996862 1027740451 /nfs/dbraw/zinc/74/04/51/1027740451.db2.gz ZFBYPVATOMPULT-UHFFFAOYSA-N 1 1 307.315 3.974 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000778996862 1027740463 /nfs/dbraw/zinc/74/04/63/1027740463.db2.gz ZFBYPVATOMPULT-UHFFFAOYSA-N 1 1 307.315 3.974 20 10 DHCDMO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc(F)ccc1O)CC3 ZINC000779000464 1027742900 /nfs/dbraw/zinc/74/29/00/1027742900.db2.gz WZMSVWOWDVQWDK-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1cc(F)ccc1O)CC3 ZINC000779000464 1027742917 /nfs/dbraw/zinc/74/29/17/1027742917.db2.gz WZMSVWOWDVQWDK-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000779001283 1027752015 /nfs/dbraw/zinc/75/20/15/1027752015.db2.gz DZVRXESVPUHIBI-AZUAARDMSA-N 1 1 311.425 3.992 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)CC(C)(C)C)cc2)CC1 ZINC000297006023 1027779276 /nfs/dbraw/zinc/77/92/76/1027779276.db2.gz GDDOFBNXAGYPCG-UHFFFAOYSA-N 1 1 304.478 3.780 20 10 DHCDMO C[C@H]1C[C@H](C[N@@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000779015113 1027817541 /nfs/dbraw/zinc/81/75/41/1027817541.db2.gz MYYBRUAYDAYNPL-JKSUJKDBSA-N 1 1 303.446 3.952 20 10 DHCDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)c1 ZINC000779021167 1027870265 /nfs/dbraw/zinc/87/02/65/1027870265.db2.gz XOGQEJHXKJPFHC-GOSISDBHSA-N 1 1 314.404 3.934 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000779028829 1027927131 /nfs/dbraw/zinc/92/71/31/1027927131.db2.gz BOPODFDJZWZPJX-CQSZACIVSA-N 1 1 321.779 3.838 20 10 DHCDMO COc1c(O)c(C[N@H+](C)C2CCC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000774904080 1027950670 /nfs/dbraw/zinc/95/06/70/1027950670.db2.gz BRLLAMZLVJGVJL-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)C2CCC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000774904080 1027950692 /nfs/dbraw/zinc/95/06/92/1027950692.db2.gz BRLLAMZLVJGVJL-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO Cc1cc(C[N@H+](C[C@H](C)O)C2CCCCC2)ccc1N(C)C ZINC000815035012 1028338112 /nfs/dbraw/zinc/33/81/12/1028338112.db2.gz HBIHIAFDMOXUBF-INIZCTEOSA-N 1 1 304.478 3.577 20 10 DHCDMO Cc1cc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)ccc1N(C)C ZINC000815058540 1028344820 /nfs/dbraw/zinc/34/48/20/1028344820.db2.gz HWZGVMMUFFDYBH-OAQYLSRUSA-N 1 1 324.468 3.543 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccccc1O ZINC000368484442 1028361158 /nfs/dbraw/zinc/36/11/58/1028361158.db2.gz YIPIBUJRXOEHSA-VPWXQRGCSA-N 1 1 310.441 3.736 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H]1CCOC(C)(C)C1 ZINC000815120409 1028366316 /nfs/dbraw/zinc/36/63/16/1028366316.db2.gz RYGVEXZRRUJYFE-KRWDZBQOSA-N 1 1 304.478 3.841 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCSC1)c1cccc(C(F)(F)F)c1O ZINC000815586102 1028556153 /nfs/dbraw/zinc/55/61/53/1028556153.db2.gz ZITPMQBDOVNKHL-NXEZZACHSA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@H](C[C@H]1CCOC1)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815588349 1028559925 /nfs/dbraw/zinc/55/99/25/1028559925.db2.gz LHPQLDADUMAQOS-IJLUTSLNSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815597238 1028562479 /nfs/dbraw/zinc/56/24/79/1028562479.db2.gz QNQCWAGCODKERD-MNOVXSKESA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@H]([NH2+]Cc1ncccc1F)c1cccc(C(F)(F)F)c1O ZINC000815598216 1028562342 /nfs/dbraw/zinc/56/23/42/1028562342.db2.gz PEAYEFHXFYLCSU-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)[C@@H]1CCCOC1 ZINC000815614211 1028569739 /nfs/dbraw/zinc/56/97/39/1028569739.db2.gz JHABICMMLIQEEI-GRYCIOLGSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000815621942 1028575187 /nfs/dbraw/zinc/57/51/87/1028575187.db2.gz HPGINCOJASJSDM-ZYHUDNBSSA-N 1 1 317.351 3.613 20 10 DHCDMO COCC(C)(C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628916 1028580090 /nfs/dbraw/zinc/58/00/90/1028580090.db2.gz NYIMCDNRAQEJTF-SNVBAGLBSA-N 1 1 305.340 3.734 20 10 DHCDMO C[C@H]([NH2+]CCOC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000815606853 1028582025 /nfs/dbraw/zinc/58/20/25/1028582025.db2.gz ISSBJPGUDRNXHA-JTQLQIEISA-N 1 1 303.324 3.631 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@H]2c2cc(C)on2)c(O)c1 ZINC000371395609 1028702974 /nfs/dbraw/zinc/70/29/74/1028702974.db2.gz IDOBFNSCYITCTG-KRWDZBQOSA-N 1 1 316.401 3.815 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H]2c2cc(C)on2)c(O)c1 ZINC000371395609 1028702989 /nfs/dbraw/zinc/70/29/89/1028702989.db2.gz IDOBFNSCYITCTG-KRWDZBQOSA-N 1 1 316.401 3.815 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@H](O)[C@H](C)C2)cc1 ZINC000190051608 1028745456 /nfs/dbraw/zinc/74/54/56/1028745456.db2.gz XGPZJTXLFIADGR-APWZRJJASA-N 1 1 304.478 3.516 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@@H](C)Cc1ccsc1 ZINC000190259134 1028863763 /nfs/dbraw/zinc/86/37/63/1028863763.db2.gz QOURYKIPHYAFPU-ZDUSSCGKSA-N 1 1 305.443 3.915 20 10 DHCDMO CCc1nocc1C[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000816482804 1028893116 /nfs/dbraw/zinc/89/31/16/1028893116.db2.gz UFXIAIIIPMXSHK-UHFFFAOYSA-N 1 1 301.434 3.715 20 10 DHCDMO CCc1nocc1C[N@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000816482804 1028893137 /nfs/dbraw/zinc/89/31/37/1028893137.db2.gz UFXIAIIIPMXSHK-UHFFFAOYSA-N 1 1 301.434 3.715 20 10 DHCDMO CC(C)[N@H+](Cc1ccccn1)Cc1cc(Cl)c(F)cc1O ZINC000816493756 1028896290 /nfs/dbraw/zinc/89/62/90/1028896290.db2.gz MLCDCBRJHMCNIC-UHFFFAOYSA-N 1 1 308.784 3.990 20 10 DHCDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cc(Cl)c(F)cc1O ZINC000816493756 1028896303 /nfs/dbraw/zinc/89/63/03/1028896303.db2.gz MLCDCBRJHMCNIC-UHFFFAOYSA-N 1 1 308.784 3.990 20 10 DHCDMO CC(C)OC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816495281 1028896879 /nfs/dbraw/zinc/89/68/79/1028896879.db2.gz RDDNSYGYZIWFLO-UHFFFAOYSA-N 1 1 301.789 3.574 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000816515450 1028915985 /nfs/dbraw/zinc/91/59/85/1028915985.db2.gz ZTQOMHACQNDKAS-MRXNPFEDSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000816515450 1028915995 /nfs/dbraw/zinc/91/59/95/1028915995.db2.gz ZTQOMHACQNDKAS-MRXNPFEDSA-N 1 1 313.800 3.577 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000816536270 1028924346 /nfs/dbraw/zinc/92/43/46/1028924346.db2.gz QFYXXFNQGCCETE-VIFPVBQESA-N 1 1 324.739 3.944 20 10 DHCDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816560199 1028946151 /nfs/dbraw/zinc/94/61/51/1028946151.db2.gz HTVNEGBTOQTUND-SNVBAGLBSA-N 1 1 308.784 3.993 20 10 DHCDMO COCC[C@H]1CCCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816570708 1028947329 /nfs/dbraw/zinc/94/73/29/1028947329.db2.gz FHBHNUAGPDDFJA-GFCCVEGCSA-N 1 1 315.816 3.823 20 10 DHCDMO COCC[C@H]1CCCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816570708 1028947341 /nfs/dbraw/zinc/94/73/41/1028947341.db2.gz FHBHNUAGPDDFJA-GFCCVEGCSA-N 1 1 315.816 3.823 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](OC(F)F)C2)ccc2ccccc21 ZINC000816566154 1028949173 /nfs/dbraw/zinc/94/91/73/1028949173.db2.gz MLGDJQMMGQRORZ-CQSZACIVSA-N 1 1 307.340 3.749 20 10 DHCDMO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816574148 1028951543 /nfs/dbraw/zinc/95/15/43/1028951543.db2.gz YORPMDPGPMNIPZ-GDBMZVCRSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000816599387 1028955275 /nfs/dbraw/zinc/95/52/75/1028955275.db2.gz KXSIPQUQDGFAPY-NSHDSACASA-N 1 1 306.768 3.569 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000816599387 1028955291 /nfs/dbraw/zinc/95/52/91/1028955291.db2.gz KXSIPQUQDGFAPY-NSHDSACASA-N 1 1 306.768 3.569 20 10 DHCDMO C[C@@H]1[C@@H](N2CCCC2)CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816610048 1028959231 /nfs/dbraw/zinc/95/92/31/1028959231.db2.gz WKUOGVJKJDFBCF-BEFAXECRSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1ccc2ccccc2c1O ZINC000816610048 1028959247 /nfs/dbraw/zinc/95/92/47/1028959247.db2.gz WKUOGVJKJDFBCF-BEFAXECRSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816610049 1028960345 /nfs/dbraw/zinc/96/03/45/1028960345.db2.gz WKUOGVJKJDFBCF-DNVCBOLYSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1Cc1ccc2ccccc2c1O ZINC000816610049 1028960348 /nfs/dbraw/zinc/96/03/48/1028960348.db2.gz WKUOGVJKJDFBCF-DNVCBOLYSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609280 1028961308 /nfs/dbraw/zinc/96/13/08/1028961308.db2.gz WOYHXTDNBSGJMR-AAEUAGOBSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609280 1028961322 /nfs/dbraw/zinc/96/13/22/1028961322.db2.gz WOYHXTDNBSGJMR-AAEUAGOBSA-N 1 1 315.816 3.700 20 10 DHCDMO CCc1ccc([C@@H](O)C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816607679 1028961855 /nfs/dbraw/zinc/96/18/55/1028961855.db2.gz BPZYHYIIUQLIOC-KRWDZBQOSA-N 1 1 323.795 3.570 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)cc1 ZINC000816665984 1028986159 /nfs/dbraw/zinc/98/61/59/1028986159.db2.gz BJSYJKAGHNZZTH-UXHICEINSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000817934794 1029279765 /nfs/dbraw/zinc/27/97/65/1029279765.db2.gz PGJKFTNIYQMKRX-RVHYNSKXSA-N 1 1 323.484 3.726 20 10 DHCDMO Cc1cccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000817941095 1029282351 /nfs/dbraw/zinc/28/23/51/1029282351.db2.gz IUXTZEBIDQFUDN-JXFKEZNVSA-N 1 1 311.473 3.720 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2nccs2)c1 ZINC000374303981 1029282953 /nfs/dbraw/zinc/28/29/53/1029282953.db2.gz XZEULGWQTPEHRI-AWEZNQCLSA-N 1 1 304.415 3.585 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2nccs2)c1 ZINC000374303981 1029282966 /nfs/dbraw/zinc/28/29/66/1029282966.db2.gz XZEULGWQTPEHRI-AWEZNQCLSA-N 1 1 304.415 3.585 20 10 DHCDMO Cc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817938049 1029284500 /nfs/dbraw/zinc/28/45/00/1029284500.db2.gz CKTWTVSTCDOSLU-JXFKEZNVSA-N 1 1 311.473 3.720 20 10 DHCDMO CC(C)C[C@@H](C[NH3+])N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960486 1029299478 /nfs/dbraw/zinc/29/94/78/1029299478.db2.gz ZQMUFGBUBNACAH-WMZOPIPTSA-N 1 1 303.494 3.701 20 10 DHCDMO CCCC[C@@H](C[NH3+])[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817962055 1029299503 /nfs/dbraw/zinc/29/95/03/1029299503.db2.gz HIZZKBWPERLZPA-MNOVXSKESA-N 1 1 304.356 3.579 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1[O-] ZINC000817975966 1029312940 /nfs/dbraw/zinc/31/29/40/1029312940.db2.gz RZMNDPRKTPWAIZ-IHRRRGAJSA-N 1 1 310.869 3.770 20 10 DHCDMO CC[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817984667 1029320008 /nfs/dbraw/zinc/32/00/08/1029320008.db2.gz XDSWRKHTUSTGFF-CQSZACIVSA-N 1 1 316.367 3.594 20 10 DHCDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2O)c(F)cc1OC ZINC000529525596 1029371734 /nfs/dbraw/zinc/37/17/34/1029371734.db2.gz XVGYTVGXULJADL-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO c1cc([C@@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)n[nH]1 ZINC000121180444 1029539703 /nfs/dbraw/zinc/53/97/03/1029539703.db2.gz JMLHLIJVFCBPST-GOSISDBHSA-N 1 1 324.472 3.780 20 10 DHCDMO c1cc([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)[nH]n1 ZINC000121180444 1029539710 /nfs/dbraw/zinc/53/97/10/1029539710.db2.gz JMLHLIJVFCBPST-GOSISDBHSA-N 1 1 324.472 3.780 20 10 DHCDMO c1cc([C@@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)[nH]n1 ZINC000121180444 1029539717 /nfs/dbraw/zinc/53/97/17/1029539717.db2.gz JMLHLIJVFCBPST-GOSISDBHSA-N 1 1 324.472 3.780 20 10 DHCDMO CC1(C)Cc2n[nH]cc2C[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000828013851 1029711167 /nfs/dbraw/zinc/71/11/67/1029711167.db2.gz MHBLMFXSASOJLW-UHFFFAOYSA-N 1 1 321.424 3.853 20 10 DHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cs1 ZINC000772854918 1029889567 /nfs/dbraw/zinc/88/95/67/1029889567.db2.gz DEDVCXMKIYRQHK-GFCCVEGCSA-N 1 1 301.459 3.685 20 10 DHCDMO CCOc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c(O)c1 ZINC000865822621 1030039877 /nfs/dbraw/zinc/03/98/77/1030039877.db2.gz MLDZLIRRLQPKIR-INIZCTEOSA-N 1 1 307.340 3.730 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822530385 1030043535 /nfs/dbraw/zinc/04/35/35/1030043535.db2.gz ZMVQXOABDSBUQP-QGZVFWFLSA-N 1 1 321.848 3.827 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000822529554 1030043755 /nfs/dbraw/zinc/04/37/55/1030043755.db2.gz FOJNUTTXTWFFFO-KRWDZBQOSA-N 1 1 321.848 3.827 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CCCOCC2)cc1 ZINC000823414534 1030270270 /nfs/dbraw/zinc/27/02/70/1030270270.db2.gz UTOVWFPCVQGIQG-UHFFFAOYSA-N 1 1 316.470 3.607 20 10 DHCDMO C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(Cl)ccc1[O-] ZINC000866516497 1030342727 /nfs/dbraw/zinc/34/27/27/1030342727.db2.gz ARYIJEWNABUHFY-RFSCMCKOSA-N 1 1 310.869 3.959 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)Cc2cccs2)cc1)[C@@H](C)CO ZINC000824438893 1030552819 /nfs/dbraw/zinc/55/28/19/1030552819.db2.gz CBUNNXLUQJJXPH-HNNXBMFYSA-N 1 1 318.486 3.587 20 10 DHCDMO Oc1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@@H](F)C1 ZINC000824571651 1030585245 /nfs/dbraw/zinc/58/52/45/1030585245.db2.gz OYFOGSJZKMOJNR-MRXNPFEDSA-N 1 1 301.361 3.515 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc(OC2CC2)c1F ZINC000824594123 1030591634 /nfs/dbraw/zinc/59/16/34/1030591634.db2.gz ZRPNDRDGQVOZSY-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO [O-]c1c(Br)cccc1C[N@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000824941765 1030677784 /nfs/dbraw/zinc/67/77/84/1030677784.db2.gz QLTDLKKPQKNMQP-ZFWWWQNUSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000824941765 1030677793 /nfs/dbraw/zinc/67/77/93/1030677793.db2.gz QLTDLKKPQKNMQP-ZFWWWQNUSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000824941765 1030677802 /nfs/dbraw/zinc/67/78/02/1030677802.db2.gz QLTDLKKPQKNMQP-ZFWWWQNUSA-N 1 1 322.246 3.775 20 10 DHCDMO COc1cccc(CNc2ccc([NH+]3CCCC3)cc2C)c1O ZINC000237432171 1030925671 /nfs/dbraw/zinc/92/56/71/1030925671.db2.gz YSCRCIHFQTUGAW-UHFFFAOYSA-N 1 1 312.413 3.922 20 10 DHCDMO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(F)c1F ZINC001143916668 1031081909 /nfs/dbraw/zinc/08/19/09/1031081909.db2.gz RUXCUIOLUGENLG-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(F)c1F ZINC001143916668 1031081923 /nfs/dbraw/zinc/08/19/23/1031081923.db2.gz RUXCUIOLUGENLG-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2cc3c(cc2O)CCC3)C(C)C)cn1 ZINC000844738057 1031321554 /nfs/dbraw/zinc/32/15/54/1031321554.db2.gz KNANMUSMMVZATC-UHFFFAOYSA-N 1 1 313.445 3.508 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccc(F)cc1O ZINC000844927368 1031403649 /nfs/dbraw/zinc/40/36/49/1031403649.db2.gz ZKJDLJLVOKJCFJ-BBRMVZONSA-N 1 1 314.404 3.999 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001144509536 1031665193 /nfs/dbraw/zinc/66/51/93/1031665193.db2.gz XUOZNVJBMGIFON-HNNXBMFYSA-N 1 1 319.788 3.794 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2ccc3cncn3c2)cc1C ZINC000873130553 1031719306 /nfs/dbraw/zinc/71/93/06/1031719306.db2.gz HQHPQTGJPABGNO-UHFFFAOYSA-N 1 1 309.413 3.721 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1snnc1C ZINC000930350965 1031788595 /nfs/dbraw/zinc/78/85/95/1031788595.db2.gz KWDIHLKHYDYDNY-CYBMUJFWSA-N 1 1 305.447 3.915 20 10 DHCDMO CC(C)O[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000846012848 1031804293 /nfs/dbraw/zinc/80/42/93/1031804293.db2.gz BHVJZSJGFXFQLI-LBPRGKRZSA-N 1 1 301.789 3.574 20 10 DHCDMO CC(C)O[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000846012848 1031804301 /nfs/dbraw/zinc/80/43/01/1031804301.db2.gz BHVJZSJGFXFQLI-LBPRGKRZSA-N 1 1 301.789 3.574 20 10 DHCDMO CC(C)O[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000846013482 1031807933 /nfs/dbraw/zinc/80/79/33/1031807933.db2.gz BTNZAPMHRFJBSU-LLVKDONJSA-N 1 1 301.789 3.574 20 10 DHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000846013482 1031807949 /nfs/dbraw/zinc/80/79/49/1031807949.db2.gz BTNZAPMHRFJBSU-LLVKDONJSA-N 1 1 301.789 3.574 20 10 DHCDMO C[C@]1(CC[NH2+]Cc2cc(Cl)c(F)cc2O)C[C@@]1(F)Cl ZINC000846029275 1031821908 /nfs/dbraw/zinc/82/19/08/1031821908.db2.gz IJQODVQTIGZFTH-STQMWFEESA-N 1 1 310.171 3.979 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846103877 1031877170 /nfs/dbraw/zinc/87/71/70/1031877170.db2.gz AXXLRZHTWLXMFY-ZDUSSCGKSA-N 1 1 305.727 3.806 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846103877 1031877179 /nfs/dbraw/zinc/87/71/79/1031877179.db2.gz AXXLRZHTWLXMFY-ZDUSSCGKSA-N 1 1 305.727 3.806 20 10 DHCDMO CCc1cccc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)c1 ZINC000846210122 1031910801 /nfs/dbraw/zinc/91/08/01/1031910801.db2.gz XQKJFHBRVHFQRX-CYBMUJFWSA-N 1 1 313.397 3.592 20 10 DHCDMO CCc1cccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c1O ZINC000877809694 1033459143 /nfs/dbraw/zinc/45/91/43/1033459143.db2.gz GUKCJQUVPLDFFN-UHFFFAOYSA-N 1 1 314.429 3.747 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCC3(CCOCC3)CC2)cc1 ZINC001173052528 1033516475 /nfs/dbraw/zinc/51/64/75/1033516475.db2.gz ZLTIABFANVIKFL-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1O ZINC000126953468 1033610607 /nfs/dbraw/zinc/61/06/07/1033610607.db2.gz UKDKBFHZKSETRQ-OAHLLOKOSA-N 1 1 315.388 3.605 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1F ZINC000862347588 1033823941 /nfs/dbraw/zinc/82/39/41/1033823941.db2.gz HODHXHAOXCJMER-SNVBAGLBSA-N 1 1 322.321 3.805 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1F ZINC000862347588 1033823957 /nfs/dbraw/zinc/82/39/57/1033823957.db2.gz HODHXHAOXCJMER-SNVBAGLBSA-N 1 1 322.321 3.805 20 10 DHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3O)C2)cc1 ZINC000862541642 1033882776 /nfs/dbraw/zinc/88/27/76/1033882776.db2.gz YVXVBSUJXBMAMU-ZDUSSCGKSA-N 1 1 303.789 3.741 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1nnc(-c2cccs2)o1 ZINC000879652383 1034074411 /nfs/dbraw/zinc/07/44/11/1034074411.db2.gz ZSYMABIJUHPJDO-WDEREUQCSA-N 1 1 315.398 3.916 20 10 DHCDMO CC[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000178255383 1034224140 /nfs/dbraw/zinc/22/41/40/1034224140.db2.gz LFABQGZRVXZXMM-FQEVSTJZSA-N 1 1 315.505 3.668 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000179557776 1034313365 /nfs/dbraw/zinc/31/33/65/1034313365.db2.gz WSEUYFSTFRJQAO-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)cc1OC ZINC000179630802 1034321405 /nfs/dbraw/zinc/32/14/05/1034321405.db2.gz HZIZEGKTNGDJSU-LBPRGKRZSA-N 1 1 319.376 3.742 20 10 DHCDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183730424 1034415729 /nfs/dbraw/zinc/41/57/29/1034415729.db2.gz MZCXMNVSRAMLET-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2ccccn2)c1O ZINC000184715948 1034495894 /nfs/dbraw/zinc/49/58/94/1034495894.db2.gz CEIBSMWSWAIJKM-LLVKDONJSA-N 1 1 306.793 3.642 20 10 DHCDMO Cc1csc(CCCC[NH2+][C@@H](C)c2ccc(F)cc2O)n1 ZINC000185318795 1034540684 /nfs/dbraw/zinc/54/06/84/1034540684.db2.gz QDXFHBZBNUIQHW-LBPRGKRZSA-N 1 1 308.422 3.970 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2[O-])c1 ZINC000185352369 1034542489 /nfs/dbraw/zinc/54/24/89/1034542489.db2.gz XJQLPNCVUYJQIN-CQSZACIVSA-N 1 1 316.420 3.834 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccc(F)cc1O ZINC000186009313 1034592727 /nfs/dbraw/zinc/59/27/27/1034592727.db2.gz MJMSFZAGUZCGQG-MEBBXXQBSA-N 1 1 305.324 3.845 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)cc1 ZINC000777438652 1034742695 /nfs/dbraw/zinc/74/26/95/1034742695.db2.gz ACMXXJNQJDKFGS-HXUWFJFHSA-N 1 1 316.489 3.924 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)CCO)c1cc(Cl)c(Cl)cc1O ZINC000192916870 1034822775 /nfs/dbraw/zinc/82/27/75/1034822775.db2.gz QECZZKZKFDOTSK-VIFPVBQESA-N 1 1 306.233 3.758 20 10 DHCDMO Cc1cc(O)c(CNC[C@H](C)[N@@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC001177278135 1035362618 /nfs/dbraw/zinc/36/26/18/1035362618.db2.gz RZUAPJAGRCYLCF-KGLIPLIRSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(O)c(CNC[C@H](C)[N@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC001177278135 1035362621 /nfs/dbraw/zinc/36/26/21/1035362621.db2.gz RZUAPJAGRCYLCF-KGLIPLIRSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)C(C)(C)C)c1 ZINC001179060733 1035462240 /nfs/dbraw/zinc/46/22/40/1035462240.db2.gz YPMOGPJTKRAYOP-SNVBAGLBSA-N 1 1 300.240 3.987 20 10 DHCDMO CCCOc1ccc(CN[C@H](C)C[NH+]2CCC(C)CC2)cc1C ZINC001179148648 1035467242 /nfs/dbraw/zinc/46/72/42/1035467242.db2.gz QHHZPYQQOQRDAV-GOSISDBHSA-N 1 1 318.505 3.994 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](CCO)Cc1cc(Cl)c(F)cc1O ZINC001180001788 1035557106 /nfs/dbraw/zinc/55/71/06/1035557106.db2.gz DDXHREVQXIHBOF-LBPRGKRZSA-N 1 1 323.795 3.740 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](CCO)Cc1cc(Cl)c(F)cc1O ZINC001180001788 1035557119 /nfs/dbraw/zinc/55/71/19/1035557119.db2.gz DDXHREVQXIHBOF-LBPRGKRZSA-N 1 1 323.795 3.740 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccnn2C)cc1C(C)C ZINC000905739812 1035635005 /nfs/dbraw/zinc/63/50/05/1035635005.db2.gz JBFNPXLEXKFGRF-GOSISDBHSA-N 1 1 313.445 3.895 20 10 DHCDMO Oc1ccc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001204278878 1035742853 /nfs/dbraw/zinc/74/28/53/1035742853.db2.gz LMJOHLNKWCYUEA-ZDUSSCGKSA-N 1 1 303.789 3.741 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCSC3(CCOCC3)C2)c1 ZINC001181007298 1035807497 /nfs/dbraw/zinc/80/74/97/1035807497.db2.gz FWUDETHAOQYPRG-UHFFFAOYSA-N 1 1 321.486 3.614 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC001181525779 1035934483 /nfs/dbraw/zinc/93/44/83/1035934483.db2.gz OUHDYXOQJKJFNA-GJZGRUSLSA-N 1 1 323.864 3.993 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC001181525775 1035936609 /nfs/dbraw/zinc/93/66/09/1035936609.db2.gz OUHDYXOQJKJFNA-CABCVRRESA-N 1 1 323.864 3.993 20 10 DHCDMO C[N@@H+](CCOc1ccccc1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775632871 1036122136 /nfs/dbraw/zinc/12/21/36/1036122136.db2.gz CATJVBGVQFKXHT-UHFFFAOYSA-N 1 1 309.768 3.696 20 10 DHCDMO C[C@H]([NH2+]CCN1CCCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774113031 1036171808 /nfs/dbraw/zinc/17/18/08/1036171808.db2.gz ADTNISZIHZDMMW-NSHDSACASA-N 1 1 317.260 3.836 20 10 DHCDMO Cn1cccc1[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775644517 1036182435 /nfs/dbraw/zinc/18/24/35/1036182435.db2.gz MTZYLWHVHCPRSG-HNNXBMFYSA-N 1 1 308.784 3.860 20 10 DHCDMO C[C@H]([NH2+]CC[C@H](C)[S@](C)=O)c1cc(Cl)c(Cl)cc1O ZINC000774259054 1036263810 /nfs/dbraw/zinc/26/38/10/1036263810.db2.gz WGPDWBMSDVBHTI-OWXODZSWSA-N 1 1 324.273 3.507 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[C@H](O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774264278 1036267696 /nfs/dbraw/zinc/26/76/96/1036267696.db2.gz AJCAGISTPHTEGQ-OPRDCNLKSA-N 1 1 304.217 3.653 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1O ZINC000775660256 1036268335 /nfs/dbraw/zinc/26/83/35/1036268335.db2.gz DPIKMEXOUKALJM-IBGZPJMESA-N 1 1 311.425 3.882 20 10 DHCDMO COCC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)CC(C)C ZINC000914783633 1036332101 /nfs/dbraw/zinc/33/21/01/1036332101.db2.gz FLXVVAJCRPLNJL-UHFFFAOYSA-N 1 1 317.429 3.658 20 10 DHCDMO COc1ccc(F)c(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC001183000945 1036500418 /nfs/dbraw/zinc/50/04/18/1036500418.db2.gz QQYWDMYUSKTVLJ-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO CCc1cccc(CN2CCC(C)([NH+]3CCCCC3)CC2)c1O ZINC001183687177 1036649603 /nfs/dbraw/zinc/64/96/03/1036649603.db2.gz UKWOQZNWNVZKAM-UHFFFAOYSA-N 1 1 316.489 3.795 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC001183885174 1036697156 /nfs/dbraw/zinc/69/71/56/1036697156.db2.gz FVBNMCSSEAESLK-NSHDSACASA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC001183885174 1036697163 /nfs/dbraw/zinc/69/71/63/1036697163.db2.gz FVBNMCSSEAESLK-NSHDSACASA-N 1 1 324.396 3.582 20 10 DHCDMO COc1ccc(N(CCn2cc[nH+]c2C)Cc2ccccc2)cc1 ZINC000762381821 1036727733 /nfs/dbraw/zinc/72/77/33/1036727733.db2.gz OCXGJWIVBRRYAR-UHFFFAOYSA-N 1 1 321.424 3.907 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001184106517 1036743003 /nfs/dbraw/zinc/74/30/03/1036743003.db2.gz RVGJHFBZUVVILC-HNNXBMFYSA-N 1 1 303.352 3.708 20 10 DHCDMO CCc1nc(N(C)Cc2ccc(N3CCCCC3)cc2)cc(C)[nH+]1 ZINC001184672896 1036915644 /nfs/dbraw/zinc/91/56/44/1036915644.db2.gz FPQNPLLXPYZAAV-UHFFFAOYSA-N 1 1 324.472 3.974 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCCn2ccnc2C)cc1 ZINC000762918856 1037069111 /nfs/dbraw/zinc/06/91/11/1037069111.db2.gz PNIMPLGFVSTGLI-UHFFFAOYSA-N 1 1 314.477 3.560 20 10 DHCDMO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2c(F)cccc2F)c1O ZINC000774864357 1037130762 /nfs/dbraw/zinc/13/07/62/1037130762.db2.gz DNCOOEAQHPZRAK-VIFPVBQESA-N 1 1 323.314 3.863 20 10 DHCDMO CCCCC[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911609 1037206274 /nfs/dbraw/zinc/20/62/74/1037206274.db2.gz ICAMMDXQMCOIMM-AWEZNQCLSA-N 1 1 322.405 3.854 20 10 DHCDMO CCCCC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911609 1037206290 /nfs/dbraw/zinc/20/62/90/1037206290.db2.gz ICAMMDXQMCOIMM-AWEZNQCLSA-N 1 1 322.405 3.854 20 10 DHCDMO COc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)nc1 ZINC000775981427 1037272216 /nfs/dbraw/zinc/27/22/16/1037272216.db2.gz ABNKAJVITCOKBS-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)nc1 ZINC000775981427 1037272235 /nfs/dbraw/zinc/27/22/35/1037272235.db2.gz ABNKAJVITCOKBS-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCOC1 ZINC000776001794 1037295254 /nfs/dbraw/zinc/29/52/54/1037295254.db2.gz BOJIDLZYHNUEFP-DLBZAZTESA-N 1 1 311.425 3.992 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000776012126 1037306506 /nfs/dbraw/zinc/30/65/06/1037306506.db2.gz CZCFQLNVGUGONW-RISCZKNCSA-N 1 1 317.351 3.954 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776015639 1037309137 /nfs/dbraw/zinc/30/91/37/1037309137.db2.gz WCKRZJFGNVTTQT-AAEUAGOBSA-N 1 1 317.351 3.954 20 10 DHCDMO CCCC1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000774977691 1037322927 /nfs/dbraw/zinc/32/29/27/1037322927.db2.gz VZDYBRRFBFWECN-UHFFFAOYSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000784680138 1037559580 /nfs/dbraw/zinc/55/95/80/1037559580.db2.gz PETWILVSUGQTIQ-UHFFFAOYSA-N 1 1 317.816 3.655 20 10 DHCDMO [O-]c1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775137810 1037691043 /nfs/dbraw/zinc/69/10/43/1037691043.db2.gz QJKUZVRGZYIFNM-QMMMGPOBSA-N 1 1 311.706 3.959 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2cc(C)ccc2F)c1 ZINC000775166817 1037901289 /nfs/dbraw/zinc/90/12/89/1037901289.db2.gz ALRUCGMIQGWFKB-UHFFFAOYSA-N 1 1 303.377 3.870 20 10 DHCDMO CCC[C@]1(CO)CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775175333 1037916189 /nfs/dbraw/zinc/91/61/89/1037916189.db2.gz HIXWLHXEJBLYBW-HXUWFJFHSA-N 1 1 316.489 3.804 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2cn3ccccc3n2)C2CC2)cc1 ZINC000917073853 1038161172 /nfs/dbraw/zinc/16/11/72/1038161172.db2.gz DMJIWBNTSKVUKI-UHFFFAOYSA-N 1 1 320.440 3.565 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cn3ccccc3n2)C2CC2)cc1 ZINC000917073853 1038161178 /nfs/dbraw/zinc/16/11/78/1038161178.db2.gz DMJIWBNTSKVUKI-UHFFFAOYSA-N 1 1 320.440 3.565 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC(C)(C)O1 ZINC001190436925 1038314450 /nfs/dbraw/zinc/31/44/50/1038314450.db2.gz OLALPACYQFBINT-SFHVURJKSA-N 1 1 304.478 3.921 20 10 DHCDMO COC[C@@H](C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)C(C)C ZINC001190437280 1038318105 /nfs/dbraw/zinc/31/81/05/1038318105.db2.gz WKYGWTIOVJWOQC-GOSISDBHSA-N 1 1 306.494 3.882 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1O ZINC000775522713 1038632513 /nfs/dbraw/zinc/63/25/13/1038632513.db2.gz YMVCSTBJLBIRHV-KBPBESRZSA-N 1 1 305.809 3.887 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1cc[nH]n1)Cc1ccccc1O ZINC001192302433 1038632530 /nfs/dbraw/zinc/63/25/30/1038632530.db2.gz JTIFFAGELGIHQO-OAHLLOKOSA-N 1 1 307.397 3.879 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1cc[nH]n1)Cc1ccccc1O ZINC001192302433 1038632533 /nfs/dbraw/zinc/63/25/33/1038632533.db2.gz JTIFFAGELGIHQO-OAHLLOKOSA-N 1 1 307.397 3.879 20 10 DHCDMO C[N@@H+](Cc1sccc1Br)Cc1ccccc1O ZINC000171926644 1039669836 /nfs/dbraw/zinc/66/98/36/1039669836.db2.gz YZYGFMMQKYXDDA-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[N@H+](Cc1sccc1Br)Cc1ccccc1O ZINC000171926644 1039669830 /nfs/dbraw/zinc/66/98/30/1039669830.db2.gz YZYGFMMQKYXDDA-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2cc(Cl)cc(OC)c2O)c1 ZINC000761185805 1040507273 /nfs/dbraw/zinc/50/72/73/1040507273.db2.gz YLVJLWWIAYXCMM-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)CCc2ccccc2F)c1O ZINC000761192506 1040555917 /nfs/dbraw/zinc/55/59/17/1040555917.db2.gz PGSJSVNFXGFXQI-UHFFFAOYSA-N 1 1 323.795 3.868 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H]2Cc2ccccc2)c1O ZINC000761203925 1040577083 /nfs/dbraw/zinc/57/70/83/1040577083.db2.gz ZMHGWUAKQYWEQJ-INIZCTEOSA-N 1 1 317.816 3.871 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)c(O)c1)Cc1ccccc1O ZINC000092704991 185334008 /nfs/dbraw/zinc/33/40/08/185334008.db2.gz WENVEFJNMSRJFV-UHFFFAOYSA-N 1 1 301.386 3.519 20 10 DHCDMO CCC[N@@H+](Cc1c[nH]nc1-c1cccnc1)Cc1ccccc1O ZINC000092705040 185334420 /nfs/dbraw/zinc/33/44/20/185334420.db2.gz ZEUARNVKKPGMHJ-UHFFFAOYSA-N 1 1 322.412 3.590 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc2ccccc2c1O ZINC000273515528 130130756 /nfs/dbraw/zinc/13/07/56/130130756.db2.gz SNAOSQWFAQVIJL-SJKOYZFVSA-N 1 1 307.397 3.997 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc2ccccc2c1O ZINC000273515518 130131322 /nfs/dbraw/zinc/13/13/22/130131322.db2.gz SNAOSQWFAQVIJL-SJCJKPOMSA-N 1 1 307.397 3.997 20 10 DHCDMO COc1cccc(C2([NH2+][C@@H](C)c3ccc(F)cc3O)CC2)c1 ZINC000273520484 130132377 /nfs/dbraw/zinc/13/23/77/130132377.db2.gz UBWGJZRHYINNJS-LBPRGKRZSA-N 1 1 301.361 3.880 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1O ZINC000284215479 131059770 /nfs/dbraw/zinc/05/97/70/131059770.db2.gz CMJOHGZAILRORR-GXTWGEPZSA-N 1 1 300.229 3.716 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286128833 131220802 /nfs/dbraw/zinc/22/08/02/131220802.db2.gz OKXFKLQFQPKVJD-QAPCUYQASA-N 1 1 317.404 3.738 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(F)cc1O ZINC000286161797 131223052 /nfs/dbraw/zinc/22/30/52/131223052.db2.gz PWINEUGLLFKJBT-YVEFUNNKSA-N 1 1 303.377 3.826 20 10 DHCDMO CC[C@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287669186 131292974 /nfs/dbraw/zinc/29/29/74/131292974.db2.gz MBROUDQEGQEXOE-HNNXBMFYSA-N 1 1 307.825 3.682 20 10 DHCDMO C[C@H](CCCO)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296603848 335145028 /nfs/dbraw/zinc/14/50/28/335145028.db2.gz VUBRYISNAHBVKN-NXEZZACHSA-N 1 1 306.233 3.758 20 10 DHCDMO COc1ccc(N2CCC(Nc3[nH]c4ccccc4[nH+]3)CC2)cc1 ZINC000301881662 336335970 /nfs/dbraw/zinc/33/59/70/336335970.db2.gz MHHMGWDXFRIIOA-UHFFFAOYSA-N 1 1 322.412 3.652 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCc2cnc(C(C)C)nc2C1 ZINC000375343947 337008559 /nfs/dbraw/zinc/00/85/59/337008559.db2.gz ZYODFCFYINNICQ-KRWDZBQOSA-N 1 1 311.429 3.815 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1 ZINC000375531018 337012894 /nfs/dbraw/zinc/01/28/94/337012894.db2.gz YQSVPCQJJPXCPG-ZHALLVOQSA-N 1 1 303.446 3.606 20 10 DHCDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3cc(C)ccc3O)C2)s1 ZINC000378352643 337070833 /nfs/dbraw/zinc/07/08/33/337070833.db2.gz YVVRJXABIIABNT-CQSZACIVSA-N 1 1 302.443 3.845 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000175659896 337146958 /nfs/dbraw/zinc/14/69/58/337146958.db2.gz HIQAHYBMQYIZRH-INIZCTEOSA-N 1 1 323.408 3.515 20 10 DHCDMO C[C@H]([NH2+]Cc1ccccc1-n1ccnc1)c1ccc(F)cc1O ZINC000185125259 337203221 /nfs/dbraw/zinc/20/32/21/337203221.db2.gz HNJNRHOGYVVRHF-ZDUSSCGKSA-N 1 1 311.360 3.568 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000191359080 337296325 /nfs/dbraw/zinc/29/63/25/337296325.db2.gz WKWWMAOQUZUAFS-LLVKDONJSA-N 1 1 313.800 3.766 20 10 DHCDMO C[C@H]([NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000528006227 337782938 /nfs/dbraw/zinc/78/29/38/337782938.db2.gz NRKYHXMRXUQDJI-JVWRJRKNSA-N 1 1 317.351 3.874 20 10 DHCDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(OC)ccc2O)s1 ZINC000180406809 522219113 /nfs/dbraw/zinc/21/91/13/522219113.db2.gz RBNAJKAXNKSWFJ-GFCCVEGCSA-N 1 1 320.458 3.921 20 10 DHCDMO C[C@@H](NC1CC[NH+](C2CCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000160468639 525401042 /nfs/dbraw/zinc/40/10/42/525401042.db2.gz PKNGHFDKMFAYAV-MRXNPFEDSA-N 1 1 315.505 3.810 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cnn(C)c1)Cc1ccccc1O ZINC000176680681 526089072 /nfs/dbraw/zinc/08/90/72/526089072.db2.gz ADRYJHODJZMJSK-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO OCc1ccc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)o1 ZINC000156780235 527632355 /nfs/dbraw/zinc/63/23/55/527632355.db2.gz UPQKLGIYDVWJJM-UHFFFAOYSA-N 1 1 315.413 3.812 20 10 DHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2[O-])C1 ZINC000287753853 534957578 /nfs/dbraw/zinc/95/75/78/534957578.db2.gz QMGBDPASPOCDSI-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1[O-] ZINC000286138802 535804780 /nfs/dbraw/zinc/80/47/80/535804780.db2.gz OUIMVYOLLVCSRO-WMLDXEAASA-N 1 1 308.441 3.692 20 10 DHCDMO CC[C@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(F)cc1O ZINC000286302512 535931263 /nfs/dbraw/zinc/93/12/63/535931263.db2.gz XBKJXJPLSDPZFP-GJZGRUSLSA-N 1 1 307.365 3.943 20 10 DHCDMO COCCc1cc[nH+]c(N[C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000287430608 536832014 /nfs/dbraw/zinc/83/20/14/536832014.db2.gz KMUIOYQKJCZZFL-NSHDSACASA-N 1 1 306.793 3.803 20 10 DHCDMO COCC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccco1 ZINC000293753088 1013111164 /nfs/dbraw/zinc/11/11/64/1013111164.db2.gz YGXLDCYMEOORRM-ZDUSSCGKSA-N 1 1 313.756 3.645 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(C)ccc(C)c2O)c(OC)c1 ZINC001140182311 1013792773 /nfs/dbraw/zinc/79/27/73/1013792773.db2.gz OMPYITSEULAJAG-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)c1O ZINC000834882437 1014937688 /nfs/dbraw/zinc/93/76/88/1014937688.db2.gz KCNJIOUYIMNCSF-VIFPVBQESA-N 1 1 314.216 3.592 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000834906918 1015017257 /nfs/dbraw/zinc/01/72/57/1015017257.db2.gz UFSCMQFFEOULHV-MWODSPESSA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](c3nccs3)C2)cc1Cl ZINC000895580310 1015216306 /nfs/dbraw/zinc/21/63/06/1015216306.db2.gz AEOJMLHLICBGQI-LLVKDONJSA-N 1 1 308.834 3.800 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895652913 1015249753 /nfs/dbraw/zinc/24/97/53/1015249753.db2.gz AILSKPFGZRGFEZ-UHFFFAOYSA-N 1 1 313.800 3.720 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)c1O ZINC000896536931 1015626134 /nfs/dbraw/zinc/62/61/34/1015626134.db2.gz RYHFLHXDVKRJCS-CQSZACIVSA-N 1 1 302.443 3.612 20 10 DHCDMO CCc1nnc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)s1 ZINC000290285921 1015634964 /nfs/dbraw/zinc/63/49/64/1015634964.db2.gz XOSHXKGDEQNVTO-LLVKDONJSA-N 1 1 313.426 3.810 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1 ZINC000896640055 1015694287 /nfs/dbraw/zinc/69/42/87/1015694287.db2.gz FYWLMQZQOAQLBO-LSDHHAIUSA-N 1 1 307.409 3.606 20 10 DHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)[nH]1 ZINC000276847995 1015710725 /nfs/dbraw/zinc/71/07/25/1015710725.db2.gz CUVUMDKSJRKLQV-BFHYXJOUSA-N 1 1 315.465 3.796 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCOC2(C1)CCCCCC2 ZINC001204585214 1016305824 /nfs/dbraw/zinc/30/58/24/1016305824.db2.gz OGIIYWXDOUYQRF-UHFFFAOYSA-N 1 1 316.489 3.986 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccc(F)cc1O ZINC000185405022 1016895676 /nfs/dbraw/zinc/89/56/76/1016895676.db2.gz MXTWEEYFQQJJJQ-QWHCGFSZSA-N 1 1 301.361 3.748 20 10 DHCDMO COc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185574350 1017024945 /nfs/dbraw/zinc/02/49/45/1017024945.db2.gz XEMOTTMPSCEWEI-OLZOCXBDSA-N 1 1 319.376 3.658 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000897071156 1017032504 /nfs/dbraw/zinc/03/25/04/1017032504.db2.gz WVKGJUULHZVAKX-CQSZACIVSA-N 1 1 306.768 3.747 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1 ZINC000295119611 1032282559 /nfs/dbraw/zinc/28/25/59/1032282559.db2.gz XELXIXLXSWVJBM-PWSUYJOCSA-N 1 1 303.324 3.564 20 10 DHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877543183 1033345935 /nfs/dbraw/zinc/34/59/35/1033345935.db2.gz ZQIUXUKFDJDBKQ-MRXNPFEDSA-N 1 1 304.478 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2snnc2C)cc1 ZINC000929185479 1032472593 /nfs/dbraw/zinc/47/25/93/1032472593.db2.gz SOHNWWJANYQTRN-CQSZACIVSA-N 1 1 318.490 3.886 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)c2snnc2C)cc1 ZINC000929185479 1032472600 /nfs/dbraw/zinc/47/26/00/1032472600.db2.gz SOHNWWJANYQTRN-CQSZACIVSA-N 1 1 318.490 3.886 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CC[C@@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926904405 1032659574 /nfs/dbraw/zinc/65/95/74/1032659574.db2.gz HKGWJGNZXUIRRF-PXWWUCIGSA-N 1 1 321.314 3.682 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](C[C@H]3CCOC3)C1)CCC2 ZINC000773260617 1032664285 /nfs/dbraw/zinc/66/42/85/1032664285.db2.gz YLSXOGYRNSIUGQ-JKSUJKDBSA-N 1 1 315.457 3.520 20 10 DHCDMO Cc1cc(O)c(CNC2CC(C)(C)[NH2+]C(C)(C)C2)c(Cl)c1 ZINC000840875347 1017245266 /nfs/dbraw/zinc/24/52/66/1017245266.db2.gz DEVWQTGQXUHPFE-UHFFFAOYSA-N 1 1 310.869 3.753 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n[nH]1 ZINC000186131242 1017872786 /nfs/dbraw/zinc/87/27/86/1017872786.db2.gz XZFFJDCSJUVHCI-JSGCOSHPSA-N 1 1 313.445 3.584 20 10 DHCDMO C[C@H]([NH2+]CCOCC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278154349 1018226276 /nfs/dbraw/zinc/22/62/76/1018226276.db2.gz AJAKKNBVVWMDFQ-ZETCQYMHSA-N 1 1 314.159 3.631 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(F)cc1O ZINC000278160895 1018237696 /nfs/dbraw/zinc/23/76/96/1018237696.db2.gz AKSFWSLHXPFOMX-GFCCVEGCSA-N 1 1 300.377 3.656 20 10 DHCDMO COc1ccc2c(c1)CCC[N@H+](Cc1cc(C)c(C)cc1O)C2 ZINC000728563025 1018364913 /nfs/dbraw/zinc/36/49/13/1018364913.db2.gz GKHYWDSGTMTOIR-UHFFFAOYSA-N 1 1 311.425 3.966 20 10 DHCDMO C[C@H]([NH2+]Cc1ccoc1)c1ccc(N2CCOCC2)cc1Cl ZINC000765279104 1018742974 /nfs/dbraw/zinc/74/29/74/1018742974.db2.gz FNAITEVLFZIUIH-ZDUSSCGKSA-N 1 1 320.820 3.620 20 10 DHCDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000765303380 1018749196 /nfs/dbraw/zinc/74/91/96/1018749196.db2.gz ZZTICWCCMSQGKH-BRWVUGGUSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000765303380 1018749207 /nfs/dbraw/zinc/74/92/07/1018749207.db2.gz ZZTICWCCMSQGKH-BRWVUGGUSA-N 1 1 303.494 3.524 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CCc3ccc(O)cc32)cc1F ZINC000858193500 1032796700 /nfs/dbraw/zinc/79/67/00/1032796700.db2.gz WSEHMJZBFJOWJV-KRWDZBQOSA-N 1 1 318.367 3.514 20 10 DHCDMO COc1cc(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825773972 1032810202 /nfs/dbraw/zinc/81/02/02/1032810202.db2.gz SAMWFIXAMVOXDW-HIFRSBDPSA-N 1 1 321.461 3.698 20 10 DHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000170789003 1019435259 /nfs/dbraw/zinc/43/52/59/1019435259.db2.gz TYOIBBYRTJRTMZ-NEPJUHHUSA-N 1 1 316.376 3.902 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)[C@H]2C=CCCCCC2)cc1 ZINC001171730174 1032848780 /nfs/dbraw/zinc/84/87/80/1032848780.db2.gz RTEFKHQZHMZVBA-KRWDZBQOSA-N 1 1 302.462 3.952 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1O ZINC000187593074 1019756481 /nfs/dbraw/zinc/75/64/81/1019756481.db2.gz OGPHEZLAUMRMSU-GFCCVEGCSA-N 1 1 319.351 3.669 20 10 DHCDMO FC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1 ZINC000922319145 1019995197 /nfs/dbraw/zinc/99/51/97/1019995197.db2.gz YWNUUAHTECZYED-QGZVFWFLSA-N 1 1 303.352 3.951 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001203556513 1020097463 /nfs/dbraw/zinc/09/74/63/1020097463.db2.gz RGLXYRDXKJNSBX-INIZCTEOSA-N 1 1 303.402 3.821 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@@H](C)O1 ZINC000732184677 1020209996 /nfs/dbraw/zinc/20/99/96/1020209996.db2.gz CVYLSJNXLGARSK-ZBFHGGJFSA-N 1 1 305.462 3.997 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000733029696 1020316742 /nfs/dbraw/zinc/31/67/42/1020316742.db2.gz KFCOWNCJQJUOCR-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000922877535 1020321066 /nfs/dbraw/zinc/32/10/66/1020321066.db2.gz NSTAYECGJRAQQH-CYBMUJFWSA-N 1 1 306.768 3.747 20 10 DHCDMO CCn1ccnc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000733197845 1020344286 /nfs/dbraw/zinc/34/42/86/1020344286.db2.gz CQTVXZDUOHKEKP-UHFFFAOYSA-N 1 1 313.445 3.944 20 10 DHCDMO CC[C@@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccc(F)cc1O ZINC000903323804 1020372148 /nfs/dbraw/zinc/37/21/48/1020372148.db2.gz LISATYHRSUSMGF-NSWWBONSSA-N 1 1 307.409 3.920 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000179583587 1020412773 /nfs/dbraw/zinc/41/27/73/1020412773.db2.gz PUFATYFXCJPSOF-CQSZACIVSA-N 1 1 303.789 3.699 20 10 DHCDMO C[C@H]1SCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)[C@H]1C ZINC000735668497 1020760370 /nfs/dbraw/zinc/76/03/70/1020760370.db2.gz JYLSQRJRDGTEAS-NWDGAFQWSA-N 1 1 309.475 3.721 20 10 DHCDMO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)C[C@@H]1CCCO1 ZINC000738062438 1020862942 /nfs/dbraw/zinc/86/29/42/1020862942.db2.gz YTGUCGJDGLAIKU-AWEZNQCLSA-N 1 1 311.381 3.902 20 10 DHCDMO CN(C)[C@H]1CCC[N@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738144611 1020862965 /nfs/dbraw/zinc/86/29/65/1020862965.db2.gz QTYZIILOZKQQSJ-HNNXBMFYSA-N 1 1 324.424 3.818 20 10 DHCDMO CN(C)[C@H]1CCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738144611 1020862968 /nfs/dbraw/zinc/86/29/68/1020862968.db2.gz QTYZIILOZKQQSJ-HNNXBMFYSA-N 1 1 324.424 3.818 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CO[C@H](C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000858547051 1032940406 /nfs/dbraw/zinc/94/04/06/1032940406.db2.gz HYDXSNQTFNUPEY-KPCOEVGBSA-N 1 1 316.228 3.917 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000741753274 1021049301 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Cc1cc(O)c(C[N@H+]2CCC3(C2)CCOCC3)cc1C(C)C ZINC000743405160 1021286941 /nfs/dbraw/zinc/28/69/41/1021286941.db2.gz GVFCTTWMVNLYPI-UHFFFAOYSA-N 1 1 303.446 3.827 20 10 DHCDMO CCC[N@@H+](CCc1ccc2c(c1)CCO2)Cc1ccccc1O ZINC000743870197 1021395984 /nfs/dbraw/zinc/39/59/84/1021395984.db2.gz KVSCCTWIFUTTHN-UHFFFAOYSA-N 1 1 311.425 3.782 20 10 DHCDMO Cc1c[nH]c(C[NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)n1 ZINC000850096795 1021418685 /nfs/dbraw/zinc/41/86/85/1021418685.db2.gz XBQQWJKVIPDILG-UHFFFAOYSA-N 1 1 312.461 3.777 20 10 DHCDMO C[C@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Cl)c(Cl)cc1O ZINC000850482614 1021556118 /nfs/dbraw/zinc/55/61/18/1021556118.db2.gz QCXPYNRKCOJFSP-DTWKUNHWSA-N 1 1 304.217 3.917 20 10 DHCDMO CCO[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850513370 1021571429 /nfs/dbraw/zinc/57/14/29/1021571429.db2.gz GVVQQUAUZRGYIN-GMTAPVOTSA-N 1 1 303.324 3.629 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1O ZINC000850523702 1021576818 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COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(OC)ccc2O)c1 ZINC000179657630 1022072159 /nfs/dbraw/zinc/07/21/59/1022072159.db2.gz NTOXLVNGHYYNRG-SFHVURJKSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]CCCN2CCC(C)CC2)c(O)c1C ZINC000756361930 1022078116 /nfs/dbraw/zinc/07/81/16/1022078116.db2.gz LTJIAROVEAAFRZ-QGZVFWFLSA-N 1 1 304.478 3.782 20 10 DHCDMO C[N@@H+](CCCc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000071124004 1022078880 /nfs/dbraw/zinc/07/88/80/1022078880.db2.gz DJRFVKANIZJIDO-UHFFFAOYSA-N 1 1 324.468 3.588 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000763621240 1022159176 /nfs/dbraw/zinc/15/91/76/1022159176.db2.gz JRKYIMQUAADANE-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1cccc(CNc2cc(C(F)(F)F)cc(C)[nH+]2)c1O ZINC000853259060 1022246457 /nfs/dbraw/zinc/24/64/57/1022246457.db2.gz NTWCBIXHKXMMGQ-UHFFFAOYSA-N 1 1 312.291 3.735 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)c1ccccc1 ZINC000111232828 1022253678 /nfs/dbraw/zinc/25/36/78/1022253678.db2.gz SVPDNIRZAUHWHU-FQEVSTJZSA-N 1 1 323.392 3.721 20 10 DHCDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2O)CCN1Cc1ccccc1 ZINC000179573347 1022467907 /nfs/dbraw/zinc/46/79/07/1022467907.db2.gz BUTSHQBQXOJHAN-YLJYHZDGSA-N 1 1 324.468 3.877 20 10 DHCDMO Oc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cc1 ZINC000179569291 1022468634 /nfs/dbraw/zinc/46/86/34/1022468634.db2.gz HKHBXIXBHOWMGS-UHFFFAOYSA-N 1 1 309.365 3.893 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccc(F)cc1O ZINC000185405038 1022483905 /nfs/dbraw/zinc/48/39/05/1022483905.db2.gz MXTWEEYFQQJJJQ-CHWSQXEVSA-N 1 1 301.361 3.748 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1O ZINC000179608405 1022485648 /nfs/dbraw/zinc/48/56/48/1022485648.db2.gz LHAGKPOKTULZIH-INIZCTEOSA-N 1 1 317.454 3.943 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](CCn1cccn1)Cc1ccccc1O ZINC000179645093 1022495721 /nfs/dbraw/zinc/49/57/21/1022495721.db2.gz NRVTVKOAIDETPT-QGZVFWFLSA-N 1 1 321.424 3.852 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC001169753951 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DHCDMO Cc1cc([C@@H]2C[N@@H+](Cc3cc(F)ccc3O)CCO2)ccc1F ZINC000180194491 1022659007 /nfs/dbraw/zinc/65/90/07/1022659007.db2.gz RDQQFFMVZOCGLI-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO CCC1(CC)C[N@@H+](Cc2cc(C)cc(OC)c2O)CCS1 ZINC000767479673 1022728591 /nfs/dbraw/zinc/72/85/91/1022728591.db2.gz OOKBCODBOPPSJH-UHFFFAOYSA-N 1 1 309.475 3.817 20 10 DHCDMO CC[N@@H+](Cc1cnc2c(C)cccn12)Cc1ccc(N(C)C)cc1 ZINC000768133997 1022901436 /nfs/dbraw/zinc/90/14/36/1022901436.db2.gz NRTGZKFCEYLXAM-UHFFFAOYSA-N 1 1 322.456 3.731 20 10 DHCDMO CC[N@@H+](Cc1nn(C)c2ccccc12)Cc1ccc(N(C)C)cc1 ZINC000768132524 1022901676 /nfs/dbraw/zinc/90/16/76/1022901676.db2.gz GOLCTRQXFNAJTN-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO COc1cccc(C[N@@H+](C)CCOc2ccc(Cl)cc2)c1O ZINC000768175383 1022913808 /nfs/dbraw/zinc/91/38/08/1022913808.db2.gz ORDBHPWKLAHIPW-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO COc1ccc(OCC[N@@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC000768197360 1022924512 /nfs/dbraw/zinc/92/45/12/1022924512.db2.gz 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1022946466 /nfs/dbraw/zinc/94/64/66/1022946466.db2.gz ZOWPWGBJQVFIJB-SECBINFHSA-N 1 1 311.303 3.669 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000768329877 1022947704 /nfs/dbraw/zinc/94/77/04/1022947704.db2.gz IWNQEQFFOVTZPP-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C)[C@@H]3CCCC[C@H]32)cc1OC ZINC000768439441 1022967520 /nfs/dbraw/zinc/96/75/20/1022967520.db2.gz LZPULRBAHVYRPB-CWRNSKLLSA-N 1 1 319.445 3.810 20 10 DHCDMO COc1cc(C[N@@H+](C)CCc2ccccc2F)c(O)cc1C ZINC000768447871 1022968686 /nfs/dbraw/zinc/96/86/86/1022968686.db2.gz QNUHQYDDBQUCAL-UHFFFAOYSA-N 1 1 303.377 3.523 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](CC(C)C)C2)cc1OC ZINC000768464436 1022972108 /nfs/dbraw/zinc/97/21/08/1022972108.db2.gz RDYSTIKPFFMMIT-AWEZNQCLSA-N 1 1 307.434 3.668 20 10 DHCDMO COc1cc(O)c(C[N@@H+](CC(C)C)CC(C)(C)C)cc1OC ZINC000768463320 1022972243 /nfs/dbraw/zinc/97/22/43/1022972243.db2.gz RNUWITUNJJBVHQ-UHFFFAOYSA-N 1 1 309.450 3.914 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1CC=C(C(F)(F)F)CC1)CCCC2 ZINC000768466005 1022972937 /nfs/dbraw/zinc/97/29/37/1022972937.db2.gz VEMZSLJGTDDBEU-UHFFFAOYSA-N 1 1 311.347 3.965 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@@H]2CC(C)C)cc1OC ZINC000768462999 1022973446 /nfs/dbraw/zinc/97/34/46/1022973446.db2.gz DLGAKIBIBQXEPI-OAHLLOKOSA-N 1 1 307.434 3.810 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@]3(CCCOC3)C1)CCCC2 ZINC000768463370 1022973855 /nfs/dbraw/zinc/97/38/55/1022973855.db2.gz HNEIMFCGJFXHSA-HXUWFJFHSA-N 1 1 315.457 3.664 20 10 DHCDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768465747 1022974080 /nfs/dbraw/zinc/97/40/80/1022974080.db2.gz KFHZWGVEDIXTPE-UKRRQHHQSA-N 1 1 307.434 3.810 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1F)Cc1cccc(OC)c1O ZINC000768486572 1022978986 /nfs/dbraw/zinc/97/89/86/1022978986.db2.gz OCWZJPBBAAMXKQ-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000768520438 1022980679 /nfs/dbraw/zinc/98/06/79/1022980679.db2.gz MYXMBFOWQPCOQQ-UHFFFAOYSA-N 1 1 317.433 3.958 20 10 DHCDMO CC[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1ccccc1O ZINC001237953367 1023028799 /nfs/dbraw/zinc/02/87/99/1023028799.db2.gz YPYWIRNIGIMSEM-UHFFFAOYSA-N 1 1 316.348 3.890 20 10 DHCDMO CCCN1CCC([N@H+](C)Cc2ccc(N(CC)CC)cc2)CC1 ZINC000768919711 1023055823 /nfs/dbraw/zinc/05/58/23/1023055823.db2.gz AAUVBZLUJVOGTB-UHFFFAOYSA-N 1 1 317.521 3.839 20 10 DHCDMO CCCN1CCC([N@@H+](C)Cc2ccc(N(CC)CC)cc2)CC1 ZINC000768919711 1023055840 /nfs/dbraw/zinc/05/58/40/1023055840.db2.gz AAUVBZLUJVOGTB-UHFFFAOYSA-N 1 1 317.521 3.839 20 10 DHCDMO CCC[NH+]1CCC(N(C)Cc2ccc(N(CC)CC)cc2)CC1 ZINC000768919711 1023055852 /nfs/dbraw/zinc/05/58/52/1023055852.db2.gz AAUVBZLUJVOGTB-UHFFFAOYSA-N 1 1 317.521 3.839 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1 ZINC000768930131 1023060293 /nfs/dbraw/zinc/06/02/93/1023060293.db2.gz LKIYNRXJBQINSN-AWEZNQCLSA-N 1 1 313.397 3.747 20 10 DHCDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769164359 1023094251 /nfs/dbraw/zinc/09/42/51/1023094251.db2.gz IVKYKHMTDAAHHD-IBGZPJMESA-N 1 1 316.489 3.924 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(OC)cc1OC ZINC000769201305 1023102014 /nfs/dbraw/zinc/10/20/14/1023102014.db2.gz RLJPMKSYZGHFOW-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CC(C)(C)C[N@@H+](CCO)Cc1ccc(N2CCCCC2)cc1 ZINC000769336827 1023114039 /nfs/dbraw/zinc/11/40/39/1023114039.db2.gz BNILMTKFPWPLLS-UHFFFAOYSA-N 1 1 304.478 3.517 20 10 DHCDMO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769311206 1023119529 /nfs/dbraw/zinc/11/95/29/1023119529.db2.gz ZQJZTBKKOYPINN-OXQOHEQNSA-N 1 1 310.441 3.715 20 10 DHCDMO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)C[C@@H]1CCOC1 ZINC000749963527 1023122572 /nfs/dbraw/zinc/12/25/72/1023122572.db2.gz IHCZTFLRSCODOM-ZDUSSCGKSA-N 1 1 311.381 3.760 20 10 DHCDMO CCC1(CC)CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769398133 1023150847 /nfs/dbraw/zinc/15/08/47/1023150847.db2.gz GPQUIKZBQCWWDF-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2)[C@H](CO)C(C)C)c1 ZINC000769456542 1023157922 /nfs/dbraw/zinc/15/79/22/1023157922.db2.gz KYOJICBBUHTEQZ-LJQANCHMSA-N 1 1 313.441 3.720 20 10 DHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769458663 1023159845 /nfs/dbraw/zinc/15/98/45/1023159845.db2.gz XUIUVWYAPOJOBG-GOSISDBHSA-N 1 1 302.462 3.678 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC000769537127 1023175483 /nfs/dbraw/zinc/17/54/83/1023175483.db2.gz HRIJQMPJWNMFCX-UHFFFAOYSA-N 1 1 315.413 3.820 20 10 DHCDMO C[N@@H+](CCOCc1ccccc1)Cc1c(O)cccc1Cl ZINC000770306721 1023294232 /nfs/dbraw/zinc/29/42/32/1023294232.db2.gz PIVHIMNCDBGGLR-UHFFFAOYSA-N 1 1 305.805 3.694 20 10 DHCDMO Cc1ccc(C)c([C@H]2C[N@@H+](Cc3ccccc3O)[C@@H](C)CO2)c1 ZINC000770506157 1023316400 /nfs/dbraw/zinc/31/64/00/1023316400.db2.gz VTTXOYCJTWBZPQ-OXJNMPFZSA-N 1 1 311.425 3.971 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000876805389 1033146922 /nfs/dbraw/zinc/14/69/22/1033146922.db2.gz ZQPSIWDTOJEIQX-RHSMWYFYSA-N 1 1 317.454 3.850 20 10 DHCDMO C[C@H](NCCC[NH+]1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000178414383 1023588755 /nfs/dbraw/zinc/58/87/55/1023588755.db2.gz YWNAFMVLNPPCJC-SFHVURJKSA-N 1 1 315.505 3.813 20 10 DHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1c(O)cccc1OC ZINC000785985996 1023649583 /nfs/dbraw/zinc/64/95/83/1023649583.db2.gz ZQONJCPNMGBPTK-UHFFFAOYSA-N 1 1 310.397 3.904 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)C2CCC(OC)CC2)c(O)c1 ZINC000093415094 1023720577 /nfs/dbraw/zinc/72/05/77/1023720577.db2.gz QUYZSHOVHAURSC-UHFFFAOYSA-N 1 1 307.434 3.570 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(F)cn1)C1CCCC1 ZINC000787247338 1023776322 /nfs/dbraw/zinc/77/63/22/1023776322.db2.gz UPNQBXHWPZBIJP-UHFFFAOYSA-N 1 1 300.377 3.871 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC000787416847 1023791339 /nfs/dbraw/zinc/79/13/39/1023791339.db2.gz HWMYIYCHDLTRGU-CQSZACIVSA-N 1 1 317.351 3.954 20 10 DHCDMO COC[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788612502 1023914615 /nfs/dbraw/zinc/91/46/15/1023914615.db2.gz MPHNKFTYKPMJPV-GXFFZTMASA-N 1 1 305.340 3.733 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCS1)c1cccc(C(F)(F)F)c1O ZINC000788629565 1023916354 /nfs/dbraw/zinc/91/63/54/1023916354.db2.gz WJGFPFLRTDHVTE-VHSXEESVSA-N 1 1 305.365 3.957 20 10 DHCDMO CSC1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000788793257 1023939690 /nfs/dbraw/zinc/93/96/90/1023939690.db2.gz BOMHTEUUQDRXRD-SECBINFHSA-N 1 1 305.365 3.957 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccc(F)cc1O ZINC000796702916 1023939680 /nfs/dbraw/zinc/93/96/80/1023939680.db2.gz QLOSAGFCWPBWFH-AEFFLSMTSA-N 1 1 303.377 3.960 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)cc1C(C)C ZINC000789506805 1024103899 /nfs/dbraw/zinc/10/38/99/1024103899.db2.gz NPTOLEPEWTZIJA-PKOBYXMFSA-N 1 1 303.446 3.967 20 10 DHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000789584866 1024120261 /nfs/dbraw/zinc/12/02/61/1024120261.db2.gz SFZFTSCTFUORMS-HNNXBMFYSA-N 1 1 319.832 3.735 20 10 DHCDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000789586084 1024120463 /nfs/dbraw/zinc/12/04/63/1024120463.db2.gz JUGKCKQWSIVSCP-LJQANCHMSA-N 1 1 313.441 3.699 20 10 DHCDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882881086 1024156680 /nfs/dbraw/zinc/15/66/80/1024156680.db2.gz XOCCBQYAOMCVFL-NSHDSACASA-N 1 1 307.340 3.838 20 10 DHCDMO C[C@H]([NH2+]Cc1nccn1C)c1ccc(N2CCCCCC2)cc1 ZINC000268956035 1024205157 /nfs/dbraw/zinc/20/51/57/1024205157.db2.gz YQXXQXQUTLIPDH-INIZCTEOSA-N 1 1 312.461 3.651 20 10 DHCDMO CCOc1cc(C)ccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883038664 1024219178 /nfs/dbraw/zinc/21/91/78/1024219178.db2.gz OWQKAROFGCKEPB-UHFFFAOYSA-N 1 1 307.340 3.667 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000883088819 1024237865 /nfs/dbraw/zinc/23/78/65/1024237865.db2.gz RBCCIJJWYJYHNV-NVXWUHKLSA-N 1 1 319.351 3.680 20 10 DHCDMO CCO[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883104605 1024241940 /nfs/dbraw/zinc/24/19/40/1024241940.db2.gz GIZLVQAMCSLKEE-MRXNPFEDSA-N 1 1 307.340 3.538 20 10 DHCDMO CC(C)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H](O)c1ccccc1 ZINC000883106563 1024243255 /nfs/dbraw/zinc/24/32/55/1024243255.db2.gz XFAQRFVEGAWSQV-WMZOPIPTSA-N 1 1 321.367 3.518 20 10 DHCDMO C[C@H](Cn1cccn1)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278893473 1024355609 /nfs/dbraw/zinc/35/56/09/1024355609.db2.gz YTQCXBBKJLKHQW-NXEZZACHSA-N 1 1 314.216 3.635 20 10 DHCDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000131592874 1024394625 /nfs/dbraw/zinc/39/46/25/1024394625.db2.gz VKNSNHPYXZCNJQ-JTQLQIEISA-N 1 1 321.323 3.592 20 10 DHCDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000131592874 1024394639 /nfs/dbraw/zinc/39/46/39/1024394639.db2.gz VKNSNHPYXZCNJQ-JTQLQIEISA-N 1 1 321.323 3.592 20 10 DHCDMO COc1ccc(CCC[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790954236 1024404207 /nfs/dbraw/zinc/40/42/07/1024404207.db2.gz MVWUEYHPFSXTDT-UHFFFAOYSA-N 1 1 323.795 3.916 20 10 DHCDMO COc1cccc(C[C@@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790959349 1024404654 /nfs/dbraw/zinc/40/46/54/1024404654.db2.gz ZPQJGGYYNUJNPZ-LLVKDONJSA-N 1 1 323.795 3.914 20 10 DHCDMO CS[C@H]1CCC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790966745 1024409126 /nfs/dbraw/zinc/40/91/26/1024409126.db2.gz VOLUBCKQOZGXLO-ZJUUUORDSA-N 1 1 303.830 3.949 20 10 DHCDMO CS[C@@H]1CCC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790966742 1024409359 /nfs/dbraw/zinc/40/93/59/1024409359.db2.gz VOLUBCKQOZGXLO-NXEZZACHSA-N 1 1 303.830 3.949 20 10 DHCDMO CCCC(O)(CCC)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790966791 1024409753 /nfs/dbraw/zinc/40/97/53/1024409753.db2.gz JUPMLKLZTKPRCQ-UHFFFAOYSA-N 1 1 303.805 3.606 20 10 DHCDMO CCCC[N@H+](C)C[C@@H](C)NCc1c(C)c2ccccc2n1C ZINC001202618153 1024617212 /nfs/dbraw/zinc/61/72/12/1024617212.db2.gz HCJAGINRXHORQN-OAHLLOKOSA-N 1 1 301.478 3.697 20 10 DHCDMO CCCC[N@@H+](C)C[C@@H](C)NCc1c(C)c2ccccc2n1C ZINC001202618153 1024617218 /nfs/dbraw/zinc/61/72/18/1024617218.db2.gz HCJAGINRXHORQN-OAHLLOKOSA-N 1 1 301.478 3.697 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2c(O)ccc(Cl)c2F)cc1 ZINC000792160845 1024639024 /nfs/dbraw/zinc/63/90/24/1024639024.db2.gz BXOHFFPMBLWJDH-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c(O)ccc(Cl)c2F)cc1 ZINC000792160845 1024639028 /nfs/dbraw/zinc/63/90/28/1024639028.db2.gz BXOHFFPMBLWJDH-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc[nH]2)c(C(F)(F)F)c1 ZINC000792836801 1024806111 /nfs/dbraw/zinc/80/61/11/1024806111.db2.gz ZUDLBYKJIDLOCV-UHFFFAOYSA-N 1 1 311.351 3.732 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@](C)(OC)CC2)cc1 ZINC000793342263 1024984792 /nfs/dbraw/zinc/98/47/92/1024984792.db2.gz WUAPOYDSAITTEP-LJQANCHMSA-N 1 1 304.478 3.924 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000228172566 1025010143 /nfs/dbraw/zinc/01/01/43/1025010143.db2.gz MNVOLRLYCCQEOP-BXUZGUMPSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000228172566 1025010160 /nfs/dbraw/zinc/01/01/60/1025010160.db2.gz MNVOLRLYCCQEOP-BXUZGUMPSA-N 1 1 310.235 3.919 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1O ZINC000318944478 1025088018 /nfs/dbraw/zinc/08/80/18/1025088018.db2.gz ZVEWVMGTXMVOGH-ZDUSSCGKSA-N 1 1 317.351 3.954 20 10 DHCDMO CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000319118349 1025168948 /nfs/dbraw/zinc/16/89/48/1025168948.db2.gz NOIDGKPCWXWIJL-HNNXBMFYSA-N 1 1 300.446 3.926 20 10 DHCDMO CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000319118349 1025168958 /nfs/dbraw/zinc/16/89/58/1025168958.db2.gz NOIDGKPCWXWIJL-HNNXBMFYSA-N 1 1 300.446 3.926 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1Cl ZINC000825949543 1033276622 /nfs/dbraw/zinc/27/66/22/1033276622.db2.gz WSVPFVLDYMQIAW-SJORKVTESA-N 1 1 321.848 3.888 20 10 DHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](CO)C2)c(O)c(C(C)(C)C)c1 ZINC000092764830 1025461527 /nfs/dbraw/zinc/46/15/27/1025461527.db2.gz ROIALDUJZGVBPR-CQSZACIVSA-N 1 1 319.489 3.801 20 10 DHCDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886496723 1025655082 /nfs/dbraw/zinc/65/50/82/1025655082.db2.gz FQJDXDCCYRXEGP-NEPJUHHUSA-N 1 1 316.376 3.902 20 10 DHCDMO CC(C)Oc1ncccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886505031 1025658416 /nfs/dbraw/zinc/65/84/16/1025658416.db2.gz FZCOOSALHHAEBS-GFCCVEGCSA-N 1 1 304.365 3.564 20 10 DHCDMO CCCOc1ncccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886512856 1025666386 /nfs/dbraw/zinc/66/63/86/1025666386.db2.gz OMCBKDBXCDRVCF-GFCCVEGCSA-N 1 1 304.365 3.566 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc([S@](C)=O)cc1 ZINC000886557202 1025702552 /nfs/dbraw/zinc/70/25/52/1025702552.db2.gz WAJFEHNZIJFFRL-IBILFNBTSA-N 1 1 321.417 3.681 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1c(O)cccc1F ZINC000886559674 1025708594 /nfs/dbraw/zinc/70/85/94/1025708594.db2.gz AZDSJBLMRSNKGT-LBPRGKRZSA-N 1 1 318.392 3.954 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1c(O)cccc1F ZINC000886577972 1025716823 /nfs/dbraw/zinc/71/68/23/1025716823.db2.gz DUUURXVRILKYRV-NQERCMRGSA-N 1 1 305.393 3.530 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1c(O)cccc1F ZINC000886594925 1025731021 /nfs/dbraw/zinc/73/10/21/1025731021.db2.gz WXDZBSXENIRYTG-LBPRGKRZSA-N 1 1 303.377 3.610 20 10 DHCDMO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886609090 1025736420 /nfs/dbraw/zinc/73/64/20/1025736420.db2.gz MEAUCHOPZWLMHH-FHSNZYRGSA-N 1 1 303.377 3.612 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H](O)c1ccccc1 ZINC000886649431 1025761478 /nfs/dbraw/zinc/76/14/78/1025761478.db2.gz AKHYCKZWOQVXJG-XLWVJDPXSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000806180827 1025834137 /nfs/dbraw/zinc/83/41/37/1025834137.db2.gz SXWLVZYNWMQNBK-DGCLKSJQSA-N 1 1 323.795 3.611 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000886774908 1025892384 /nfs/dbraw/zinc/89/23/84/1025892384.db2.gz XYWUYOVLNZDXSY-CXAGYDPISA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1O ZINC000841746740 1026049060 /nfs/dbraw/zinc/04/90/60/1026049060.db2.gz KXXNELTZNIIFJN-NSHDSACASA-N 1 1 320.776 3.847 20 10 DHCDMO C[N@@H+](CCc1nccs1)Cc1ccc(N2CCCCC2)cc1 ZINC000093843759 1026131245 /nfs/dbraw/zinc/13/12/45/1026131245.db2.gz KKSZCMUJQJFXIC-UHFFFAOYSA-N 1 1 315.486 3.808 20 10 DHCDMO CCC[N@@H+](CCc1ccccn1)Cc1cc(Cl)ccc1O ZINC000809734578 1026597910 /nfs/dbraw/zinc/59/79/10/1026597910.db2.gz KCFMHNHTYFPKIQ-UHFFFAOYSA-N 1 1 304.821 3.895 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](N3CCCC3)C[C@@H]2C)cc1 ZINC000809703299 1026599214 /nfs/dbraw/zinc/59/92/14/1026599214.db2.gz HSANNGNWJYMCIJ-PXNSSMCTSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@@H](N3CCCC3)C[C@@H]2C)cc1 ZINC000809703299 1026599218 /nfs/dbraw/zinc/59/92/18/1026599218.db2.gz HSANNGNWJYMCIJ-PXNSSMCTSA-N 1 1 315.505 3.591 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)c1 ZINC000809768162 1026605699 /nfs/dbraw/zinc/60/56/99/1026605699.db2.gz DEXSBTMYPBWXGU-KRWDZBQOSA-N 1 1 321.424 3.715 20 10 DHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000809766995 1026606006 /nfs/dbraw/zinc/60/60/06/1026606006.db2.gz DBYHJCUAJQHGPV-LBPRGKRZSA-N 1 1 318.280 3.728 20 10 DHCDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000809767272 1026606607 /nfs/dbraw/zinc/60/66/07/1026606607.db2.gz IFOMWPOCJHNJKA-LJQANCHMSA-N 1 1 304.478 3.516 20 10 DHCDMO CCOC1CC([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809773571 1026607937 /nfs/dbraw/zinc/60/79/37/1026607937.db2.gz GCKMXWBPRKUXED-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2[O-])cc1 ZINC000809738375 1026609114 /nfs/dbraw/zinc/60/91/14/1026609114.db2.gz WPJMLPKGGBVFEK-UHFFFAOYSA-N 1 1 318.848 3.739 20 10 DHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2[O-])cc1 ZINC000809738375 1026609117 /nfs/dbraw/zinc/60/91/17/1026609117.db2.gz WPJMLPKGGBVFEK-UHFFFAOYSA-N 1 1 318.848 3.739 20 10 DHCDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1cccc(OC)c1O ZINC000809783453 1026623571 /nfs/dbraw/zinc/62/35/71/1026623571.db2.gz DCSQZGOGIPGERX-QGZVFWFLSA-N 1 1 315.413 3.993 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000809787144 1026626064 /nfs/dbraw/zinc/62/60/64/1026626064.db2.gz UUWBMWZABPVXCE-LBPRGKRZSA-N 1 1 310.235 3.777 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000809787144 1026626073 /nfs/dbraw/zinc/62/60/73/1026626073.db2.gz UUWBMWZABPVXCE-LBPRGKRZSA-N 1 1 310.235 3.777 20 10 DHCDMO Cc1cccc2c1OC[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)C2 ZINC000810259775 1026721389 /nfs/dbraw/zinc/72/13/89/1026721389.db2.gz SELCVQOAAKVECN-FZMZJTMJSA-N 1 1 319.351 3.633 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)[C@@H]1[C@H]1CCCO1 ZINC000811510693 1027026012 /nfs/dbraw/zinc/02/60/12/1027026012.db2.gz MZJJXZZXTYKHIM-RTBURBONSA-N 1 1 311.425 3.935 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000811512213 1027027603 /nfs/dbraw/zinc/02/76/03/1027027603.db2.gz HODSXRHJVTZZQM-LJQANCHMSA-N 1 1 313.372 3.501 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCCC3)[C@H]1[C@H]1CCCO1 ZINC000811777970 1027082089 /nfs/dbraw/zinc/08/20/89/1027082089.db2.gz WHHGIZISJKUMSN-MOPGFXCFSA-N 1 1 315.457 3.660 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)C[C@H](C)OC ZINC000812808497 1027431977 /nfs/dbraw/zinc/43/19/77/1027431977.db2.gz FSMOEIPSOWMNAO-LBPRGKRZSA-N 1 1 318.383 3.628 20 10 DHCDMO C[C@@H]1C[C@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000778984773 1027712172 /nfs/dbraw/zinc/71/21/72/1027712172.db2.gz KIECYALTLWMBOT-IEBWSBKVSA-N 1 1 316.489 3.924 20 10 DHCDMO C[N@@H+](Cc1cc(F)ccc1O)Cc1ccccc1Br ZINC000778991634 1027728896 /nfs/dbraw/zinc/72/88/96/1027728896.db2.gz BLYXLIRVGROXME-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@H+](Cc1cc(F)ccc1O)Cc1ccccc1Br ZINC000778991634 1027728912 /nfs/dbraw/zinc/72/89/12/1027728912.db2.gz BLYXLIRVGROXME-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)ccc1O ZINC000778995989 1027748073 /nfs/dbraw/zinc/74/80/73/1027748073.db2.gz IAHNDSPNAIEVDW-UHFFFAOYSA-N 1 1 318.348 3.850 20 10 DHCDMO CC(C)n1ncc2c1C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)CC2 ZINC000364377373 1027812758 /nfs/dbraw/zinc/81/27/58/1027812758.db2.gz OTMAETQBWSQBNO-DOMZBBRYSA-N 1 1 317.408 3.517 20 10 DHCDMO CCC[N@@H+](Cc1cc(F)ccc1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000779024929 1027906364 /nfs/dbraw/zinc/90/63/64/1027906364.db2.gz DZAPVPPETADSQZ-DJIMGWMZSA-N 1 1 307.409 3.557 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(c3cccc(F)c3)C[C@H]2C)c1 ZINC000814178366 1027915512 /nfs/dbraw/zinc/91/55/12/1027915512.db2.gz NEZYPQPBWBRFBB-OAHLLOKOSA-N 1 1 314.404 3.550 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)[C@H]1c1ccncc1 ZINC000814227897 1027963275 /nfs/dbraw/zinc/96/32/75/1027963275.db2.gz OSRCMVMKJUDOIJ-IBGZPJMESA-N 1 1 319.408 3.919 20 10 DHCDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c(O)cc1C ZINC000814229883 1027965141 /nfs/dbraw/zinc/96/51/41/1027965141.db2.gz GJZREZLEYRAKHX-GOSISDBHSA-N 1 1 312.413 3.687 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1[O-] ZINC000367491333 1028190508 /nfs/dbraw/zinc/19/05/08/1028190508.db2.gz SPUKUXVGBICYMC-XEZPLFJOSA-N 1 1 308.853 3.713 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000367718091 1028231128 /nfs/dbraw/zinc/23/11/28/1028231128.db2.gz FFWVAHKBERLSIV-CQSZACIVSA-N 1 1 305.809 3.723 20 10 DHCDMO CCc1nc([C@H]2CCC[N@H+]2[C@H](CC)c2ccccc2O)no1 ZINC000368030912 1028285229 /nfs/dbraw/zinc/28/52/29/1028285229.db2.gz QKHWLAOHRMXLAH-ZIAGYGMSSA-N 1 1 301.390 3.626 20 10 DHCDMO CCc1nc([C@H]2CCC[N@@H+]2[C@H](CC)c2ccccc2O)no1 ZINC000368030912 1028285241 /nfs/dbraw/zinc/28/52/41/1028285241.db2.gz QKHWLAOHRMXLAH-ZIAGYGMSSA-N 1 1 301.390 3.626 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)ccc1N(C)C ZINC000815016012 1028328204 /nfs/dbraw/zinc/32/82/04/1028328204.db2.gz VEPWSXFSEDKYHG-FQEVSTJZSA-N 1 1 310.441 3.635 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1N(C)C ZINC000815080548 1028353099 /nfs/dbraw/zinc/35/30/99/1028353099.db2.gz SMMYKPVECAGUPX-PKOBYXMFSA-N 1 1 316.489 3.700 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)ccc1N(C)C ZINC000815118496 1028364502 /nfs/dbraw/zinc/36/45/02/1028364502.db2.gz WJGZWDXRRHULPL-AEFFLSMTSA-N 1 1 304.478 3.577 20 10 DHCDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc(F)cc1O ZINC000368586510 1028379640 /nfs/dbraw/zinc/37/96/40/1028379640.db2.gz YUKTZULHPCMAJE-YAXFVEMYSA-N 1 1 305.324 3.843 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccnn2C)ccc1N(C)C ZINC000815106997 1028380554 /nfs/dbraw/zinc/38/05/54/1028380554.db2.gz ISHOELSGHHVOAG-LJQANCHMSA-N 1 1 312.461 3.522 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCCC[C@H]1O ZINC000779154446 1028457172 /nfs/dbraw/zinc/45/71/72/1028457172.db2.gz SQIYBTPOSNMPKJ-AZUAARDMSA-N 1 1 316.489 3.660 20 10 DHCDMO CCc1nnc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000810260566 1028537261 /nfs/dbraw/zinc/53/72/61/1028537261.db2.gz MCIOPVBIRGKVOA-VIFPVBQESA-N 1 1 311.838 3.619 20 10 DHCDMO CC[C@@H](c1ccccc1O)N1CCC([N@@H+]2CCC[C@@H]2C)CC1 ZINC000369888349 1028541002 /nfs/dbraw/zinc/54/10/02/1028541002.db2.gz NXKXAQXCVRQQPG-YJBOKZPZSA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@@H](c1ccccc1O)N1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000369888349 1028541012 /nfs/dbraw/zinc/54/10/12/1028541012.db2.gz NXKXAQXCVRQQPG-YJBOKZPZSA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000369928995 1028548102 /nfs/dbraw/zinc/54/81/02/1028548102.db2.gz GFCAPGQSFIOAQB-WBVHZDCISA-N 1 1 303.427 3.978 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)N(C(C)C)C(C)C ZINC000076074536 1028556782 /nfs/dbraw/zinc/55/67/82/1028556782.db2.gz ICEIXEBBTXTERY-MRXNPFEDSA-N 1 1 320.477 3.638 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583712 1028556888 /nfs/dbraw/zinc/55/68/88/1028556888.db2.gz MRVSTXXVFPPALT-SDDRHHMPSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583712 1028556900 /nfs/dbraw/zinc/55/69/00/1028556900.db2.gz MRVSTXXVFPPALT-SDDRHHMPSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@@H]([NH2+]CCc1nccs1)c1cccc(C(F)(F)F)c1O ZINC000815572067 1028566787 /nfs/dbraw/zinc/56/67/87/1028566787.db2.gz UIWFFRFTJNDYGO-SECBINFHSA-N 1 1 316.348 3.761 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](n2cnc3ccccc32)C1 ZINC000371464095 1028715172 /nfs/dbraw/zinc/71/51/72/1028715172.db2.gz ONXFJAJXBJBIJN-MRXNPFEDSA-N 1 1 307.397 3.579 20 10 DHCDMO CCC[N@@H+](CCCOCC(F)(F)F)Cc1ccccc1O ZINC000077275814 1028820208 /nfs/dbraw/zinc/82/02/08/1028820208.db2.gz YSAXMCPPQCDZBM-UHFFFAOYSA-N 1 1 305.340 3.573 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000372212242 1028823798 /nfs/dbraw/zinc/82/37/98/1028823798.db2.gz OUGADOAINIRSRB-KRWDZBQOSA-N 1 1 311.425 3.794 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@H](c3ccsc3)C[C@@H]2C)c1O ZINC000372405582 1028849534 /nfs/dbraw/zinc/84/95/34/1028849534.db2.gz WMYDBIAFEUPKJA-SWLSCSKDSA-N 1 1 303.427 3.840 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@@H](C)Cc1ccsc1 ZINC000190259801 1028866364 /nfs/dbraw/zinc/86/63/64/1028866364.db2.gz JGAUFAWAUQQTKY-ZDUSSCGKSA-N 1 1 305.443 3.915 20 10 DHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)Cc1ccsc1 ZINC000190259736 1028866531 /nfs/dbraw/zinc/86/65/31/1028866531.db2.gz OZUBNTWTLIQPSJ-GFCCVEGCSA-N 1 1 319.426 3.636 20 10 DHCDMO Oc1ccc2c(c1)C[N@H+](Cc1ccc3ccccc3c1O)CC2 ZINC000816492646 1028897874 /nfs/dbraw/zinc/89/78/74/1028897874.db2.gz XPTZKWKTSIWDHK-UHFFFAOYSA-N 1 1 305.377 3.809 20 10 DHCDMO [O-]c1c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513843 1028912120 /nfs/dbraw/zinc/91/21/20/1028912120.db2.gz DMDOJEARIMZYRY-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO [O-]c1c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513843 1028912133 /nfs/dbraw/zinc/91/21/33/1028912133.db2.gz DMDOJEARIMZYRY-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@]3(CCCOC3)C2)ccc2ccccc21 ZINC000816514827 1028917330 /nfs/dbraw/zinc/91/73/30/1028917330.db2.gz IJZLKFDDTHMUED-FQEVSTJZSA-N 1 1 311.425 3.938 20 10 DHCDMO Oc1c(C[N@H+]2CCO[C@@H](c3ccco3)C2)ccc2ccccc21 ZINC000816518598 1028917600 /nfs/dbraw/zinc/91/76/00/1028917600.db2.gz HLXIAKQETICBQJ-GOSISDBHSA-N 1 1 309.365 3.712 20 10 DHCDMO CCCOc1ncccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816542997 1028927473 /nfs/dbraw/zinc/92/74/73/1028927473.db2.gz JZTWMWYIDVXJPG-UHFFFAOYSA-N 1 1 324.783 3.658 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cc(F)ccc1F ZINC000816548033 1028930689 /nfs/dbraw/zinc/93/06/89/1028930689.db2.gz RMGJBXONBYUUJU-UHFFFAOYSA-N 1 1 301.695 3.753 20 10 DHCDMO CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816548391 1028930753 /nfs/dbraw/zinc/93/07/53/1028930753.db2.gz FZXYKWQNBQSHDI-INIZCTEOSA-N 1 1 312.457 3.755 20 10 DHCDMO CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816548391 1028930766 /nfs/dbraw/zinc/93/07/66/1028930766.db2.gz FZXYKWQNBQSHDI-INIZCTEOSA-N 1 1 312.457 3.755 20 10 DHCDMO CS[C@H]1CCCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521710 1028933235 /nfs/dbraw/zinc/93/32/35/1028933235.db2.gz XCSQTNXSSJTYRD-NSHDSACASA-N 1 1 303.830 3.902 20 10 DHCDMO CS[C@H]1CCCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521710 1028933248 /nfs/dbraw/zinc/93/32/48/1028933248.db2.gz XCSQTNXSSJTYRD-NSHDSACASA-N 1 1 303.830 3.902 20 10 DHCDMO Cc1c(C[NH2+]Cc2cc(Cl)c(F)cc2O)cccc1[N+](=O)[O-] ZINC000816590968 1028937467 /nfs/dbraw/zinc/93/74/67/1028937467.db2.gz PYKGFSOEAWQGHN-UHFFFAOYSA-N 1 1 324.739 3.691 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000816588379 1028938146 /nfs/dbraw/zinc/93/81/46/1028938146.db2.gz MNTMCCTZSCUFSB-UHFFFAOYSA-N 1 1 304.752 3.956 20 10 DHCDMO CSc1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)ccn1 ZINC000816565008 1028944947 /nfs/dbraw/zinc/94/49/47/1028944947.db2.gz YGTJTDNMXYTDGD-UHFFFAOYSA-N 1 1 312.797 3.591 20 10 DHCDMO COc1cc(F)cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816558595 1028946077 /nfs/dbraw/zinc/94/60/77/1028946077.db2.gz GBFCTLNGCWOXSN-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO COC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCCCC1 ZINC000816572337 1028950062 /nfs/dbraw/zinc/95/00/62/1028950062.db2.gz LPFZLWYCMUPKNB-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO Cc1ccc([C@@H](O)[C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816608507 1028959559 /nfs/dbraw/zinc/95/95/59/1028959559.db2.gz BERJNVGVXXIQRX-GTNSWQLSSA-N 1 1 323.795 3.705 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000816610604 1028961894 /nfs/dbraw/zinc/96/18/94/1028961894.db2.gz QXNBLSKNZFQBCN-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2O)[C@@H]1[C@H]1CCCO1 ZINC000816614083 1028963666 /nfs/dbraw/zinc/96/36/66/1028963666.db2.gz MIFPCLDBJVDPMG-IEBWSBKVSA-N 1 1 311.425 3.935 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)cc1 ZINC000816662657 1028985393 /nfs/dbraw/zinc/98/53/93/1028985393.db2.gz UUSQKHQOERTBLV-HXUWFJFHSA-N 1 1 318.505 3.763 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000817281612 1029113897 /nfs/dbraw/zinc/11/38/97/1029113897.db2.gz NATSXJIYHKQSFM-CQSZACIVSA-N 1 1 300.368 3.917 20 10 DHCDMO Cc1cccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000817941101 1029282392 /nfs/dbraw/zinc/28/23/92/1029282392.db2.gz IUXTZEBIDQFUDN-OXQOHEQNSA-N 1 1 311.473 3.720 20 10 DHCDMO CC(C)[C@@H](N)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817960032 1029300975 /nfs/dbraw/zinc/30/09/75/1029300975.db2.gz WQSSDGNSTKHDKE-OALUTQOASA-N 1 1 312.457 3.639 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1[O-] ZINC000817975967 1029314565 /nfs/dbraw/zinc/31/45/65/1029314565.db2.gz RZMNDPRKTPWAIZ-MGPQQGTHSA-N 1 1 310.869 3.770 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977998 1029317405 /nfs/dbraw/zinc/31/74/05/1029317405.db2.gz SSQOTFQGCUYDHL-ZWNOBZJWSA-N 1 1 304.356 3.579 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc2ccccc2c1[O-] ZINC000817985269 1029321959 /nfs/dbraw/zinc/32/19/59/1029321959.db2.gz ITHFUHNJQNGXLY-ZBFHGGJFSA-N 1 1 310.441 3.871 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1 ZINC000822530361 1030043608 /nfs/dbraw/zinc/04/36/08/1030043608.db2.gz YTEHIIIIRNDXTG-IBGZPJMESA-N 1 1 314.473 3.534 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000290443901 1030052606 /nfs/dbraw/zinc/05/26/06/1030052606.db2.gz LYVXWKXFTZNEQW-KRWDZBQOSA-N 1 1 316.424 3.569 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1ccnn1C ZINC000866614734 1030405784 /nfs/dbraw/zinc/40/57/84/1030405784.db2.gz OPTUVMPMGRBKIY-UWVGGRQHSA-N 1 1 313.323 3.556 20 10 DHCDMO COC[C@]1(C)CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000824576523 1030585642 /nfs/dbraw/zinc/58/56/42/1030585642.db2.gz MZJFGFKAWBHNOV-HXUWFJFHSA-N 1 1 311.425 3.918 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](OC)[C@@H](C)C2)cc1F ZINC000824815722 1030645166 /nfs/dbraw/zinc/64/51/66/1030645166.db2.gz XQWZCFBMHZOEKS-KBXCAEBGSA-N 1 1 308.441 3.529 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC3(CCOCC3)C2)cc1Cl ZINC000824824277 1030657439 /nfs/dbraw/zinc/65/74/39/1030657439.db2.gz IXSHJAYXZBPTRN-UHFFFAOYSA-N 1 1 309.837 3.747 20 10 DHCDMO COc1c(O)c(C[N@H+](C(C)C)C2CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000825331458 1030779049 /nfs/dbraw/zinc/77/90/49/1030779049.db2.gz GQYYGFHPUOZECH-UHFFFAOYSA-N 1 1 322.405 3.708 20 10 DHCDMO COc1c(O)c(C[N@@H+](C(C)C)C2CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000825331458 1030779057 /nfs/dbraw/zinc/77/90/57/1030779057.db2.gz GQYYGFHPUOZECH-UHFFFAOYSA-N 1 1 322.405 3.708 20 10 DHCDMO CCOc1c(F)cc(C[N@@H+]2CCc3cccc(O)c3C2)cc1F ZINC001144033523 1031197353 /nfs/dbraw/zinc/19/73/53/1031197353.db2.gz WBPQOYLDWSZFOV-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1c(F)cc(C[N@H+]2CCc3cccc(O)c3C2)cc1F ZINC001144033523 1031197360 /nfs/dbraw/zinc/19/73/60/1031197360.db2.gz WBPQOYLDWSZFOV-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CSC)C2)c1O ZINC000292882711 1031234221 /nfs/dbraw/zinc/23/42/21/1031234221.db2.gz XYGJNILOLCBGQV-LLVKDONJSA-N 1 1 315.866 3.629 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@]4(CC4(F)F)C3)c2c1 ZINC000844759859 1031317246 /nfs/dbraw/zinc/31/72/46/1031317246.db2.gz MTNSOTGGFKTYLF-KRWDZBQOSA-N 1 1 319.351 3.785 20 10 DHCDMO C[C@@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299498 1031440143 /nfs/dbraw/zinc/44/01/43/1031440143.db2.gz YJTUCDMRRIBZJE-SECBINFHSA-N 1 1 302.187 3.668 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299498 1031440151 /nfs/dbraw/zinc/44/01/51/1031440151.db2.gz YJTUCDMRRIBZJE-SECBINFHSA-N 1 1 302.187 3.668 20 10 DHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1[O-] ZINC001144308091 1031459575 /nfs/dbraw/zinc/45/95/75/1031459575.db2.gz OKQVDBIXXKDGBO-CYBMUJFWSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144308091 1031459582 /nfs/dbraw/zinc/45/95/82/1031459582.db2.gz OKQVDBIXXKDGBO-CYBMUJFWSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144308091 1031459591 /nfs/dbraw/zinc/45/95/91/1031459591.db2.gz OKQVDBIXXKDGBO-CYBMUJFWSA-N 1 1 316.214 3.914 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1 ZINC000872261081 1031563470 /nfs/dbraw/zinc/56/34/70/1031563470.db2.gz ZIXJGRQXJORYGR-LJQANCHMSA-N 1 1 302.462 3.676 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872261440 1031565155 /nfs/dbraw/zinc/56/51/55/1031565155.db2.gz FFNHYLFDOXCWOK-AWEZNQCLSA-N 1 1 309.837 3.969 20 10 DHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc4c(cc3O)CCC4)C2)n1 ZINC000872807514 1031663607 /nfs/dbraw/zinc/66/36/07/1031663607.db2.gz SUQVPFAAISMELQ-OAHLLOKOSA-N 1 1 314.454 3.635 20 10 DHCDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000872803882 1031663803 /nfs/dbraw/zinc/66/38/03/1031663803.db2.gz DTZPOGJFNBKTLE-HNNXBMFYSA-N 1 1 310.319 3.715 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c(O)c1 ZINC001144515618 1031674510 /nfs/dbraw/zinc/67/45/10/1031674510.db2.gz SRKISHHCSKINNK-OAHLLOKOSA-N 1 1 319.788 3.794 20 10 DHCDMO C[N@@H+](Cc1c(O)cc(O)cc1O)C1CCC(C(C)(C)C)CC1 ZINC001144515012 1031675625 /nfs/dbraw/zinc/67/56/25/1031675625.db2.gz BFYPZBIGBYWVRX-UHFFFAOYSA-N 1 1 307.434 3.840 20 10 DHCDMO CCCc1nc(C)c(C[NH2+]Cc2cc(Cl)c(F)cc2O)o1 ZINC000293968340 1031727563 /nfs/dbraw/zinc/72/75/63/1031727563.db2.gz QIKJTCOOUSVERK-UHFFFAOYSA-N 1 1 312.772 3.723 20 10 DHCDMO CN(C)c1ccc(/C=C/C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000873165899 1031737824 /nfs/dbraw/zinc/73/78/24/1031737824.db2.gz ZFBUNWMRVAMLOH-ONEGZZNKSA-N 1 1 307.850 3.666 20 10 DHCDMO FC1(F)C[C@@]12CC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000846117186 1031867338 /nfs/dbraw/zinc/86/73/38/1031867338.db2.gz OFHWZGOBUOEVQR-QGZVFWFLSA-N 1 1 306.400 3.908 20 10 DHCDMO COc1ccc([C@@H]2CC[N@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001142527391 1031909996 /nfs/dbraw/zinc/90/99/96/1031909996.db2.gz SWPNYRUHFDQISX-CYBMUJFWSA-N 1 1 319.351 3.669 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001142527391 1031910008 /nfs/dbraw/zinc/91/00/08/1031910008.db2.gz SWPNYRUHFDQISX-CYBMUJFWSA-N 1 1 319.351 3.669 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccc(F)cc1O ZINC000846188888 1031922038 /nfs/dbraw/zinc/92/20/38/1031922038.db2.gz QSJHFCPTSIASQC-SJLPKXTDSA-N 1 1 307.409 3.777 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](Cc3nccs3)C2)cc1C ZINC000898071796 1031943169 /nfs/dbraw/zinc/94/31/69/1031943169.db2.gz SUIWDXUQZXCQMY-AWEZNQCLSA-N 1 1 302.443 3.530 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000846699574 1032041944 /nfs/dbraw/zinc/04/19/44/1032041944.db2.gz UTTGPDBGQXHJNO-FUHWJXTLSA-N 1 1 303.494 3.625 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c(O)c1 ZINC000877470192 1033312024 /nfs/dbraw/zinc/31/20/24/1033312024.db2.gz FQXWGQKPIFZEFQ-ZDUSSCGKSA-N 1 1 315.417 3.982 20 10 DHCDMO Cc1ncc([C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000877685445 1033412971 /nfs/dbraw/zinc/41/29/71/1033412971.db2.gz ZTPBEEDDQGRDST-ZETCQYMHSA-N 1 1 300.786 3.800 20 10 DHCDMO COc1cc(C[N@@H+]2Cc3cccc(O)c3C2)ccc1OC(C)C ZINC000877704070 1033417200 /nfs/dbraw/zinc/41/72/00/1033417200.db2.gz ZBLUKLYPSKWVSC-UHFFFAOYSA-N 1 1 313.397 3.704 20 10 DHCDMO COc1cc(C[N@H+]2Cc3cccc(O)c3C2)ccc1OC(C)C ZINC000877704070 1033417206 /nfs/dbraw/zinc/41/72/06/1033417206.db2.gz ZBLUKLYPSKWVSC-UHFFFAOYSA-N 1 1 313.397 3.704 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)c1O ZINC000877811978 1033460438 /nfs/dbraw/zinc/46/04/38/1033460438.db2.gz DKDODSROOZDBEA-CYBMUJFWSA-N 1 1 323.742 3.829 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCOC1)c1ccc(F)cc1O ZINC000927070458 1033518465 /nfs/dbraw/zinc/51/84/65/1033518465.db2.gz SDIXUFXESQFFOJ-SKDZVZGDSA-N 1 1 307.409 3.777 20 10 DHCDMO CCCOC1CCC([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001173101747 1033540360 /nfs/dbraw/zinc/54/03/60/1033540360.db2.gz SFVPPGOJGLRYLM-UHFFFAOYSA-N 1 1 304.478 3.922 20 10 DHCDMO CCCC[N@H+](Cc1nc(C2CCC2)no1)Cc1ccccc1O ZINC000878565223 1033753361 /nfs/dbraw/zinc/75/33/61/1033753361.db2.gz HHIJJFSUTWAHCI-UHFFFAOYSA-N 1 1 315.417 3.845 20 10 DHCDMO CCCC[N@@H+](Cc1nc(C2CCC2)no1)Cc1ccccc1O ZINC000878565223 1033753372 /nfs/dbraw/zinc/75/33/72/1033753372.db2.gz HHIJJFSUTWAHCI-UHFFFAOYSA-N 1 1 315.417 3.845 20 10 DHCDMO CC[N@H+](CCC(F)(F)F)Cc1cc(F)c(N(C)C)cc1F ZINC000862236831 1033789874 /nfs/dbraw/zinc/78/98/74/1033789874.db2.gz DULDJSHXAWHWOH-UHFFFAOYSA-N 1 1 310.310 3.805 20 10 DHCDMO CC[N@@H+](CCC(F)(F)F)Cc1cc(F)c(N(C)C)cc1F ZINC000862236831 1033789888 /nfs/dbraw/zinc/78/98/88/1033789888.db2.gz DULDJSHXAWHWOH-UHFFFAOYSA-N 1 1 310.310 3.805 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000862476391 1033862305 /nfs/dbraw/zinc/86/23/05/1033862305.db2.gz SAVUNZGRDGMCNC-QFBILLFUSA-N 1 1 316.489 3.833 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(C)ccc3O)C2)cc1F ZINC000862541895 1033881315 /nfs/dbraw/zinc/88/13/15/1033881315.db2.gz YTLDRXLUNGAXNM-OAHLLOKOSA-N 1 1 315.388 3.838 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1nnc(-c2cccs2)o1 ZINC000879650071 1034071534 /nfs/dbraw/zinc/07/15/34/1034071534.db2.gz ZSYMABIJUHPJDO-GHMZBOCLSA-N 1 1 315.398 3.916 20 10 DHCDMO COCCCC[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC000842170702 1034240906 /nfs/dbraw/zinc/24/09/06/1034240906.db2.gz CGGABVMEMHPBMK-UHFFFAOYSA-N 1 1 304.478 3.844 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000794663708 1034320218 /nfs/dbraw/zinc/32/02/18/1034320218.db2.gz VDFDRAFSPCZBRD-HZMBPMFUSA-N 1 1 310.319 3.713 20 10 DHCDMO C[C@@H](N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1O ZINC000183396378 1034382545 /nfs/dbraw/zinc/38/25/45/1034382545.db2.gz GGRHMOVDMZHYTA-APWZRJJASA-N 1 1 310.441 3.880 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185833609 1034575762 /nfs/dbraw/zinc/57/57/62/1034575762.db2.gz OWDWDEHYZVCBIE-IIYDPXPESA-N 1 1 303.377 3.694 20 10 DHCDMO Clc1cncc(Cl)c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000865440198 1034646883 /nfs/dbraw/zinc/64/68/83/1034646883.db2.gz DQEAJYGOAUAKKI-UHFFFAOYSA-N 1 1 309.196 3.613 20 10 DHCDMO COc1cc2c(cc1F)C[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000777440053 1034740477 /nfs/dbraw/zinc/74/04/77/1034740477.db2.gz GEBZAGSNPBKGRR-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc2c(cc1F)C[N@@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000777440053 1034740492 /nfs/dbraw/zinc/74/04/92/1034740492.db2.gz GEBZAGSNPBKGRR-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466590 1034757475 /nfs/dbraw/zinc/75/74/75/1034757475.db2.gz AHDCXZPNIJSHOU-QGZVFWFLSA-N 1 1 316.489 3.924 20 10 DHCDMO C[C@@H]([NH2+]CCc1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192649434 1034813449 /nfs/dbraw/zinc/81/34/49/1034813449.db2.gz ULGNAXWMUQUBMM-SNVBAGLBSA-N 1 1 311.212 3.987 20 10 DHCDMO Cc1cc(O)c(CNC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)c(Cl)c1 ZINC001177441435 1035372353 /nfs/dbraw/zinc/37/23/53/1035372353.db2.gz ATUXQOSQDJXROU-FZKQIMNGSA-N 1 1 324.896 3.954 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C[C@H](C)O)C2CCCCC2)cc1 ZINC000773756427 1035436407 /nfs/dbraw/zinc/43/64/07/1035436407.db2.gz ILRRJHXZWXUTOW-INIZCTEOSA-N 1 1 304.478 3.658 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)cc1 ZINC000773756087 1035438617 /nfs/dbraw/zinc/43/86/17/1035438617.db2.gz SZKBMBJLNRZPJT-OAQYLSRUSA-N 1 1 324.468 3.625 20 10 DHCDMO CC[NH+](CC)CC[C@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC001179830071 1035509281 /nfs/dbraw/zinc/50/92/81/1035509281.db2.gz KEOBZFLMLGDUEL-SFHVURJKSA-N 1 1 317.521 3.887 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@]2(C)Cc2ccccc2)c1 ZINC001180593866 1035728096 /nfs/dbraw/zinc/72/80/96/1035728096.db2.gz PORPVVQBTLIEOS-HXUWFJFHSA-N 1 1 311.425 3.998 20 10 DHCDMO CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)cc1C ZINC001181472813 1035921436 /nfs/dbraw/zinc/92/14/36/1035921436.db2.gz RQQZBCKITAOFCY-SFHVURJKSA-N 1 1 304.478 3.604 20 10 DHCDMO CCCOc1ccc(CNC[C@@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC001181472813 1035921440 /nfs/dbraw/zinc/92/14/40/1035921440.db2.gz RQQZBCKITAOFCY-SFHVURJKSA-N 1 1 304.478 3.604 20 10 DHCDMO CCCOc1ccc(CNC[C@@H]2CC[N@H+](C(C)C)C2)cc1C ZINC001181472813 1035921447 /nfs/dbraw/zinc/92/14/47/1035921447.db2.gz RQQZBCKITAOFCY-SFHVURJKSA-N 1 1 304.478 3.604 20 10 DHCDMO Oc1cc2c(cc1O)C[N@H+](Cc1cccc(Cl)c1)CCC2 ZINC001203801669 1036059393 /nfs/dbraw/zinc/05/93/93/1036059393.db2.gz XWDOZDCCHWUPTK-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1cccc(Cl)c1)CCC2 ZINC001203801669 1036059412 /nfs/dbraw/zinc/05/94/12/1036059412.db2.gz XWDOZDCCHWUPTK-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO CN(C)c1ccc(/C=C\CN2CC[N@@H+](C)Cc3ccccc32)cc1 ZINC001181988222 1036061795 /nfs/dbraw/zinc/06/17/95/1036061795.db2.gz XINBSTNKGWRUDY-SREVYHEPSA-N 1 1 321.468 3.718 20 10 DHCDMO C[C@H]([NH2+]C[C@H](O)c1ccco1)c1cc(Cl)c(Cl)cc1O ZINC000774115008 1036157572 /nfs/dbraw/zinc/15/75/72/1036157572.db2.gz JJDFBXIYULBZEV-SDBXPKJASA-N 1 1 316.184 3.676 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)CCOc2ccc(Cl)cc2)c1 ZINC000775643727 1036167575 /nfs/dbraw/zinc/16/75/75/1036167575.db2.gz TWXVUKBNONPJAK-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774148876 1036198536 /nfs/dbraw/zinc/19/85/36/1036198536.db2.gz UHSVCXVULWIVLF-ZJUUUORDSA-N 1 1 304.217 3.919 20 10 DHCDMO CC(C)C[C@H](O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774160632 1036206663 /nfs/dbraw/zinc/20/66/63/1036206663.db2.gz XYAOLRQUJPDFMB-UWVGGRQHSA-N 1 1 306.233 3.757 20 10 DHCDMO CC(C)C[C@@H](O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774160633 1036208813 /nfs/dbraw/zinc/20/88/13/1036208813.db2.gz XYAOLRQUJPDFMB-VHSXEESVSA-N 1 1 306.233 3.757 20 10 DHCDMO CC(C)[C@H](CCO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774210903 1036229936 /nfs/dbraw/zinc/22/99/36/1036229936.db2.gz HRZSLRCFDBPGRF-ZANVPECISA-N 1 1 306.233 3.757 20 10 DHCDMO CCC[C@](C)(O)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774185950 1036235695 /nfs/dbraw/zinc/23/56/95/1036235695.db2.gz WKAZYQINFDHPAU-OTYXRUKQSA-N 1 1 306.233 3.901 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c1 ZINC000775652946 1036242593 /nfs/dbraw/zinc/24/25/93/1036242593.db2.gz WPNQEDDSQXVXLP-GOSISDBHSA-N 1 1 311.425 3.998 20 10 DHCDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cccc(C)c1O ZINC000775665611 1036292823 /nfs/dbraw/zinc/29/28/23/1036292823.db2.gz FZANJDZFZJWRSG-SFHVURJKSA-N 1 1 311.425 3.916 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@H](O)C1(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774361002 1036298479 /nfs/dbraw/zinc/29/84/79/1036298479.db2.gz WJWNYCIHACPYBV-YLJLNXRRSA-N 1 1 304.217 3.509 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@@H]2CCc3ccccc32)cc1 ZINC001182726716 1036438638 /nfs/dbraw/zinc/43/86/38/1036438638.db2.gz XVLBDMSQJMHVHX-SFHVURJKSA-N 1 1 324.468 3.793 20 10 DHCDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001196175506 1036465707 /nfs/dbraw/zinc/46/57/07/1036465707.db2.gz LKXIMJZDAOQSBA-IAGOWNOFSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000775713908 1036524676 /nfs/dbraw/zinc/52/46/76/1036524676.db2.gz LMHZKZBZGWGMHR-DZGCQCFKSA-N 1 1 315.388 3.918 20 10 DHCDMO Cc1cc(Cl)cc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1O ZINC000775726712 1036574801 /nfs/dbraw/zinc/57/48/01/1036574801.db2.gz XPGHGLCLBVPHRN-HNNXBMFYSA-N 1 1 322.880 3.518 20 10 DHCDMO COc1cc(O)c(C[N@@H+](CC2CCCCC2)C2CC2)cc1OC ZINC000762172662 1036588136 /nfs/dbraw/zinc/58/81/36/1036588136.db2.gz KGBSIUZRUXUSPH-UHFFFAOYSA-N 1 1 319.445 3.954 20 10 DHCDMO [O-]c1ccc2ccccc2c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000151817158 1036646572 /nfs/dbraw/zinc/64/65/72/1036646572.db2.gz WRALRSOGPREIFA-UHFFFAOYSA-N 1 1 324.468 3.853 20 10 DHCDMO C[N@@H+](CCCOc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000915208206 1036705514 /nfs/dbraw/zinc/70/55/14/1036705514.db2.gz AEJRNIZBXOFITA-UHFFFAOYSA-N 1 1 311.425 3.782 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000153523411 1036717112 /nfs/dbraw/zinc/71/71/12/1036717112.db2.gz JJFIFKNJBMLRAP-QGZVFWFLSA-N 1 1 323.436 3.879 20 10 DHCDMO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1ccc(N(C)C)cc1 ZINC000775834579 1036994860 /nfs/dbraw/zinc/99/48/60/1036994860.db2.gz VBTZPVNDAQEZDM-CQSZACIVSA-N 1 1 322.412 3.653 20 10 DHCDMO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903236 1037191908 /nfs/dbraw/zinc/19/19/08/1037191908.db2.gz JRXPOZSAYJJBMR-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903236 1037191916 /nfs/dbraw/zinc/19/19/16/1037191916.db2.gz JRXPOZSAYJJBMR-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCCC23CCCCC3)ccc1[N+](=O)[O-] ZINC000774904900 1037196919 /nfs/dbraw/zinc/19/69/19/1037196919.db2.gz XQEHFKLVTLIAKF-UHFFFAOYSA-N 1 1 320.389 3.608 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCCC23CCCCC3)ccc1[N+](=O)[O-] ZINC000774904900 1037196929 /nfs/dbraw/zinc/19/69/29/1037196929.db2.gz XQEHFKLVTLIAKF-UHFFFAOYSA-N 1 1 320.389 3.608 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccsc2)c1 ZINC000800985079 1037995161 /nfs/dbraw/zinc/99/51/61/1037995161.db2.gz LJFXRZNCCOICQL-GHMZBOCLSA-N 1 1 305.399 3.652 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000917074008 1038161325 /nfs/dbraw/zinc/16/13/25/1038161325.db2.gz MTKRPPAYAPFTHE-ZDUSSCGKSA-N 1 1 313.272 3.911 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000164447720 1038190785 /nfs/dbraw/zinc/19/07/85/1038190785.db2.gz WVYZADAKANHZMC-UHFFFAOYSA-N 1 1 316.470 3.976 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000164447720 1038190798 /nfs/dbraw/zinc/19/07/98/1038190798.db2.gz WVYZADAKANHZMC-UHFFFAOYSA-N 1 1 316.470 3.976 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)CC2(O)CCCCCC2)cc1Cl ZINC001205474990 1038245924 /nfs/dbraw/zinc/24/59/24/1038245924.db2.gz GOEZNXBVGBBLJU-UHFFFAOYSA-N 1 1 311.853 3.871 20 10 DHCDMO CO[C@H](CC(C)C)C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190436840 1038315456 /nfs/dbraw/zinc/31/54/56/1038315456.db2.gz MCZNNKMCTRLIHT-LJQANCHMSA-N 1 1 304.478 3.778 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H](O)CC2CCCC2)C2CC2)cc1 ZINC001190437045 1038317735 /nfs/dbraw/zinc/31/77/35/1038317735.db2.gz RKAXYYGRIJATIC-FQEVSTJZSA-N 1 1 316.489 3.658 20 10 DHCDMO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)C[C@H]1CCCO1 ZINC000057100952 1038565542 /nfs/dbraw/zinc/56/55/42/1038565542.db2.gz UQUCDTDACFESTC-MRXNPFEDSA-N 1 1 315.413 3.555 20 10 DHCDMO CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000775548446 1038703523 /nfs/dbraw/zinc/70/35/23/1038703523.db2.gz RXLLRYDDFXSCPI-HNNXBMFYSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000760905936 1039043410 /nfs/dbraw/zinc/04/34/10/1039043410.db2.gz NCXBOYCQNFKEFY-MWLCHTKSSA-N 1 1 319.323 3.560 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087182 1039941016 /nfs/dbraw/zinc/94/10/16/1039941016.db2.gz KRVCDDOOMYTJJU-ROUUACIJSA-N 1 1 315.505 3.669 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+](C)Cc3cscn3)c2c1 ZINC000063127344 1040129679 /nfs/dbraw/zinc/12/96/79/1040129679.db2.gz DTWTZLTZBRIGNX-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3cscn3)c2c1 ZINC000063127344 1040129684 /nfs/dbraw/zinc/12/96/84/1040129684.db2.gz DTWTZLTZBRIGNX-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000093336103 193233173 /nfs/dbraw/zinc/23/31/73/193233173.db2.gz HMPGBHSSPLNRTQ-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000093336103 193233174 /nfs/dbraw/zinc/23/31/74/193233174.db2.gz HMPGBHSSPLNRTQ-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000272900408 130072180 /nfs/dbraw/zinc/07/21/80/130072180.db2.gz UZWNTZWZAQVWAO-AOIWGVFYSA-N 1 1 324.468 3.953 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cncc(F)c1 ZINC000275127199 130292655 /nfs/dbraw/zinc/29/26/55/130292655.db2.gz KXANQPQOEOOUGK-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)c(O)c1 ZINC000284059395 131045188 /nfs/dbraw/zinc/04/51/88/131045188.db2.gz KQQJHWWFHFSBHN-OAHLLOKOSA-N 1 1 302.462 3.534 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1c(F)cncc1F ZINC000285747626 131198736 /nfs/dbraw/zinc/19/87/36/131198736.db2.gz RSROIYQGANZOCZ-NWDGAFQWSA-N 1 1 305.372 3.838 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000295119610 131884428 /nfs/dbraw/zinc/88/44/28/131884428.db2.gz XELXIXLXSWVJBM-JQWIXIFHSA-N 1 1 303.324 3.564 20 10 DHCDMO Cc1noc(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000298697709 132074295 /nfs/dbraw/zinc/07/42/95/132074295.db2.gz GHTQXWMGXHCRML-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1O ZINC000295029779 335129919 /nfs/dbraw/zinc/12/99/19/335129919.db2.gz NTSZSHSICZKLEK-ZYHUDNBSSA-N 1 1 303.324 3.564 20 10 DHCDMO C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc2ccccc2c1[O-] ZINC000185356463 333369691 /nfs/dbraw/zinc/36/96/91/333369691.db2.gz KKZDRAKZUGAQRA-OAHLLOKOSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[C@@H](CO)C1)c1cc(Cl)c(Cl)cc1O ZINC000296514613 335145921 /nfs/dbraw/zinc/14/59/21/335145921.db2.gz PQKRTWBDKQWZDS-BBBLOLIVSA-N 1 1 304.217 3.511 20 10 DHCDMO COCCc1cc[nH+]c(NCc2c(C)c3ccccc3n2C)c1 ZINC000352545190 336223803 /nfs/dbraw/zinc/22/38/03/336223803.db2.gz HBYGOGGSLLFIMU-UHFFFAOYSA-N 1 1 309.413 3.683 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000375256589 337006623 /nfs/dbraw/zinc/00/66/23/337006623.db2.gz SUJQRTGGXMKBLT-AZUAARDMSA-N 1 1 309.409 3.975 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCCn2cc(C)nc21)c1ccc(F)cc1O ZINC000375843570 337021109 /nfs/dbraw/zinc/02/11/09/337021109.db2.gz YBDDBPDVINHUGQ-CJNGLKHVSA-N 1 1 317.408 3.655 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000305750354 337035635 /nfs/dbraw/zinc/03/56/35/337035635.db2.gz ZHUKPQQIOQOBHJ-AEFFLSMTSA-N 1 1 315.413 3.854 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1O ZINC000180021100 337173195 /nfs/dbraw/zinc/17/31/95/337173195.db2.gz RQIQLKADFHDSEI-QGZVFWFLSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1O ZINC000180021100 337173196 /nfs/dbraw/zinc/17/31/96/337173196.db2.gz RQIQLKADFHDSEI-QGZVFWFLSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1nnc([C@@H]([NH2+][C@H](C)c2ccc(C)cc2O)c2ccccc2)[nH]1 ZINC000185324673 337205116 /nfs/dbraw/zinc/20/51/16/337205116.db2.gz UHBWPGWCFSEEQQ-ACJLOTCBSA-N 1 1 322.412 3.567 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186442288 337256182 /nfs/dbraw/zinc/25/61/82/337256182.db2.gz YYTVNGZFEUVKNQ-GOSISDBHSA-N 1 1 315.800 3.677 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(F)cc1O ZINC000188060653 525627344 /nfs/dbraw/zinc/62/73/44/525627344.db2.gz KTJUROZQUQEYSY-BONVTDFDSA-N 1 1 305.324 3.845 20 10 DHCDMO Cc1noc(C2CCC([NH2+][C@@H](C)c3ccc(F)cc3O)CC2)n1 ZINC000363845800 526586474 /nfs/dbraw/zinc/58/64/74/526586474.db2.gz BPQZTLCXTUYQCT-JKDOVBDQSA-N 1 1 319.380 3.600 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](O)c1ccccc1C)c1ccc(F)cc1O ZINC000286234954 535911097 /nfs/dbraw/zinc/91/10/97/535911097.db2.gz SZDDIFDFQOMKLV-WMZOPIPTSA-N 1 1 303.377 3.614 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)c1O ZINC000894461917 1013378095 /nfs/dbraw/zinc/37/80/95/1013378095.db2.gz LZHIOFVPBPABDI-YOEHRIQHSA-N 1 1 312.413 3.687 20 10 DHCDMO COc1cc(C[N@@H+](CCc2nccs2)C(C)C)c(O)cc1C ZINC000160485263 1014112290 /nfs/dbraw/zinc/11/22/90/1014112290.db2.gz IAPVGMJLKPZXGK-UHFFFAOYSA-N 1 1 320.458 3.619 20 10 DHCDMO Cc1ccc2c(C)cc(NCCc3cc(O)c(O)cc3O)[nH+]c2c1 ZINC001168007011 1014427893 /nfs/dbraw/zinc/42/78/93/1014427893.db2.gz YQKHMZSDJIMKHY-UHFFFAOYSA-N 1 1 324.380 3.623 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000707157310 1015133818 /nfs/dbraw/zinc/13/38/18/1015133818.db2.gz MWBWEKAXCWLRBS-MRVPVSSYSA-N 1 1 324.140 3.539 20 10 DHCDMO C[C@H]([NH2+]Cc1csc(C(F)(F)F)n1)c1ccccc1O ZINC000895850952 1015334105 /nfs/dbraw/zinc/33/41/05/1015334105.db2.gz HBZLLZTYRJBLJK-QMMMGPOBSA-N 1 1 302.321 3.718 20 10 DHCDMO C[N@H+](Cc1nc2ccccc2o1)Cc1ccc(Cl)cc1O ZINC001140465406 1015528310 /nfs/dbraw/zinc/52/83/10/1015528310.db2.gz MBDMKQSVBSDMRI-UHFFFAOYSA-N 1 1 302.761 3.819 20 10 DHCDMO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccc(Cl)cc1O ZINC001140465406 1015528318 /nfs/dbraw/zinc/52/83/18/1015528318.db2.gz MBDMKQSVBSDMRI-UHFFFAOYSA-N 1 1 302.761 3.819 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC000896515610 1015617050 /nfs/dbraw/zinc/61/70/50/1015617050.db2.gz GXHNISFFKLYSAJ-CQSZACIVSA-N 1 1 314.454 3.717 20 10 DHCDMO CCC[N@@H+](Cc1cccc2[nH]c(=O)oc21)Cc1ccccc1O ZINC000891854429 1015688622 /nfs/dbraw/zinc/68/86/22/1015688622.db2.gz YULDXEQUFXWBFI-UHFFFAOYSA-N 1 1 312.369 3.651 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c1O ZINC000399575835 1016167671 /nfs/dbraw/zinc/16/76/71/1016167671.db2.gz HWNRMLLLBUYZHS-SRVKXCTJSA-N 1 1 312.251 3.939 20 10 DHCDMO COc1ccc(C[N@H+]2CCC3(C2)CCCCC3)c(O)c1OC ZINC000892115823 1016250981 /nfs/dbraw/zinc/25/09/81/1016250981.db2.gz UMFOMAIATOPJCH-UHFFFAOYSA-N 1 1 305.418 3.566 20 10 DHCDMO COCC1=CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000185054773 1016526210 /nfs/dbraw/zinc/52/62/10/1016526210.db2.gz GYWYGLDTLZUFHO-UHFFFAOYSA-N 1 1 303.446 3.777 20 10 DHCDMO Cc1ccc2c(C[N@@H+](C)Cc3ccccc3O)cc(=O)oc2c1C ZINC000111235937 1016746702 /nfs/dbraw/zinc/74/67/02/1016746702.db2.gz UZUVVVHJTRIKNF-UHFFFAOYSA-N 1 1 323.392 3.747 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1O ZINC000185233637 1016776059 /nfs/dbraw/zinc/77/60/59/1016776059.db2.gz SBCINUQHYXXITC-CYBMUJFWSA-N 1 1 314.404 3.765 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccc(F)cc1O ZINC000185404979 1016894973 /nfs/dbraw/zinc/89/49/73/1016894973.db2.gz MXTWEEYFQQJJJQ-STQMWFEESA-N 1 1 301.361 3.748 20 10 DHCDMO C[C@H]([NH2+]CCCSc1nccs1)c1ccc(F)cc1O ZINC000185489868 1016944868 /nfs/dbraw/zinc/94/48/68/1016944868.db2.gz WBDWTWXGLUPFEF-JTQLQIEISA-N 1 1 312.435 3.821 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)Oc1ccccc1F ZINC000185576178 1017020803 /nfs/dbraw/zinc/02/08/03/1017020803.db2.gz QYMMLBZGARQAMM-NEPJUHHUSA-N 1 1 307.340 3.789 20 10 DHCDMO COc1ccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185578479 1017028889 /nfs/dbraw/zinc/02/88/89/1017028889.db2.gz CSLDRWDAXUESRZ-OLZOCXBDSA-N 1 1 319.376 3.658 20 10 DHCDMO Cc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccccc2O)cc1 ZINC000091956448 1032466218 /nfs/dbraw/zinc/46/62/18/1032466218.db2.gz YDVYCDRASKWQRR-UHFFFAOYSA-N 1 1 307.397 3.723 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1C ZINC000773256185 1032661509 /nfs/dbraw/zinc/66/15/09/1032661509.db2.gz BFYJGAWEQRCGSU-IRXDYDNUSA-N 1 1 303.446 3.648 20 10 DHCDMO CC[N@@H+](CCc1ccc2c(c1)CCO2)Cc1ccc(N(C)C)cc1 ZINC001209148768 1013027159 /nfs/dbraw/zinc/02/71/59/1013027159.db2.gz KVDFDUUEDPEECO-UHFFFAOYSA-N 1 1 324.468 3.752 20 10 DHCDMO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185743338 1017135938 /nfs/dbraw/zinc/13/59/38/1017135938.db2.gz PCVPCEIWIMBCCT-ZBEGNZNMSA-N 1 1 301.361 3.878 20 10 DHCDMO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1O ZINC000796843947 1017531301 /nfs/dbraw/zinc/53/13/01/1017531301.db2.gz BMSPOCQMRDUBNT-INIZCTEOSA-N 1 1 318.348 3.723 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCOCC2)cc1)CC1CCCCC1 ZINC000764860622 1018402335 /nfs/dbraw/zinc/40/23/35/1018402335.db2.gz GHJJTMYJKSQHAV-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO CC[C@@H](CN[C@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868802 1018409173 /nfs/dbraw/zinc/40/91/73/1018409173.db2.gz JBQKSOCVNMNEBZ-AEFFLSMTSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccc(F)cc1O ZINC000926918959 1032763611 /nfs/dbraw/zinc/76/36/11/1032763611.db2.gz KMVSBAZAVPBOJS-VXGBXAGGSA-N 1 1 301.361 3.706 20 10 DHCDMO C[C@H](NC[C@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933635 1018431865 /nfs/dbraw/zinc/43/18/65/1018431865.db2.gz QFUYVOVXKOOBDT-IKGGRYGDSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H](NC[C@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933635 1018431870 /nfs/dbraw/zinc/43/18/70/1018431870.db2.gz QFUYVOVXKOOBDT-IKGGRYGDSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000161868110 1018662442 /nfs/dbraw/zinc/66/24/42/1018662442.db2.gz ZLONLKCGGYGIOL-KRWDZBQOSA-N 1 1 310.441 3.716 20 10 DHCDMO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858164878 1032789232 /nfs/dbraw/zinc/78/92/32/1032789232.db2.gz GPDBLUMVFCXAME-ZMZPIMSZSA-N 1 1 318.367 3.643 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCC2CCOCC2)C2CC2)cc1 ZINC000765933271 1018871934 /nfs/dbraw/zinc/87/19/34/1018871934.db2.gz QKRAPXFUVFNMTR-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO CCC(CC)[N@@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC000715711747 1018944650 /nfs/dbraw/zinc/94/46/50/1018944650.db2.gz HTNNOIKMXFPGGH-UHFFFAOYSA-N 1 1 304.203 3.914 20 10 DHCDMO CC(C)[C@H]1CCC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000715718486 1018949837 /nfs/dbraw/zinc/94/98/37/1018949837.db2.gz NXVCEBFCGJMOIC-CYBMUJFWSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000715718486 1018949848 /nfs/dbraw/zinc/94/98/48/1018949848.db2.gz NXVCEBFCGJMOIC-CYBMUJFWSA-N 1 1 316.214 3.914 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2c(Cl)c(C)nn2C)cc1 ZINC000921552899 1019052703 /nfs/dbraw/zinc/05/27/03/1019052703.db2.gz GJPRJJSOWJFROS-UHFFFAOYSA-N 1 1 320.868 3.518 20 10 DHCDMO Cc1cc(C[N@H+]2CCOC3(CCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000765723080 1019071585 /nfs/dbraw/zinc/07/15/85/1019071585.db2.gz DJNBLXFLGGXWMU-UHFFFAOYSA-N 1 1 303.446 3.753 20 10 DHCDMO COc1cc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825773973 1032808761 /nfs/dbraw/zinc/80/87/61/1032808761.db2.gz SAMWFIXAMVOXDW-UKRRQHHQSA-N 1 1 321.461 3.698 20 10 DHCDMO CC[C@H]1CCCC[N@@H+]1CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000765962605 1019194780 /nfs/dbraw/zinc/19/47/80/1019194780.db2.gz ULXFBRCWCUDSEG-AEFFLSMTSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000765962605 1019194782 /nfs/dbraw/zinc/19/47/82/1019194782.db2.gz ULXFBRCWCUDSEG-AEFFLSMTSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@@]1(C)O ZINC001143103491 1019369485 /nfs/dbraw/zinc/36/94/85/1019369485.db2.gz DRXWZSIACMJQAK-IFXJQAMLSA-N 1 1 305.462 3.673 20 10 DHCDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000170789268 1019434411 /nfs/dbraw/zinc/43/44/11/1019434411.db2.gz AKMDHHOTHDOSQR-NWDGAFQWSA-N 1 1 319.376 3.960 20 10 DHCDMO CCCc1nc(C)c(C[NH2+]Cc2ccc3c(c2)CCCO3)o1 ZINC000922144380 1019517866 /nfs/dbraw/zinc/51/78/66/1019517866.db2.gz UBONUSGZJTZSEP-UHFFFAOYSA-N 1 1 300.402 3.550 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc(F)cc2F)cc1 ZINC001171730295 1032847260 /nfs/dbraw/zinc/84/72/60/1032847260.db2.gz SWWYALJVDRVFDN-UHFFFAOYSA-N 1 1 320.383 3.542 20 10 DHCDMO CCC[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1ccccc1O ZINC000727830939 1019819714 /nfs/dbraw/zinc/81/97/14/1019819714.db2.gz WXFWZURRMREWEX-UHFFFAOYSA-N 1 1 313.397 3.576 20 10 DHCDMO CN1CCCc2cc(C[NH2+][C@@H]3CCCc4scnc43)ccc21 ZINC000858357466 1032861721 /nfs/dbraw/zinc/86/17/21/1032861721.db2.gz GPAHJYNFXCGDBS-OAHLLOKOSA-N 1 1 313.470 3.693 20 10 DHCDMO COc1ccnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000730378395 1019980031 /nfs/dbraw/zinc/98/00/31/1019980031.db2.gz CQKNYDBSROJOKD-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO CC[C@H]([NH2+]CCN1Cc2ccccc2C1)c1ccc(F)cc1O ZINC000796720900 1020045483 /nfs/dbraw/zinc/04/54/83/1020045483.db2.gz RXFPPJKEUFLATC-SFHVURJKSA-N 1 1 314.404 3.588 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc1C ZINC000922519857 1020112450 /nfs/dbraw/zinc/11/24/50/1020112450.db2.gz HOECCEGLSRGQJF-YJBOKZPZSA-N 1 1 301.361 3.570 20 10 DHCDMO O=C(C[N@H+](Cc1ccccc1O)C1CCCC1)Nc1ccccc1 ZINC000731845913 1020158346 /nfs/dbraw/zinc/15/83/46/1020158346.db2.gz NFOWYQOBQSGMBF-UHFFFAOYSA-N 1 1 324.424 3.776 20 10 DHCDMO CC[C@H](NCC[N@H+](C)C1CCCC1)c1ccc(N(C)C)cc1 ZINC000765799373 1020218740 /nfs/dbraw/zinc/21/87/40/1020218740.db2.gz HXGIUICQWSMAAP-IBGZPJMESA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@H](NCC[N@@H+](C)C1CCCC1)c1ccc(N(C)C)cc1 ZINC000765799373 1020218747 /nfs/dbraw/zinc/21/87/47/1020218747.db2.gz HXGIUICQWSMAAP-IBGZPJMESA-N 1 1 303.494 3.668 20 10 DHCDMO Cc1csc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CCC2)n1 ZINC000921646782 1020289905 /nfs/dbraw/zinc/28/99/05/1020289905.db2.gz VZHLXHAGDUTZHC-UHFFFAOYSA-N 1 1 314.454 3.946 20 10 DHCDMO C[NH+](C)[C@H](CNCc1c(O)cccc1Cl)C1CCCCC1 ZINC000733324412 1020370996 /nfs/dbraw/zinc/37/09/96/1020370996.db2.gz ACMNQMIWHBHYRS-MRXNPFEDSA-N 1 1 310.869 3.646 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cccc(Cl)c1[O-] ZINC000858490187 1032917990 /nfs/dbraw/zinc/91/79/90/1032917990.db2.gz CTVWVHZYGQTULU-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H]1CN1CCCCC1 ZINC000738098968 1020860377 /nfs/dbraw/zinc/86/03/77/1020860377.db2.gz MMOOKSJMHFIEDJ-SFHVURJKSA-N 1 1 324.468 3.996 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2c(C)noc2C)cc1 ZINC000177999658 1020886322 /nfs/dbraw/zinc/88/63/22/1020886322.db2.gz PBRFRIDYYVLYFX-UHFFFAOYSA-N 1 1 301.434 3.770 20 10 DHCDMO Cc1ncsc1CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000738877658 1020898112 /nfs/dbraw/zinc/89/81/12/1020898112.db2.gz SSFCXCYNGQRQSF-UHFFFAOYSA-N 1 1 315.486 3.725 20 10 DHCDMO CC[C@H](CNCc1ccc(N(CC)CC)c(F)c1)[NH+]1CCCC1 ZINC000740000422 1020923033 /nfs/dbraw/zinc/92/30/33/1020923033.db2.gz CBTQAPITPKCSCE-QGZVFWFLSA-N 1 1 321.484 3.636 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](N(C)C)[C@H]2C)ccc1N1CCCCC1 ZINC001171942402 1032947019 /nfs/dbraw/zinc/94/70/19/1032947019.db2.gz IKHOENBYLOZJTQ-XLIONFOSSA-N 1 1 315.505 3.510 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@H](N(C)C)[C@H]2C)ccc1N1CCCCC1 ZINC001171942402 1032947036 /nfs/dbraw/zinc/94/70/36/1032947036.db2.gz IKHOENBYLOZJTQ-XLIONFOSSA-N 1 1 315.505 3.510 20 10 DHCDMO C[C@@H](NCC[N@@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274068 1021035832 /nfs/dbraw/zinc/03/58/32/1021035832.db2.gz SKOGRQWVUOSVNP-QZTJIDSGSA-N 1 1 315.505 3.812 20 10 DHCDMO C[C@@H](NCC[N@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274068 1021035838 /nfs/dbraw/zinc/03/58/38/1021035838.db2.gz SKOGRQWVUOSVNP-QZTJIDSGSA-N 1 1 315.505 3.812 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc(OC)c(F)c2)cc1 ZINC000741752953 1021048881 /nfs/dbraw/zinc/04/88/81/1021048881.db2.gz KJIHSWCUXKRFET-UHFFFAOYSA-N 1 1 316.420 3.922 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000311042301 1021185549 /nfs/dbraw/zinc/18/55/49/1021185549.db2.gz GRVDBLUYEQNGSM-TXEJJXNPSA-N 1 1 310.235 3.777 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000311042301 1021185556 /nfs/dbraw/zinc/18/55/56/1021185556.db2.gz GRVDBLUYEQNGSM-TXEJJXNPSA-N 1 1 310.235 3.777 20 10 DHCDMO CN(C)c1cc(F)c(CNc2[nH]c3ccccc3[nH+]2)cc1F ZINC001202328776 1021218133 /nfs/dbraw/zinc/21/81/33/1021218133.db2.gz LRNZAVHKQRLDEG-UHFFFAOYSA-N 1 1 302.328 3.519 20 10 DHCDMO CCC[N@@H+](Cc1ccc(C)cc1)Cc1cc2c(cc1O)OCO2 ZINC000917454839 1021270808 /nfs/dbraw/zinc/27/08/08/1021270808.db2.gz OASQAAJZTDLZOX-UHFFFAOYSA-N 1 1 313.397 3.842 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@H](C)c2ccc(OC)cc2)c1O ZINC000125813826 1032986094 /nfs/dbraw/zinc/98/60/94/1032986094.db2.gz COADGSNDFXMKPL-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccc(OC)cc2)c1 ZINC000125832157 1032988535 /nfs/dbraw/zinc/98/85/35/1032988535.db2.gz OGAQDCLQHUMQPH-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@H]([NH2+][C@H]1COC(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000850481250 1021556419 /nfs/dbraw/zinc/55/64/19/1021556419.db2.gz FGYNIEKKNUQWGP-VHSXEESVSA-N 1 1 303.324 3.629 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc(F)cc1O ZINC000850531278 1021585111 /nfs/dbraw/zinc/58/51/11/1021585111.db2.gz IQUULFQYVPDOMX-KMFMINBZSA-N 1 1 315.388 3.755 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](O)C12CCC2)c1cc(Cl)c(Cl)cc1O ZINC000850548138 1021597665 /nfs/dbraw/zinc/59/76/65/1021597665.db2.gz ZEWGTIBVUZVZSG-MCCGJVOXSA-N 1 1 316.228 3.653 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@H]2CCCCO2)c(O)c(C(C)(C)C)c1 ZINC000918735343 1021637462 /nfs/dbraw/zinc/63/74/62/1021637462.db2.gz KGVSZZZRHCRODL-MRXNPFEDSA-N 1 1 305.462 3.999 20 10 DHCDMO CC(C)(C)OCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000109761030 1021744655 /nfs/dbraw/zinc/74/46/55/1021744655.db2.gz SUIVGUJEDHDWHJ-UHFFFAOYSA-N 1 1 303.402 3.803 20 10 DHCDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1ccccc1O ZINC000109772543 1021746680 /nfs/dbraw/zinc/74/66/80/1021746680.db2.gz PSEYZDZTLHQUNL-UHFFFAOYSA-N 1 1 306.203 3.787 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)c(OC)c1 ZINC000119650689 1021803577 /nfs/dbraw/zinc/80/35/77/1021803577.db2.gz SOUWGWIZSNYXTK-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1F)Cc1cc2c(cc1O)OCO2 ZINC000746038299 1021827855 /nfs/dbraw/zinc/82/78/55/1021827855.db2.gz NRNDRWHSSXCXJM-UHFFFAOYSA-N 1 1 317.360 3.672 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000746154125 1021876078 /nfs/dbraw/zinc/87/60/78/1021876078.db2.gz YXUNLJJOEHUXLP-LJQANCHMSA-N 1 1 302.462 3.676 20 10 DHCDMO CO[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000851716764 1021973454 /nfs/dbraw/zinc/97/34/54/1021973454.db2.gz QTZHRLYEYXVTRD-MOPGFXCFSA-N 1 1 302.462 3.676 20 10 DHCDMO Oc1ccccc1C[N@H+](CC=C(Cl)Cl)C[C@H]1CCCO1 ZINC000851841392 1022018674 /nfs/dbraw/zinc/01/86/74/1022018674.db2.gz QPMYRMRWXFNRFH-CYBMUJFWSA-N 1 1 316.228 3.692 20 10 DHCDMO Oc1ccccc1C[N@@H+](CC=C(Cl)Cl)C[C@H]1CCCO1 ZINC000851841392 1022018688 /nfs/dbraw/zinc/01/86/88/1022018688.db2.gz QPMYRMRWXFNRFH-CYBMUJFWSA-N 1 1 316.228 3.692 20 10 DHCDMO CCC[N@@H+](CCOc1ccccc1OC)Cc1ccccc1O ZINC000110735874 1022150290 /nfs/dbraw/zinc/15/02/90/1022150290.db2.gz SWBOWWWHZXSHCB-UHFFFAOYSA-N 1 1 315.413 3.692 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1[O-] ZINC000853239126 1022238954 /nfs/dbraw/zinc/23/89/54/1022238954.db2.gz AKDOHSUEZDQAOY-ZFWWWQNUSA-N 1 1 322.880 3.818 20 10 DHCDMO Cc1ccc(-c2cc(C[N@H+](C)Cc3ccccc3O)on2)cc1 ZINC000111236209 1022253366 /nfs/dbraw/zinc/25/33/66/1022253366.db2.gz VYRDWSKVBQXDMK-UHFFFAOYSA-N 1 1 308.381 3.988 20 10 DHCDMO Cc1nn(C)c(C)c1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000111245083 1022261916 /nfs/dbraw/zinc/26/19/16/1022261916.db2.gz 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ZINC000185165306 1022464950 /nfs/dbraw/zinc/46/49/50/1022464950.db2.gz XTGSGFBREIRZRX-CYBMUJFWSA-N 1 1 311.360 3.568 20 10 DHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2O)CCN1Cc1ccccc1 ZINC000179573356 1022469036 /nfs/dbraw/zinc/46/90/36/1022469036.db2.gz BUTSHQBQXOJHAN-FXAWDEMLSA-N 1 1 324.468 3.877 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1O ZINC001237680635 1022539122 /nfs/dbraw/zinc/53/91/22/1022539122.db2.gz FCUAEELFQKPGPR-GFCCVEGCSA-N 1 1 307.743 3.923 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC(F)(F)[C@H](F)C2)c1O ZINC001237680635 1022539133 /nfs/dbraw/zinc/53/91/33/1022539133.db2.gz FCUAEELFQKPGPR-GFCCVEGCSA-N 1 1 307.743 3.923 20 10 DHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000112961875 1022572696 /nfs/dbraw/zinc/57/26/96/1022572696.db2.gz UUHIEPGSANXURH-OAHLLOKOSA-N 1 1 305.462 3.857 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cc(F)ccc2O)ccc1SC ZINC000180014162 1022614612 /nfs/dbraw/zinc/61/46/12/1022614612.db2.gz VNPJTELROTXBHA-UHFFFAOYSA-N 1 1 321.417 3.894 20 10 DHCDMO Cc1cccc(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)c1O ZINC000180064392 1022629290 /nfs/dbraw/zinc/62/92/90/1022629290.db2.gz JOLBPDHQJHTWPC-UHFFFAOYSA-N 1 1 324.468 3.797 20 10 DHCDMO COc1cc(O)c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)cc1OC ZINC000180234878 1022668702 /nfs/dbraw/zinc/66/87/02/1022668702.db2.gz NKECJRYOZVQJFS-NFAWXSAZSA-N 1 1 305.418 3.562 20 10 DHCDMO Cc1cccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)c1O ZINC000180243173 1022674092 /nfs/dbraw/zinc/67/40/92/1022674092.db2.gz DWYJICUHKCHPKA-IBGZPJMESA-N 1 1 311.425 3.573 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c1O ZINC000180396245 1022718361 /nfs/dbraw/zinc/71/83/61/1022718361.db2.gz XVJGFOMCFXYUBV-KDOFPFPSSA-N 1 1 315.388 3.802 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(C(F)F)nc2)cc1 ZINC000876511483 1033084003 /nfs/dbraw/zinc/08/40/03/1033084003.db2.gz JXBADQJZULKEQV-UHFFFAOYSA-N 1 1 305.372 3.717 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)CC1CCSCC1 ZINC000876532047 1033084756 /nfs/dbraw/zinc/08/47/56/1033084756.db2.gz XJEFQYKLXYWUFM-KRWDZBQOSA-N 1 1 321.486 3.516 20 10 DHCDMO CC(C)[N@H+]1CCCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768136794 1022901856 /nfs/dbraw/zinc/90/18/56/1022901856.db2.gz BQBNCSILHXNSPX-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO CC(C)N1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768136794 1022901866 /nfs/dbraw/zinc/90/18/66/1022901866.db2.gz BQBNCSILHXNSPX-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO CC(C)N1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768136794 1022901871 /nfs/dbraw/zinc/90/18/71/1022901871.db2.gz BQBNCSILHXNSPX-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CC=CCC1 ZINC000768162058 1022907300 /nfs/dbraw/zinc/90/73/00/1022907300.db2.gz KGVAPDDWDAUUQL-AEFFLSMTSA-N 1 1 301.430 3.730 20 10 DHCDMO COCC[N@@H+](Cc1ccccc1)Cc1c(O)cccc1Cl ZINC000768159918 1022908561 /nfs/dbraw/zinc/90/85/61/1022908561.db2.gz IEZICZNNQLUHPS-UHFFFAOYSA-N 1 1 305.805 3.694 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCOc2cccc(C)c2)c(O)c1 ZINC000768212577 1022924377 /nfs/dbraw/zinc/92/43/77/1022924377.db2.gz LXJSUEGIUFYCMD-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CCCCCC1 ZINC000768215065 1022927212 /nfs/dbraw/zinc/92/72/12/1022927212.db2.gz WJBSDIUKTUZMSF-UHFFFAOYSA-N 1 1 302.462 3.678 20 10 DHCDMO COc1cccc(C[N@@H+](C)CCOc2ccccc2Cl)c1O ZINC000768213277 1022927998 /nfs/dbraw/zinc/92/79/98/1022927998.db2.gz PORGVPBTAMGYJF-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+](C)Cc2ccc(F)cc2F)c1 ZINC000768234153 1022930437 /nfs/dbraw/zinc/93/04/37/1022930437.db2.gz UBGLHIYTPGGHRP-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(F)cc2F)c1 ZINC000768234153 1022930447 /nfs/dbraw/zinc/93/04/47/1022930447.db2.gz UBGLHIYTPGGHRP-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccc3c2OCO3)C2CC2)cc1 ZINC000768257547 1022932124 /nfs/dbraw/zinc/93/21/24/1022932124.db2.gz LWWNKMOCFPWNJE-UHFFFAOYSA-N 1 1 324.424 3.646 20 10 DHCDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)c1 ZINC000857082992 1022946129 /nfs/dbraw/zinc/94/61/29/1022946129.db2.gz ZOWPWGBJQVFIJB-VIFPVBQESA-N 1 1 311.303 3.669 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2cccc(F)c2)C(C)C)c1O ZINC000768330562 1022948753 /nfs/dbraw/zinc/94/87/53/1022948753.db2.gz WKTWYAURIYZBFU-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCCC3)no1 ZINC000768442406 1022967664 /nfs/dbraw/zinc/96/76/64/1022967664.db2.gz UWSRTGKWXBWJMB-SFHVURJKSA-N 1 1 312.413 3.905 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2CC(C)(C)C)cc1OC ZINC000768446474 1022968288 /nfs/dbraw/zinc/96/82/88/1022968288.db2.gz YBAUGSLTNMETBD-AWEZNQCLSA-N 1 1 307.434 3.810 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc(F)cc2F)c(O)cc1C ZINC000768440882 1022968992 /nfs/dbraw/zinc/96/89/92/1022968992.db2.gz HJDCUWXJPBCFHJ-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2CCC(C)C)cc1OC ZINC000768463419 1022972329 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CCOc1cccc(C[N@@H+](Cc2ccccn2)C(C)C)c1O ZINC000768926937 1023058050 /nfs/dbraw/zinc/05/80/50/1023058050.db2.gz UDFWNYMREXVPEO-UHFFFAOYSA-N 1 1 300.402 3.597 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCc2ccc(F)cc2)c(O)c1 ZINC000768919990 1023058324 /nfs/dbraw/zinc/05/83/24/1023058324.db2.gz CWMXDAMHOUGYEJ-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](SC)C2)c1 ZINC000756589262 1023087453 /nfs/dbraw/zinc/08/74/53/1023087453.db2.gz LDPKMTXIPYDSKC-IACUBPJLSA-N 1 1 323.458 3.504 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccccc1C(=O)OC ZINC000769200646 1023101757 /nfs/dbraw/zinc/10/17/57/1023101757.db2.gz FUKKVLNNQXZTCV-UHFFFAOYSA-N 1 1 313.397 3.591 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c1 ZINC000769244760 1023107987 /nfs/dbraw/zinc/10/79/87/1023107987.db2.gz ORGZKVYQURJIIV-ICSRJNTNSA-N 1 1 311.425 3.789 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](N3CCCCC3)C2)cc1 ZINC000769330515 1023124541 /nfs/dbraw/zinc/12/45/41/1023124541.db2.gz OPPXUXVKIGPMHA-FQEVSTJZSA-N 1 1 315.505 3.593 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](N3CCCCC3)C2)cc1 ZINC000769330515 1023124547 /nfs/dbraw/zinc/12/45/47/1023124547.db2.gz OPPXUXVKIGPMHA-FQEVSTJZSA-N 1 1 315.505 3.593 20 10 DHCDMO COc1cc(Cl)c(C[N@@H+](C)Cc2ccccc2O)cc1OC ZINC000876615646 1033107375 /nfs/dbraw/zinc/10/73/75/1033107375.db2.gz JYFLOCRLQQDWSW-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(O)c1 ZINC000769381035 1023135468 /nfs/dbraw/zinc/13/54/68/1023135468.db2.gz ZWAUJFYMQXUDAQ-CQSZACIVSA-N 1 1 315.388 3.920 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000769390561 1023139762 /nfs/dbraw/zinc/13/97/62/1023139762.db2.gz YXYBJDZXSKXZIK-NSHDSACASA-N 1 1 322.202 3.737 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000769390561 1023139766 /nfs/dbraw/zinc/13/97/66/1023139766.db2.gz YXYBJDZXSKXZIK-NSHDSACASA-N 1 1 322.202 3.737 20 10 DHCDMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000769402603 1023141273 /nfs/dbraw/zinc/14/12/73/1023141273.db2.gz MTFYRGZSELZHFS-KRWDZBQOSA-N 1 1 320.452 3.530 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)Cc2cn[nH]c2)cc1 ZINC000769426693 1023146838 /nfs/dbraw/zinc/14/68/38/1023146838.db2.gz VXHXZLGSMQGVFO-UHFFFAOYSA-N 1 1 300.450 3.668 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000769447597 1023156505 /nfs/dbraw/zinc/15/65/05/1023156505.db2.gz YOBPFWIPCAHIAD-FQEVSTJZSA-N 1 1 310.441 3.635 20 10 DHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC000769499818 1023168608 /nfs/dbraw/zinc/16/86/08/1023168608.db2.gz WCZGISHTWAISBU-HXUWFJFHSA-N 1 1 312.457 3.526 20 10 DHCDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc(N(C)C)c(F)c1 ZINC000769518132 1023172209 /nfs/dbraw/zinc/17/22/09/1023172209.db2.gz VJBPOZXKZWXUJR-UHFFFAOYSA-N 1 1 321.465 3.801 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)cc1F ZINC000769538080 1023175458 /nfs/dbraw/zinc/17/54/58/1023175458.db2.gz RGGFTNWLOGNVJF-IBGZPJMESA-N 1 1 315.436 3.957 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCO[C@H]2CCCCO2)cc1 ZINC000769695480 1023195513 /nfs/dbraw/zinc/19/55/13/1023195513.db2.gz GHJUTUCSQCSUBR-IBGZPJMESA-N 1 1 320.477 3.508 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000770286006 1023291590 /nfs/dbraw/zinc/29/15/90/1023291590.db2.gz NLTRIMPAFZFVSY-ICSRJNTNSA-N 1 1 314.473 3.678 20 10 DHCDMO CCOc1ccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c(O)c1 ZINC000770353568 1023304744 /nfs/dbraw/zinc/30/47/44/1023304744.db2.gz CZHBOAFSXBIHMW-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c(O)c1 ZINC000770353568 1023304748 /nfs/dbraw/zinc/30/47/48/1023304748.db2.gz CZHBOAFSXBIHMW-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCc2c(Br)cccc2C1 ZINC000770510674 1023316706 /nfs/dbraw/zinc/31/67/06/1023316706.db2.gz PHRLTXXVOLHURJ-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000771170862 1023406225 /nfs/dbraw/zinc/40/62/25/1023406225.db2.gz LSIRXHKABAHKMN-UHFFFAOYSA-N 1 1 308.356 3.638 20 10 DHCDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876743585 1033131740 /nfs/dbraw/zinc/13/17/40/1033131740.db2.gz JHNURRUZYHZGKW-FQEVSTJZSA-N 1 1 316.489 3.660 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1nccs1 ZINC000093399224 1023714590 /nfs/dbraw/zinc/71/45/90/1023714590.db2.gz HEYUVRJJVDXHJV-ZDUSSCGKSA-N 1 1 319.499 3.547 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1nccs1 ZINC000093399225 1023715198 /nfs/dbraw/zinc/71/51/98/1023715198.db2.gz HEYUVRJJVDXHJV-CYBMUJFWSA-N 1 1 319.499 3.547 20 10 DHCDMO Cc1cc(C)c([C@H](C)NCC[N@H+](C)C2CCCCC2)c(O)c1 ZINC000788562200 1023905319 /nfs/dbraw/zinc/90/53/19/1023905319.db2.gz GFYUWVPHERAZRC-INIZCTEOSA-N 1 1 304.478 3.924 20 10 DHCDMO Cc1cc(C)c([C@H](C)NCC[N@@H+](C)C2CCCCC2)c(O)c1 ZINC000788562200 1023905322 /nfs/dbraw/zinc/90/53/22/1023905322.db2.gz GFYUWVPHERAZRC-INIZCTEOSA-N 1 1 304.478 3.924 20 10 DHCDMO CCC(O)(CC)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788572136 1023909302 /nfs/dbraw/zinc/90/93/02/1023909302.db2.gz MCFAEXPPHIJCMH-JTQLQIEISA-N 1 1 305.340 3.613 20 10 DHCDMO CO[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788607732 1023913111 /nfs/dbraw/zinc/91/31/11/1023913111.db2.gz CFRNANOFVQWBSG-GWCFXTLKSA-N 1 1 305.340 3.733 20 10 DHCDMO CCOC(C)(C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788758362 1023930285 /nfs/dbraw/zinc/93/02/85/1023930285.db2.gz PFQMHENRZMMSQP-JTQLQIEISA-N 1 1 305.340 3.877 20 10 DHCDMO CC(C)[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000788773610 1023937493 /nfs/dbraw/zinc/93/74/93/1023937493.db2.gz CALPBKFBUIQTGH-HZMBPMFUSA-N 1 1 319.367 3.857 20 10 DHCDMO C[C@H]([NH2+]CCCOC(F)F)c1cccc(C(F)(F)F)c1O ZINC000788820256 1023941308 /nfs/dbraw/zinc/94/13/08/1023941308.db2.gz UBACDYUVODBNIA-QMMMGPOBSA-N 1 1 313.266 3.691 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(c3ccccc3F)C[C@@H]2C)c1O ZINC000789590004 1024122519 /nfs/dbraw/zinc/12/25/19/1024122519.db2.gz OWAZNHCJOXNBAZ-HNNXBMFYSA-N 1 1 314.404 3.550 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nc(C(C)C)c[nH]2)cc1F ZINC000882989993 1024197928 /nfs/dbraw/zinc/19/79/28/1024197928.db2.gz QULGMFPMRVAKDC-UHFFFAOYSA-N 1 1 318.440 3.808 20 10 DHCDMO C[C@@H]([NH2+]Cc1nccn1C)c1ccc(N2CCCCCC2)cc1 ZINC000268956037 1024203648 /nfs/dbraw/zinc/20/36/48/1024203648.db2.gz YQXXQXQUTLIPDH-MRXNPFEDSA-N 1 1 312.461 3.651 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000883082165 1024234105 /nfs/dbraw/zinc/23/41/05/1024234105.db2.gz YRDFZKNFPDAAKE-DYVFJYSZSA-N 1 1 319.351 3.538 20 10 DHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000131022132 1024248456 /nfs/dbraw/zinc/24/84/56/1024248456.db2.gz KZRUBLAAGLUGAG-SNVBAGLBSA-N 1 1 310.191 3.941 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000883186850 1024275839 /nfs/dbraw/zinc/27/58/39/1024275839.db2.gz AKGREEYZTNSCIO-INIZCTEOSA-N 1 1 304.340 3.696 20 10 DHCDMO COc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c(OC)c1 ZINC000883189129 1024277409 /nfs/dbraw/zinc/27/74/09/1024277409.db2.gz YVJIWGBSSCCVIZ-JTQLQIEISA-N 1 1 323.339 3.538 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]C2(c3ncccn3)CCC2)c2c1c(F)ccc2O ZINC000883311626 1024364315 /nfs/dbraw/zinc/36/43/15/1024364315.db2.gz HENKAAOEXAOKJZ-AAEUAGOBSA-N 1 1 313.376 3.539 20 10 DHCDMO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Cl)cc1O ZINC000883311853 1024364646 /nfs/dbraw/zinc/36/46/46/1024364646.db2.gz MODNVIALGCRQDK-LLVKDONJSA-N 1 1 303.793 3.566 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cc(F)cc(F)c1 ZINC000790954972 1024405121 /nfs/dbraw/zinc/40/51/21/1024405121.db2.gz IOLHRCQBFALTDR-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO CCOc1ccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790956886 1024405332 /nfs/dbraw/zinc/40/53/32/1024405332.db2.gz VUAMWCUIRUHPMD-UHFFFAOYSA-N 1 1 309.768 3.873 20 10 DHCDMO C[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)Oc1ccccc1 ZINC000790965366 1024407124 /nfs/dbraw/zinc/40/71/24/1024407124.db2.gz IDAJSEDNSZZEBG-NSHDSACASA-N 1 1 309.768 3.742 20 10 DHCDMO CC(C)n1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000271041861 1024448061 /nfs/dbraw/zinc/44/80/61/1024448061.db2.gz JGJRBFKLWYWYEA-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CCCC[N@H+](Cc1cn(C(C)(C)C)nn1)Cc1ccccc1O ZINC000283105707 1024591617 /nfs/dbraw/zinc/59/16/17/1024591617.db2.gz TZTFCCJGNGTETJ-UHFFFAOYSA-N 1 1 316.449 3.541 20 10 DHCDMO CCCC[N@@H+](Cc1cn(C(C)(C)C)nn1)Cc1ccccc1O ZINC000283105707 1024591627 /nfs/dbraw/zinc/59/16/27/1024591627.db2.gz TZTFCCJGNGTETJ-UHFFFAOYSA-N 1 1 316.449 3.541 20 10 DHCDMO CCCC[N@H+](C)C[C@@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC001202619198 1024624210 /nfs/dbraw/zinc/62/42/10/1024624210.db2.gz PZXIKMAWMLJQRX-GOSISDBHSA-N 1 1 317.521 3.887 20 10 DHCDMO CCCC[N@@H+](C)C[C@@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC001202619198 1024624215 /nfs/dbraw/zinc/62/42/15/1024624215.db2.gz PZXIKMAWMLJQRX-GOSISDBHSA-N 1 1 317.521 3.887 20 10 DHCDMO COC1CCC([N@H+](C)Cc2c(O)ccc(Cl)c2F)CC1 ZINC000792166964 1024642176 /nfs/dbraw/zinc/64/21/76/1024642176.db2.gz WXQUJJGRQPUVIC-UHFFFAOYSA-N 1 1 301.789 3.574 20 10 DHCDMO COC1CCC([N@@H+](C)Cc2c(O)ccc(Cl)c2F)CC1 ZINC000792166964 1024642179 /nfs/dbraw/zinc/64/21/79/1024642179.db2.gz WXQUJJGRQPUVIC-UHFFFAOYSA-N 1 1 301.789 3.574 20 10 DHCDMO CCn1ccc(C[N@@H+](C)Cc2cc(Cl)cc(OC)c2O)c1 ZINC000792182332 1024644099 /nfs/dbraw/zinc/64/40/99/1024644099.db2.gz CDIYYQDZQOVKCO-UHFFFAOYSA-N 1 1 308.809 3.508 20 10 DHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3cc(C)ccc3O)CCO2)cc1 ZINC000792191389 1024646055 /nfs/dbraw/zinc/64/60/55/1024646055.db2.gz ZNAYRFFCXCAOFF-HXUWFJFHSA-N 1 1 311.425 3.837 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000689884966 1024696533 /nfs/dbraw/zinc/69/65/33/1024696533.db2.gz YEXPAWWJPFGTBO-NSHDSACASA-N 1 1 316.214 3.726 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(F)ccc1O)c1nc(C(F)(F)F)cs1 ZINC000279116088 1024744912 /nfs/dbraw/zinc/74/49/12/1024744912.db2.gz WNIFPTBUIRTCRK-ZETCQYMHSA-N 1 1 320.311 3.857 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccnc1OC(C)C)c1ccc(F)cc1O ZINC000796696840 1024765461 /nfs/dbraw/zinc/76/54/61/1024765461.db2.gz UNTCLZWIWMXCKS-INIZCTEOSA-N 1 1 318.392 3.954 20 10 DHCDMO C[C@H]1COCCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000772822691 1024838195 /nfs/dbraw/zinc/83/81/95/1024838195.db2.gz INKSTJICSJGXIB-ZDUSSCGKSA-N 1 1 315.413 3.628 20 10 DHCDMO c1cc2c(cc1CN[C@H]1CC[N@H+](C3CCCCC3)C1)CCCO2 ZINC001203181282 1033240643 /nfs/dbraw/zinc/24/06/43/1033240643.db2.gz SIFPMLZOCKHZLG-SFHVURJKSA-N 1 1 314.473 3.508 20 10 DHCDMO c1cc2c(cc1C[NH2+][C@H]1CCN(C3CCCCC3)C1)CCCO2 ZINC001203181282 1033240653 /nfs/dbraw/zinc/24/06/53/1033240653.db2.gz SIFPMLZOCKHZLG-SFHVURJKSA-N 1 1 314.473 3.508 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccnc2)c(C(F)(F)F)c1 ZINC000793062269 1024874097 /nfs/dbraw/zinc/87/40/97/1024874097.db2.gz QARHALIXSRVLQA-UHFFFAOYSA-N 1 1 323.362 3.798 20 10 DHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000793216382 1024938229 /nfs/dbraw/zinc/93/82/29/1024938229.db2.gz FLRUNDTVFOOFER-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc2ccccc2nc1OC ZINC001137206946 1024984754 /nfs/dbraw/zinc/98/47/54/1024984754.db2.gz RYPHJRPSQVRSGG-UHFFFAOYSA-N 1 1 322.408 3.971 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000793370739 1025010628 /nfs/dbraw/zinc/01/06/28/1025010628.db2.gz QXDUGPVTISIXGP-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000793370739 1025010638 /nfs/dbraw/zinc/01/06/38/1025010638.db2.gz QXDUGPVTISIXGP-CYBMUJFWSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cccc(C)c2C)cc1OC ZINC000793542769 1025085789 /nfs/dbraw/zinc/08/57/89/1025085789.db2.gz LGQCGDQIRRNRSZ-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)cc1F ZINC000793609661 1025129577 /nfs/dbraw/zinc/12/95/77/1025129577.db2.gz QYFIXSSLUXFPAN-MOPGFXCFSA-N 1 1 320.452 3.815 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)cc1 ZINC000108091153 1025325780 /nfs/dbraw/zinc/32/57/80/1025325780.db2.gz FDPPMTJVFPSLRK-UHFFFAOYSA-N 1 1 302.462 3.788 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000893995483 1025638760 /nfs/dbraw/zinc/63/87/60/1025638760.db2.gz LWLBQVFRGHZCBY-KRWDZBQOSA-N 1 1 319.351 3.634 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000893995483 1025638775 /nfs/dbraw/zinc/63/87/75/1025638775.db2.gz LWLBQVFRGHZCBY-KRWDZBQOSA-N 1 1 319.351 3.634 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1c(O)cccc1F ZINC000886490060 1025649690 /nfs/dbraw/zinc/64/96/90/1025649690.db2.gz YMDFTIMDBZAAAP-AAEUAGOBSA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886542981 1025690588 /nfs/dbraw/zinc/69/05/88/1025690588.db2.gz ITMYBZHDPDREDI-XNJGSVPQSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610906 1025736696 /nfs/dbraw/zinc/73/66/96/1025736696.db2.gz MXLKBJCPZGVJEJ-DGCLKSJQSA-N 1 1 323.795 3.611 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1OCCc2sccc21)c1c(O)cccc1F ZINC000886613936 1025739573 /nfs/dbraw/zinc/73/95/73/1025739573.db2.gz ISZRCJNGUAALGW-DINDLPBHSA-N 1 1 321.417 3.946 20 10 DHCDMO CC(C)[C@@H](CO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000806170036 1025798020 /nfs/dbraw/zinc/79/80/20/1025798020.db2.gz VTBJXOGRRDWUAV-VHSXEESVSA-N 1 1 306.233 3.614 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)cc1O ZINC000806179761 1025834052 /nfs/dbraw/zinc/83/40/52/1025834052.db2.gz GZVAGKISXPYGTR-PRHODGIISA-N 1 1 320.177 3.993 20 10 DHCDMO CC[C@@H]([NH2+]CCCc1c(C)nn(C)c1C)c1ccc(F)cc1O ZINC000796857081 1025867839 /nfs/dbraw/zinc/86/78/39/1025867839.db2.gz YVYPXRNRQZYITP-QGZVFWFLSA-N 1 1 319.424 3.555 20 10 DHCDMO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000924873815 1026015452 /nfs/dbraw/zinc/01/54/52/1026015452.db2.gz YWTGUZZZEAFGKF-MRXNPFEDSA-N 1 1 311.429 3.533 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2F)cc1 ZINC001137941530 1026045799 /nfs/dbraw/zinc/04/57/99/1026045799.db2.gz VBTUZANXSDPIJT-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2F)cc1 ZINC001137941530 1026045812 /nfs/dbraw/zinc/04/58/12/1026045812.db2.gz VBTUZANXSDPIJT-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO CC[C@@H]([NH2+]Cc1csc(COC)n1)c1ccc(N(C)C)cc1 ZINC000289645539 1026111514 /nfs/dbraw/zinc/11/15/14/1026111514.db2.gz FYUKRMNTXHBWEN-MRXNPFEDSA-N 1 1 319.474 3.596 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000245717939 1026160216 /nfs/dbraw/zinc/16/02/16/1026160216.db2.gz HJIQAJRQSCZMRF-SUMWQHHRSA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@H]23)c1O ZINC000808677016 1026356822 /nfs/dbraw/zinc/35/68/22/1026356822.db2.gz OJTQJXRNPUXSGM-VBNZEHGJSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1O ZINC000808677016 1026356836 /nfs/dbraw/zinc/35/68/36/1026356836.db2.gz OJTQJXRNPUXSGM-VBNZEHGJSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c1[O-] ZINC000808715474 1026362398 /nfs/dbraw/zinc/36/23/98/1026362398.db2.gz FWDVHOJDUHFAEJ-ZDUSSCGKSA-N 1 1 322.880 3.879 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccn(C)c2)Cc2ccco2)cc1 ZINC000809731029 1026597085 /nfs/dbraw/zinc/59/70/85/1026597085.db2.gz AGWCTYGFFUCPQN-UHFFFAOYSA-N 1 1 323.440 3.887 20 10 DHCDMO COc1cccc(O)c1C[N@H+](Cc1ccc(O)cc1)CC1CC1 ZINC000809737382 1026609704 /nfs/dbraw/zinc/60/97/04/1026609704.db2.gz GTZGHXIFSJVJFQ-UHFFFAOYSA-N 1 1 313.397 3.519 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1F ZINC000809758489 1026617743 /nfs/dbraw/zinc/61/77/43/1026617743.db2.gz OGPIRNWUKUIANZ-RDJZCZTQSA-N 1 1 320.452 3.530 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@]2(C)CCCO)cc1 ZINC000809757951 1026618046 /nfs/dbraw/zinc/61/80/46/1026618046.db2.gz XBSMTYDRDPQTQE-LJQANCHMSA-N 1 1 304.478 3.660 20 10 DHCDMO CCCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CCC1 ZINC000809766117 1026619847 /nfs/dbraw/zinc/61/98/47/1026619847.db2.gz VGVDCXDKIGGDQC-CQSZACIVSA-N 1 1 322.405 3.758 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000811512288 1027026468 /nfs/dbraw/zinc/02/64/68/1027026468.db2.gz KHKVXZVDTTWEPV-HXUWFJFHSA-N 1 1 309.409 3.670 20 10 DHCDMO COc1ccc(O)c(CNc2c(C)c[nH+]c3c(OC)cccc23)c1 ZINC000811805865 1027087713 /nfs/dbraw/zinc/08/77/13/1027087713.db2.gz DSEAETRIMKNVAZ-UHFFFAOYSA-N 1 1 324.380 3.878 20 10 DHCDMO COc1cccc2c(NCCc3ccc(O)c(O)c3)cc(C)[nH+]c12 ZINC000811810875 1027090325 /nfs/dbraw/zinc/09/03/25/1027090325.db2.gz GZFYSFCBWUOCCH-UHFFFAOYSA-N 1 1 324.380 3.618 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc(F)cc1O ZINC000296595198 1027680609 /nfs/dbraw/zinc/68/06/09/1027680609.db2.gz VFSHTJNLRNNZKV-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@H]1C[C@@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000778984772 1027710962 /nfs/dbraw/zinc/71/09/62/1027710962.db2.gz KIECYALTLWMBOT-HKUYNNGSSA-N 1 1 316.489 3.924 20 10 DHCDMO C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(N2CCCCCC2)cc1 ZINC000813877530 1027747296 /nfs/dbraw/zinc/74/72/96/1027747296.db2.gz YSYGEIZFKKYOMK-ZWKOTPCHSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000813877530 1027747317 /nfs/dbraw/zinc/74/73/17/1027747317.db2.gz YSYGEIZFKKYOMK-ZWKOTPCHSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1noc(-c2ccccc2)n1 ZINC000296986525 1027771328 /nfs/dbraw/zinc/77/13/28/1027771328.db2.gz SDGNWKQZRQXKCM-WFASDCNBSA-N 1 1 321.380 3.780 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC000779028827 1027925747 /nfs/dbraw/zinc/92/57/47/1027925747.db2.gz BOPODFDJZWZPJX-AWEZNQCLSA-N 1 1 321.779 3.838 20 10 DHCDMO Cn1c2cc(F)ccc2[nH+]c1NCCCSc1nccs1 ZINC000814256620 1027971768 /nfs/dbraw/zinc/97/17/68/1027971768.db2.gz KBWQGWQSJRVNKQ-UHFFFAOYSA-N 1 1 322.434 3.763 20 10 DHCDMO C[C@H]([NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000528006716 1028032237 /nfs/dbraw/zinc/03/22/37/1028032237.db2.gz NRKYHXMRXUQDJI-VITBEWHZSA-N 1 1 317.351 3.874 20 10 DHCDMO CCOc1ccc(O)c(C[NH2+][C@H]2COc3cccc(Cl)c32)c1 ZINC000367386104 1028177973 /nfs/dbraw/zinc/17/79/73/1028177973.db2.gz OXHBZQRYULOSJI-AWEZNQCLSA-N 1 1 319.788 3.668 20 10 DHCDMO COc1cc(C[N@@H+](Cc2cccs2)C2CC2)c(O)cc1C ZINC000159753494 1028211095 /nfs/dbraw/zinc/21/10/95/1028211095.db2.gz DMRCHHVWVVPSCL-UHFFFAOYSA-N 1 1 303.427 3.935 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000815042435 1028343851 /nfs/dbraw/zinc/34/38/51/1028343851.db2.gz PQFOAMGKOFHWMB-SFHVURJKSA-N 1 1 304.478 3.842 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)ccc1N(C)C ZINC000815063198 1028345571 /nfs/dbraw/zinc/34/55/71/1028345571.db2.gz WXHQEDWOWIOQHN-QGZVFWFLSA-N 1 1 316.470 3.696 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3cccs3)C2)ccc1N(C)C ZINC000815063198 1028345586 /nfs/dbraw/zinc/34/55/86/1028345586.db2.gz WXHQEDWOWIOQHN-QGZVFWFLSA-N 1 1 316.470 3.696 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)no2)cc1 ZINC000815116908 1028360969 /nfs/dbraw/zinc/36/09/69/1028360969.db2.gz FSOBFXBKWCVHCN-QGZVFWFLSA-N 1 1 314.433 3.561 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)no2)cc1 ZINC000815116908 1028360990 /nfs/dbraw/zinc/36/09/90/1028360990.db2.gz FSOBFXBKWCVHCN-QGZVFWFLSA-N 1 1 314.433 3.561 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)no2)cc1 ZINC000815116907 1028363343 /nfs/dbraw/zinc/36/33/43/1028363343.db2.gz FSOBFXBKWCVHCN-KRWDZBQOSA-N 1 1 314.433 3.561 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)no2)cc1 ZINC000815116907 1028363357 /nfs/dbraw/zinc/36/33/57/1028363357.db2.gz FSOBFXBKWCVHCN-KRWDZBQOSA-N 1 1 314.433 3.561 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc(F)c2[O-])o1 ZINC000368658240 1028391252 /nfs/dbraw/zinc/39/12/52/1028391252.db2.gz HUAVQJQBNKXVMX-OAHLLOKOSA-N 1 1 305.349 3.608 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(F)c2O)o1 ZINC000368658240 1028391263 /nfs/dbraw/zinc/39/12/63/1028391263.db2.gz HUAVQJQBNKXVMX-OAHLLOKOSA-N 1 1 305.349 3.608 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc(F)c2O)o1 ZINC000368658240 1028391273 /nfs/dbraw/zinc/39/12/73/1028391273.db2.gz HUAVQJQBNKXVMX-OAHLLOKOSA-N 1 1 305.349 3.608 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000368795113 1028410623 /nfs/dbraw/zinc/41/06/23/1028410623.db2.gz DZCLNDOPFZVMGE-ZBFHGGJFSA-N 1 1 312.413 3.648 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000368795112 1028411685 /nfs/dbraw/zinc/41/16/85/1028411685.db2.gz DZCLNDOPFZVMGE-HOCLYGCPSA-N 1 1 312.413 3.648 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815582880 1028554494 /nfs/dbraw/zinc/55/44/94/1028554494.db2.gz RMMXGNLQWRSIGJ-COPLHBTASA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583713 1028556125 /nfs/dbraw/zinc/55/61/25/1028556125.db2.gz MRVSTXXVFPPALT-SRVKXCTJSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583713 1028556139 /nfs/dbraw/zinc/55/61/39/1028556139.db2.gz MRVSTXXVFPPALT-SRVKXCTJSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+]C1CCSCC1)c1cccc(C(F)(F)F)c1O ZINC000815591996 1028558730 /nfs/dbraw/zinc/55/87/30/1028558730.db2.gz WAXYQRDNBSGLBU-VIFPVBQESA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000815614212 1028569164 /nfs/dbraw/zinc/56/91/64/1028569164.db2.gz JHABICMMLIQEEI-SDDRHHMPSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCOC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625618 1028577421 /nfs/dbraw/zinc/57/74/21/1028577421.db2.gz ICPFPSPSSQCKRT-SDDRHHMPSA-N 1 1 317.351 3.734 20 10 DHCDMO C[C@@H]([NH2+]CCOC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000815606854 1028582141 /nfs/dbraw/zinc/58/21/41/1028582141.db2.gz ISSBJPGUDRNXHA-SNVBAGLBSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000815647582 1028592518 /nfs/dbraw/zinc/59/25/18/1028592518.db2.gz OPICTHNHAMMPLK-CQSZACIVSA-N 1 1 310.869 3.962 20 10 DHCDMO Oc1c(C[NH+]2CCN(C3CCCC3)CC2)ccc2ccccc21 ZINC000816483782 1028891459 /nfs/dbraw/zinc/89/14/59/1028891459.db2.gz DSVVXXCEKONBCX-UHFFFAOYSA-N 1 1 310.441 3.606 20 10 DHCDMO COC(=O)CC[N@H+](Cc1ccc2ccccc2c1O)CC(C)C ZINC000816492278 1028896190 /nfs/dbraw/zinc/89/61/90/1028896190.db2.gz NOSILJFNCOBFQC-UHFFFAOYSA-N 1 1 315.413 3.567 20 10 DHCDMO CC[C@@]1(C)C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCO1 ZINC000190343897 1028903160 /nfs/dbraw/zinc/90/31/60/1028903160.db2.gz QFURPWHYBWGSLA-IBGZPJMESA-N 1 1 315.413 3.555 20 10 DHCDMO CCC[NH+]1CCC(C[NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000816548917 1028929514 /nfs/dbraw/zinc/92/95/14/1028929514.db2.gz XKUXWLMSCFCOQO-UHFFFAOYSA-N 1 1 312.457 3.757 20 10 DHCDMO CCO[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C12CCC2 ZINC000816552031 1028937380 /nfs/dbraw/zinc/93/73/80/1028937380.db2.gz YXFWYBIXCBXUHH-CABCVRRESA-N 1 1 313.800 3.622 20 10 DHCDMO COCC[N@@H+](Cc1cccnc1)Cc1ccc2ccccc2c1O ZINC000816610805 1028960848 /nfs/dbraw/zinc/96/08/48/1028960848.db2.gz ZGDUJTATHNBUEA-UHFFFAOYSA-N 1 1 322.408 3.589 20 10 DHCDMO CCOc1ccc(C[N@H+](C)Cc2c(F)cccc2F)c(O)c1 ZINC000816652112 1028975315 /nfs/dbraw/zinc/97/53/15/1028975315.db2.gz ZQVXULBFBXDHAT-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2c(F)cccc2F)c(O)c1 ZINC000816652112 1028975321 /nfs/dbraw/zinc/97/53/21/1028975321.db2.gz ZQVXULBFBXDHAT-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Oc1c(C[N@H+]2CC3(CCOCC3)[C@H]2C2CC2)ccc2ccccc21 ZINC000816656307 1028980640 /nfs/dbraw/zinc/98/06/40/1028980640.db2.gz NIHZCQSAOXOCEB-HXUWFJFHSA-N 1 1 323.436 3.936 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CC12CCSCC2 ZINC000817411757 1029153382 /nfs/dbraw/zinc/15/33/82/1029153382.db2.gz VRBIRTOKQJHVMN-LLVKDONJSA-N 1 1 315.841 3.808 20 10 DHCDMO CC[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1[O-] ZINC000817587610 1029216836 /nfs/dbraw/zinc/21/68/36/1029216836.db2.gz ZKPXSOGUDSXMRW-ZBCRRDGASA-N 1 1 310.869 3.959 20 10 DHCDMO C[C@@H]1C[C@H](NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c2ccccc21 ZINC000817939502 1029281234 /nfs/dbraw/zinc/28/12/34/1029281234.db2.gz BXAWYCGDTJCNOE-UAOJZALGSA-N 1 1 309.457 3.591 20 10 DHCDMO CCc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938618 1029281536 /nfs/dbraw/zinc/28/15/36/1029281536.db2.gz OMGHHVTXLJIEOJ-CXAGYDPISA-N 1 1 317.502 3.727 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCC[C@H]2c2nccs2)c(O)c1 ZINC000374302966 1029281621 /nfs/dbraw/zinc/28/16/21/1029281621.db2.gz REJLYOLNHGMKPA-HNNXBMFYSA-N 1 1 318.442 3.975 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC[C@H]2c2nccs2)c(O)c1 ZINC000374302966 1029281637 /nfs/dbraw/zinc/28/16/37/1029281637.db2.gz REJLYOLNHGMKPA-HNNXBMFYSA-N 1 1 318.442 3.975 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1Cl ZINC000817939016 1029285343 /nfs/dbraw/zinc/28/53/43/1029285343.db2.gz XPOYKPQSCXNHRE-ACJLOTCBSA-N 1 1 317.864 3.757 20 10 DHCDMO CCCC[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963933 1029301854 /nfs/dbraw/zinc/30/18/54/1029301854.db2.gz YRMBQDGTGRKKHN-VHSXEESVSA-N 1 1 305.249 3.867 20 10 DHCDMO C[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817964779 1029302069 /nfs/dbraw/zinc/30/20/69/1029302069.db2.gz IHNYTJQMJNSEOA-XLIONFOSSA-N 1 1 315.505 3.717 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(F)cc1O ZINC000817975330 1029313004 /nfs/dbraw/zinc/31/30/04/1029313004.db2.gz LACJEBXBRGPWBC-LBPRGKRZSA-N 1 1 300.377 3.740 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817980391 1029316161 /nfs/dbraw/zinc/31/61/61/1029316161.db2.gz ALWSEEDHXFKREE-QKCSRTOESA-N 1 1 316.367 3.579 20 10 DHCDMO C[C@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817982908 1029319922 /nfs/dbraw/zinc/31/99/22/1029319922.db2.gz WCEHCHUCHZPCBM-IINYFYTJSA-N 1 1 316.367 3.579 20 10 DHCDMO CN(C)c1ccc(C[NH+]2CC(CC(F)F)C2)c(C(F)(F)F)c1 ZINC000822520558 1030042105 /nfs/dbraw/zinc/04/21/05/1030042105.db2.gz GOWCJXADVFBZAC-UHFFFAOYSA-N 1 1 322.321 3.858 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@](C)(O)c1ccccc1 ZINC000822516579 1030055153 /nfs/dbraw/zinc/05/51/53/1030055153.db2.gz MSHSMNVSULQLRC-KRWDZBQOSA-N 1 1 323.795 3.524 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@](C)(O)c1ccccc1 ZINC000822516579 1030055170 /nfs/dbraw/zinc/05/51/70/1030055170.db2.gz MSHSMNVSULQLRC-KRWDZBQOSA-N 1 1 323.795 3.524 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823458889 1030293363 /nfs/dbraw/zinc/29/33/63/1030293363.db2.gz JHEGJAAOVJTCBM-QGZVFWFLSA-N 1 1 316.470 3.605 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1cc(F)ccc1O ZINC000291084653 1030330566 /nfs/dbraw/zinc/33/05/66/1030330566.db2.gz OFOLDWUHYVFBLH-UHFFFAOYSA-N 1 1 304.365 3.508 20 10 DHCDMO CC[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCOC1)c1ccc(F)cc1O ZINC000866513365 1030340608 /nfs/dbraw/zinc/34/06/08/1030340608.db2.gz VHOGCXUXHPMASF-QANKJYHBSA-N 1 1 307.409 3.777 20 10 DHCDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)s1 ZINC000772876181 1030384643 /nfs/dbraw/zinc/38/46/43/1030384643.db2.gz SDZQMHYRRBAADT-SNVBAGLBSA-N 1 1 307.438 3.816 20 10 DHCDMO COc1ccc(N(Cc2c[nH+]c(C)n2C)Cc2ccccc2)cc1 ZINC000824473471 1030562023 /nfs/dbraw/zinc/56/20/23/1030562023.db2.gz AFAFPVVJKALSLS-UHFFFAOYSA-N 1 1 321.424 3.944 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@](C)(COC)C2)cc1F ZINC000824583769 1030594796 /nfs/dbraw/zinc/59/47/96/1030594796.db2.gz QIOBCSNSXNABAU-GOSISDBHSA-N 1 1 308.441 3.530 20 10 DHCDMO Cn1ccnc1[C@@H]1[N@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824620482 1030603917 /nfs/dbraw/zinc/60/39/17/1030603917.db2.gz QNPOAXPFFAETRJ-SFHVURJKSA-N 1 1 321.424 3.862 20 10 DHCDMO Cn1ccnc1[C@@H]1[N@@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824620482 1030603926 /nfs/dbraw/zinc/60/39/26/1030603926.db2.gz QNPOAXPFFAETRJ-SFHVURJKSA-N 1 1 321.424 3.862 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1O ZINC000824695765 1030613061 /nfs/dbraw/zinc/61/30/61/1030613061.db2.gz CJRNXQCDICPTJG-ZACQAIPSSA-N 1 1 323.864 3.870 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1Cl ZINC000824894552 1030660570 /nfs/dbraw/zinc/66/05/70/1030660570.db2.gz HOHHWAFXYSRFRZ-HNNXBMFYSA-N 1 1 322.880 3.518 20 10 DHCDMO C[C@H]([NH2+]CCc1nc2c(s1)CCC2)c1cc(F)cc(F)c1O ZINC000926930252 1031002340 /nfs/dbraw/zinc/00/23/40/1031002340.db2.gz HAKGQEJEODVUMQ-VIFPVBQESA-N 1 1 324.396 3.509 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000927115374 1031099943 /nfs/dbraw/zinc/09/99/43/1031099943.db2.gz LGJWXQHCBHRFJC-ORAYPTAESA-N 1 1 315.388 3.886 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000927115371 1031101294 /nfs/dbraw/zinc/10/12/94/1031101294.db2.gz LGJWXQHCBHRFJC-BFUOFWGJSA-N 1 1 315.388 3.886 20 10 DHCDMO Cc1c(O)cccc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001144119128 1031258153 /nfs/dbraw/zinc/25/81/53/1031258153.db2.gz VFCXUOIEZIXJSK-UHFFFAOYSA-N 1 1 310.441 3.933 20 10 DHCDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC001308811840 1031296867 /nfs/dbraw/zinc/29/68/67/1031296867.db2.gz AHOPBRMPHJCDBE-LBPRGKRZSA-N 1 1 301.789 3.576 20 10 DHCDMO CCOC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC001308811840 1031296884 /nfs/dbraw/zinc/29/68/84/1031296884.db2.gz AHOPBRMPHJCDBE-LBPRGKRZSA-N 1 1 301.789 3.576 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)[C@H](C)CO1 ZINC000844732730 1031320950 /nfs/dbraw/zinc/32/09/50/1031320950.db2.gz RILFYYCZEFEQPC-UKRRQHHQSA-N 1 1 315.413 3.553 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(-n3cccc3)cc1)CC2 ZINC001144251354 1031393095 /nfs/dbraw/zinc/39/30/95/1031393095.db2.gz FHWJEIXYVFYLPK-UHFFFAOYSA-N 1 1 304.393 3.741 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CNc2ccccc2C1)c1ccc(F)cc1O ZINC000844921745 1031401090 /nfs/dbraw/zinc/40/10/90/1031401090.db2.gz SMKLDJDMXMBPFN-ZBFHGGJFSA-N 1 1 300.377 3.609 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(O)c1F ZINC000872026982 1031409434 /nfs/dbraw/zinc/40/94/34/1031409434.db2.gz AGHSCEJFCZJHAN-NSHDSACASA-N 1 1 306.356 3.587 20 10 DHCDMO Oc1ccc(Br)cc1CNc1ccc2[nH]c[nH+]c2c1 ZINC001171175797 1031534762 /nfs/dbraw/zinc/53/47/62/1031534762.db2.gz DTJMUWDWSLQCEF-UHFFFAOYSA-N 1 1 318.174 3.643 20 10 DHCDMO CCc1ccc[nH+]c1NCc1cc(Br)ccc1O ZINC001171174441 1031535157 /nfs/dbraw/zinc/53/51/57/1031535157.db2.gz UGMRKTGAYCDXKO-UHFFFAOYSA-N 1 1 307.191 3.724 20 10 DHCDMO Oc1ccc(Br)cc1CNc1[nH+]ccc2cc[nH]c21 ZINC001171177779 1031555002 /nfs/dbraw/zinc/55/50/02/1031555002.db2.gz JSAADUUJLNOTRR-UHFFFAOYSA-N 1 1 318.174 3.643 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872260405 1031565001 /nfs/dbraw/zinc/56/50/01/1031565001.db2.gz PSMDERGAMPMJSU-INIZCTEOSA-N 1 1 309.837 3.969 20 10 DHCDMO OCCC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(O)ccc2ccccc21 ZINC000872757742 1031654794 /nfs/dbraw/zinc/65/47/94/1031654794.db2.gz KADLNRWPQJMEOC-ZXFUBFMLSA-N 1 1 311.425 3.671 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2ccn(C(C)C)n2)cc1C ZINC000873057362 1031701968 /nfs/dbraw/zinc/70/19/68/1031701968.db2.gz QQPBXVZGFMSOBN-UHFFFAOYSA-N 1 1 301.434 3.851 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2oc(CC)nc2C)cc1C ZINC000873128695 1031717078 /nfs/dbraw/zinc/71/70/78/1031717078.db2.gz ZWDQHWFCCJETRE-UHFFFAOYSA-N 1 1 302.418 3.932 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2noc3c2CCCC3)cc1C ZINC000873127813 1031717514 /nfs/dbraw/zinc/71/75/14/1031717514.db2.gz XQNNHKRWBRWDHE-UHFFFAOYSA-N 1 1 314.429 3.940 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc2ccccc2c1[O-] ZINC000873245629 1031772920 /nfs/dbraw/zinc/77/29/20/1031772920.db2.gz SKNQIWARLSMGDJ-GOEBONIOSA-N 1 1 312.457 3.974 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1[O-] ZINC000873261003 1031779585 /nfs/dbraw/zinc/77/95/85/1031779585.db2.gz KJKWTHPELJEMGN-VIRABCJISA-N 1 1 308.853 3.535 20 10 DHCDMO COCc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000294108969 1031808558 /nfs/dbraw/zinc/80/85/58/1031808558.db2.gz FTJPADZNZNGLHJ-UHFFFAOYSA-N 1 1 309.768 3.621 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000846111821 1031860291 /nfs/dbraw/zinc/86/02/91/1031860291.db2.gz NWZCHDQTMPSNKE-IYBDPMFKSA-N 1 1 301.336 3.756 20 10 DHCDMO C[C@H](CCO)[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000846111463 1031863344 /nfs/dbraw/zinc/86/33/44/1031863344.db2.gz PKGIGBNLVALDFA-OAHLLOKOSA-N 1 1 318.486 3.587 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1 ZINC000846105389 1031879892 /nfs/dbraw/zinc/87/98/92/1031879892.db2.gz TVHIVPBSWWRJFR-RCFWFJCLSA-N 1 1 306.400 3.887 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC000846104145 1031880057 /nfs/dbraw/zinc/88/00/57/1031880057.db2.gz FKQXNDFVYPRDHZ-AWEZNQCLSA-N 1 1 301.764 3.975 20 10 DHCDMO C[C@H](COCC1CC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000846205381 1031909780 /nfs/dbraw/zinc/90/97/80/1031909780.db2.gz PGJMRXQAGGJGKP-MNOVXSKESA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+]CCC1(CO)CCC1)c1cccc(C(F)(F)F)c1O ZINC000846211131 1031910851 /nfs/dbraw/zinc/91/08/51/1031910851.db2.gz TVBFDBAJJKWAKY-LLVKDONJSA-N 1 1 317.351 3.614 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000846699577 1032042524 /nfs/dbraw/zinc/04/25/24/1032042524.db2.gz UTTGPDBGQXHJNO-SJLPKXTDSA-N 1 1 303.494 3.625 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C2CC(C)(C)OC(C)(C)C2)cc1 ZINC001172659658 1033310993 /nfs/dbraw/zinc/31/09/93/1033310993.db2.gz FRZIMHOSLHCQGJ-UHFFFAOYSA-N 1 1 304.478 3.921 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000877634464 1033390351 /nfs/dbraw/zinc/39/03/51/1033390351.db2.gz QAOANWIYNGOADC-GOSISDBHSA-N 1 1 313.397 3.647 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)c1O ZINC000877672699 1033406815 /nfs/dbraw/zinc/40/68/15/1033406815.db2.gz KXWDLWPCIRPNRY-RTBURBONSA-N 1 1 311.425 3.653 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](O)C[C@H]1c1ccccc1 ZINC000877674336 1033408575 /nfs/dbraw/zinc/40/85/75/1033408575.db2.gz UBMLINZMECPMNT-SFTDATJTSA-N 1 1 324.468 3.759 20 10 DHCDMO Cc1cccc(CN2CCC(C)([NH+]3CCCCC3)CC2)c1O ZINC000877794097 1033448993 /nfs/dbraw/zinc/44/89/93/1033448993.db2.gz GJNISBUYDANOSX-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000877796469 1033454092 /nfs/dbraw/zinc/45/40/92/1033454092.db2.gz NVRJYFOJPVSNSM-GOSISDBHSA-N 1 1 316.489 3.660 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c1 ZINC000877812298 1033462658 /nfs/dbraw/zinc/46/26/58/1033462658.db2.gz LYWDDJNHWYICFF-AWEZNQCLSA-N 1 1 303.324 3.565 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)c1O ZINC000877814633 1033467580 /nfs/dbraw/zinc/46/75/80/1033467580.db2.gz VQZHTIZBBSLBNL-HNNXBMFYSA-N 1 1 302.443 3.709 20 10 DHCDMO CCCC[N@@H+](Cc1nccn1CC(F)F)Cc1ccccc1O ZINC000878566018 1033753568 /nfs/dbraw/zinc/75/35/68/1033753568.db2.gz YOLSCZFQOZPFSR-UHFFFAOYSA-N 1 1 323.387 3.656 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000862211141 1033779407 /nfs/dbraw/zinc/77/94/07/1033779407.db2.gz CRRDUMMDOPAEQJ-CQSZACIVSA-N 1 1 321.218 3.820 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2n[nH]cc21 ZINC000862212430 1033779951 /nfs/dbraw/zinc/77/99/51/1033779951.db2.gz RQJMRQVDQIBRFM-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862219498 1033784669 /nfs/dbraw/zinc/78/46/69/1033784669.db2.gz HMQCHDMDYWHQLT-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862246744 1033792859 /nfs/dbraw/zinc/79/28/59/1033792859.db2.gz BZRLLPAGWQFHHH-SNVBAGLBSA-N 1 1 318.280 3.728 20 10 DHCDMO CC[N@H+](Cc1ccoc1)Cc1c(O)cccc1Br ZINC000862238172 1033789393 /nfs/dbraw/zinc/78/93/93/1033789393.db2.gz OPXYUQAPVQBCHB-UHFFFAOYSA-N 1 1 310.191 3.770 20 10 DHCDMO CC[N@@H+](Cc1ccoc1)Cc1c(O)cccc1Br ZINC000862238172 1033789409 /nfs/dbraw/zinc/78/94/09/1033789409.db2.gz OPXYUQAPVQBCHB-UHFFFAOYSA-N 1 1 310.191 3.770 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1F ZINC000862347587 1033822348 /nfs/dbraw/zinc/82/23/48/1033822348.db2.gz HODHXHAOXCJMER-JTQLQIEISA-N 1 1 322.321 3.805 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1F ZINC000862347587 1033822360 /nfs/dbraw/zinc/82/23/60/1033822360.db2.gz HODHXHAOXCJMER-JTQLQIEISA-N 1 1 322.321 3.805 20 10 DHCDMO C[N@H+]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CC1(C)C ZINC000862368860 1033831887 /nfs/dbraw/zinc/83/18/87/1033831887.db2.gz MXZMQGGQAGDFEP-GFCCVEGCSA-N 1 1 317.260 3.661 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1F ZINC000862403945 1033843416 /nfs/dbraw/zinc/84/34/16/1033843416.db2.gz YRWJFJHBBWLKNB-OAHLLOKOSA-N 1 1 316.342 3.652 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1F ZINC000862403945 1033843427 /nfs/dbraw/zinc/84/34/27/1033843427.db2.gz YRWJFJHBBWLKNB-OAHLLOKOSA-N 1 1 316.342 3.652 20 10 DHCDMO Cc1ccccc1-c1noc([C@H](C)[N@H+](C)Cc2ccccc2O)n1 ZINC000174157355 1033908173 /nfs/dbraw/zinc/90/81/73/1033908173.db2.gz ZERGWTQADCLEEW-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO Cc1ccccc1-c1noc([C@H](C)[N@@H+](C)Cc2ccccc2O)n1 ZINC000174157355 1033908197 /nfs/dbraw/zinc/90/81/97/1033908197.db2.gz ZERGWTQADCLEEW-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO C[N@@H+](CCCCCCO)Cc1ccc(N2CCCCC2)cc1 ZINC000175741609 1034041167 /nfs/dbraw/zinc/04/11/67/1034041167.db2.gz XWXKORJNXXOMFF-UHFFFAOYSA-N 1 1 304.478 3.661 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000826120467 1034118602 /nfs/dbraw/zinc/11/86/02/1034118602.db2.gz DQFDUNOOXGACKG-RDJZCZTQSA-N 1 1 317.816 3.662 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)c1O ZINC000880000767 1034177478 /nfs/dbraw/zinc/17/74/78/1034177478.db2.gz KJZNCKRLQZOSKL-CQSZACIVSA-N 1 1 319.298 3.508 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)c1O ZINC000880000767 1034177482 /nfs/dbraw/zinc/17/74/82/1034177482.db2.gz KJZNCKRLQZOSKL-CQSZACIVSA-N 1 1 319.298 3.508 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](c3nccs3)C2)cc1 ZINC000880321140 1034296661 /nfs/dbraw/zinc/29/66/61/1034296661.db2.gz NLPVEMXXNQXFRJ-OAHLLOKOSA-N 1 1 301.459 3.589 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1ccnn1C)Cc1ccccc1O ZINC000179642130 1034320195 /nfs/dbraw/zinc/32/01/95/1034320195.db2.gz PNKCMGCTWWRZAQ-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO CC(=O)c1cc(F)cc(C[NH2+]C(C)(C)c2ncc(C)s2)c1O ZINC000183957639 1034433197 /nfs/dbraw/zinc/43/31/97/1034433197.db2.gz PPPFMUALMKLFKA-UHFFFAOYSA-N 1 1 322.405 3.524 20 10 DHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000184918074 1034511702 /nfs/dbraw/zinc/51/17/02/1034511702.db2.gz SZPNSGVHHUMOCJ-QFYYESIMSA-N 1 1 309.768 3.569 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000211406694 1034545347 /nfs/dbraw/zinc/54/53/47/1034545347.db2.gz MNVOLRLYCCQEOP-RISCZKNCSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000211406694 1034545356 /nfs/dbraw/zinc/54/53/56/1034545356.db2.gz MNVOLRLYCCQEOP-RISCZKNCSA-N 1 1 310.235 3.919 20 10 DHCDMO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)c1 ZINC000185459298 1034549583 /nfs/dbraw/zinc/54/95/83/1034549583.db2.gz YRONCSAAWQMDJN-AWEZNQCLSA-N 1 1 316.420 3.752 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(F)cc2O)o1 ZINC000185548061 1034556364 /nfs/dbraw/zinc/55/63/64/1034556364.db2.gz LUROQLKHYMCTGT-NHYWBVRUSA-N 1 1 307.365 3.725 20 10 DHCDMO C[C@@H]([NH2+]CCN1CC=CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794836649 1034593773 /nfs/dbraw/zinc/59/37/73/1034593773.db2.gz VIBNNZLGVVQTEF-LLVKDONJSA-N 1 1 315.244 3.612 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794835633 1034593976 /nfs/dbraw/zinc/59/39/76/1034593976.db2.gz RFSNDJUJOPHPEI-GXSJLCMTSA-N 1 1 318.244 3.901 20 10 DHCDMO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000186820873 1034664127 /nfs/dbraw/zinc/66/41/27/1034664127.db2.gz BKQWAXRXVVTPJG-ZDUSSCGKSA-N 1 1 318.417 3.855 20 10 DHCDMO C[N@H+]1CCC=C(Nc2ccc(CCc3ccc(N)cc3)cc2)C1 ZINC001175580003 1035048906 /nfs/dbraw/zinc/04/89/06/1035048906.db2.gz TWZYMVKHTOOPAY-UHFFFAOYSA-N 1 1 307.441 3.685 20 10 DHCDMO Cc1cc(C[N@@H+](C)CCCC(=O)OC(C)(C)C)ccc1N(C)C ZINC001176787596 1035327979 /nfs/dbraw/zinc/32/79/79/1035327979.db2.gz FOHPTXGDTIDYHY-UHFFFAOYSA-N 1 1 320.477 3.615 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]CCCCOc1ccccc1 ZINC001177199557 1035354351 /nfs/dbraw/zinc/35/43/51/1035354351.db2.gz LSTIQFYATDRELN-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO CCCOc1ccc(CN[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1C ZINC001177476195 1035371212 /nfs/dbraw/zinc/37/12/12/1035371212.db2.gz YXAQIHRHEYPHBL-WMZOPIPTSA-N 1 1 318.505 3.994 20 10 DHCDMO CCCOc1ccc(CN[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1C ZINC001177476195 1035371214 /nfs/dbraw/zinc/37/12/14/1035371214.db2.gz YXAQIHRHEYPHBL-WMZOPIPTSA-N 1 1 318.505 3.994 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3cccc4c3OC(F)(F)O4)ccc21 ZINC001178037587 1035407537 /nfs/dbraw/zinc/40/75/37/1035407537.db2.gz QYMUERAUGMMJCQ-UHFFFAOYSA-N 1 1 317.295 3.507 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2cn(C)nc2C)cc1 ZINC000773766728 1035443222 /nfs/dbraw/zinc/44/32/22/1035443222.db2.gz UXHKTCCFZNNQKD-LJQANCHMSA-N 1 1 312.461 3.522 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCCC23COC3)c2ccccc21 ZINC001204242397 1035473652 /nfs/dbraw/zinc/47/36/52/1035473652.db2.gz OYZMKBRTYHTNAX-UHFFFAOYSA-N 1 1 310.441 3.661 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1 ZINC000773825151 1035498626 /nfs/dbraw/zinc/49/86/26/1035498626.db2.gz WVZXDAQJZAVDIN-OALUTQOASA-N 1 1 316.489 3.781 20 10 DHCDMO CCCOc1ccc2c(c1)CC[N@H+](Cc1cc(F)ccc1O)C2 ZINC001179979268 1035554693 /nfs/dbraw/zinc/55/46/93/1035554693.db2.gz DYYHFWOMZSUPRT-UHFFFAOYSA-N 1 1 315.388 3.878 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@H]2CN2CCCCC2)c1 ZINC001179967135 1035561721 /nfs/dbraw/zinc/56/17/21/1035561721.db2.gz ZDDICDPVYHSVPS-LJQANCHMSA-N 1 1 316.489 3.966 20 10 DHCDMO CC(C)c1ccc(O)c(CN2CCC[C@@H]2C[NH+]2CCCCC2)c1 ZINC001179967135 1035561735 /nfs/dbraw/zinc/56/17/35/1035561735.db2.gz ZDDICDPVYHSVPS-LJQANCHMSA-N 1 1 316.489 3.966 20 10 DHCDMO Cn1ccc([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000905720277 1035624157 /nfs/dbraw/zinc/62/41/57/1035624157.db2.gz CBZGDGVKIUIAQP-INIZCTEOSA-N 1 1 321.424 3.659 20 10 DHCDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c(O)c1 ZINC001180213504 1035624292 /nfs/dbraw/zinc/62/42/92/1035624292.db2.gz VHHNLZUIRGOMFV-INIZCTEOSA-N 1 1 311.381 3.766 20 10 DHCDMO Cn1nccc1[C@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000905742424 1035639513 /nfs/dbraw/zinc/63/95/13/1035639513.db2.gz QIQQWOIEVUDUQY-GOSISDBHSA-N 1 1 307.397 3.616 20 10 DHCDMO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001180359945 1035652576 /nfs/dbraw/zinc/65/25/76/1035652576.db2.gz ZFCFBQARCLSLGW-IEBWSBKVSA-N 1 1 316.489 3.781 20 10 DHCDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(F)c(F)c2)c(O)c1 ZINC001180392202 1035661031 /nfs/dbraw/zinc/66/10/31/1035661031.db2.gz BKWCOPJYCHOHCX-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(O)c1 ZINC001204270335 1035687848 /nfs/dbraw/zinc/68/78/48/1035687848.db2.gz LPRLFPJWWBAIKM-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC001181525780 1035932761 /nfs/dbraw/zinc/93/27/61/1035932761.db2.gz OUHDYXOQJKJFNA-HUUCEWRRSA-N 1 1 323.864 3.993 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC001181526226 1035936295 /nfs/dbraw/zinc/93/62/95/1035936295.db2.gz VKYNBMIHMBVCCT-KGLIPLIRSA-N 1 1 309.837 3.684 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC001181525782 1035936886 /nfs/dbraw/zinc/93/68/86/1035936886.db2.gz OUHDYXOQJKJFNA-LSDHHAIUSA-N 1 1 323.864 3.993 20 10 DHCDMO CC[N@H+](Cc1nc2c(s1)CCC2)Cc1ccc(N(C)C)cc1 ZINC000775637750 1036140293 /nfs/dbraw/zinc/14/02/93/1036140293.db2.gz UQJKNAFNQPKJTH-UHFFFAOYSA-N 1 1 315.486 3.720 20 10 DHCDMO CC[N@@H+](Cc1nc2c(s1)CCC2)Cc1ccc(N(C)C)cc1 ZINC000775637750 1036140296 /nfs/dbraw/zinc/14/02/96/1036140296.db2.gz UQJKNAFNQPKJTH-UHFFFAOYSA-N 1 1 315.486 3.720 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000775646536 1036199403 /nfs/dbraw/zinc/19/94/03/1036199403.db2.gz ZHGDHEIBQNIDRP-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1O ZINC000775649100 1036216317 /nfs/dbraw/zinc/21/63/17/1036216317.db2.gz ZWWWLLXVBFTYHT-QGZVFWFLSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1O ZINC000775649100 1036216338 /nfs/dbraw/zinc/21/63/38/1036216338.db2.gz ZWWWLLXVBFTYHT-QGZVFWFLSA-N 1 1 317.816 3.928 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccc3nccn32)C2CC2)cc1 ZINC000775649881 1036231996 /nfs/dbraw/zinc/23/19/96/1036231996.db2.gz UPQZCSKLGLRPAT-UHFFFAOYSA-N 1 1 320.440 3.565 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccc(F)cc2)C(C)C)c1 ZINC000775652806 1036243704 /nfs/dbraw/zinc/24/37/04/1036243704.db2.gz UWQYDGGZXDFDHZ-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO COCC[N@@H+](CCc1ccccc1)Cc1cccc(Cl)c1[O-] ZINC000775657322 1036257635 /nfs/dbraw/zinc/25/76/35/1036257635.db2.gz ZGUWZEOVYHPXRR-UHFFFAOYSA-N 1 1 319.832 3.737 20 10 DHCDMO COCC[N@@H+](Cc1cc(OC)ccc1O)[C@@H](C)c1ccccc1 ZINC000775657212 1036258490 /nfs/dbraw/zinc/25/84/90/1036258490.db2.gz YKPVOGMOIKXXBH-HNNXBMFYSA-N 1 1 315.413 3.610 20 10 DHCDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658752 1036269993 /nfs/dbraw/zinc/26/99/93/1036269993.db2.gz PZXLBKVNTOTDCG-IIAWOOMASA-N 1 1 322.880 3.883 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+](C)Cc2ccoc2)c1O ZINC000775662700 1036287916 /nfs/dbraw/zinc/28/79/16/1036287916.db2.gz GASGMPWJNICINE-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO C[C@@H]([NH2+]CCOC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774378557 1036305894 /nfs/dbraw/zinc/30/58/94/1036305894.db2.gz BVHFVTNEAYUPQB-ZCFIWIBFSA-N 1 1 318.122 3.886 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774349872 1036313343 /nfs/dbraw/zinc/31/33/43/1036313343.db2.gz VZXNDMRWMYUCOV-NXEZZACHSA-N 1 1 304.217 3.776 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c1O ZINC000775669102 1036319654 /nfs/dbraw/zinc/31/96/54/1036319654.db2.gz FIIGROWJQVICEZ-ICSRJNTNSA-N 1 1 311.425 3.789 20 10 DHCDMO CCc1cccc(C[N@@H+](CC2CC2)[C@](C)(CC)C(=O)OC)c1O ZINC001182481000 1036367596 /nfs/dbraw/zinc/36/75/96/1036367596.db2.gz YDLNMTZKYHRHSI-LJQANCHMSA-N 1 1 319.445 3.508 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000775686022 1036433589 /nfs/dbraw/zinc/43/35/89/1036433589.db2.gz BOQNBQORWQYEKN-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182968710 1036490219 /nfs/dbraw/zinc/49/02/19/1036490219.db2.gz DWPXPQLQMHVDQX-PXAZEXFGSA-N 1 1 313.388 3.760 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1O ZINC000775738355 1036596587 /nfs/dbraw/zinc/59/65/87/1036596587.db2.gz BDRDKCLYSLYCJU-KGLIPLIRSA-N 1 1 309.837 3.603 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@H](O)c1ccccc1 ZINC001183698724 1036648355 /nfs/dbraw/zinc/64/83/55/1036648355.db2.gz ZBZANWRIUTXYBP-DOTOQJQBSA-N 1 1 323.795 3.787 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H](Cc2nccs2)C1 ZINC001183885173 1036697638 /nfs/dbraw/zinc/69/76/38/1036697638.db2.gz FVBNMCSSEAESLK-LLVKDONJSA-N 1 1 324.396 3.582 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@H](Cc2nccs2)C1 ZINC001183885173 1036697647 /nfs/dbraw/zinc/69/76/47/1036697647.db2.gz FVBNMCSSEAESLK-LLVKDONJSA-N 1 1 324.396 3.582 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000153523533 1036716678 /nfs/dbraw/zinc/71/66/78/1036716678.db2.gz JJFIFKNJBMLRAP-KRWDZBQOSA-N 1 1 323.436 3.879 20 10 DHCDMO COCCc1cc[nH+]c(NCc2c(O)cc(C)cc2Cl)c1 ZINC000840883889 1036888442 /nfs/dbraw/zinc/88/84/42/1036888442.db2.gz GZURMVQGIQRAEN-UHFFFAOYSA-N 1 1 306.793 3.550 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)cc1 ZINC001198572359 1037061850 /nfs/dbraw/zinc/06/18/50/1037061850.db2.gz FTPYVFALBHFELD-INIZCTEOSA-N 1 1 315.486 3.664 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@H]2[C@H]2CCCO2)ccc1N(C)C ZINC001198686054 1037109423 /nfs/dbraw/zinc/10/94/23/1037109423.db2.gz QNUZCXAAZNRGBR-RBUKOAKNSA-N 1 1 302.462 3.595 20 10 DHCDMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000915793603 1037179456 /nfs/dbraw/zinc/17/94/56/1037179456.db2.gz AMRDKBIZZUXRRM-HNNXBMFYSA-N 1 1 319.445 3.599 20 10 DHCDMO CCCCCC[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001199059937 1037190605 /nfs/dbraw/zinc/19/06/05/1037190605.db2.gz JZBMZKZGDREMMC-GOSISDBHSA-N 1 1 317.521 3.887 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)nc1 ZINC000775943469 1037220164 /nfs/dbraw/zinc/22/01/64/1037220164.db2.gz YOJKNDFAHHPLPK-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO CCCOc1ccc(CNC[C@@H](C)C[NH+]2CCCCC2)cc1C ZINC001199580933 1037286499 /nfs/dbraw/zinc/28/64/99/1037286499.db2.gz DDPKHNREEYDQJM-QGZVFWFLSA-N 1 1 318.505 3.995 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1O)C[C@H]1CCOC1 ZINC000776001799 1037295721 /nfs/dbraw/zinc/29/57/21/1037295721.db2.gz BOJIDLZYHNUEFP-IAGOWNOFSA-N 1 1 311.425 3.992 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000776013175 1037297644 /nfs/dbraw/zinc/29/76/44/1037297644.db2.gz LAINGGNPSGNZGW-IUODEOHRSA-N 1 1 300.368 3.915 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000776015642 1037307474 /nfs/dbraw/zinc/30/74/74/1037307474.db2.gz WCKRZJFGNVTTQT-YPMHNXCESA-N 1 1 317.351 3.954 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775025130 1037427022 /nfs/dbraw/zinc/42/70/22/1037427022.db2.gz BZOSKJMTLPBWSV-ZIAGYGMSSA-N 1 1 322.405 3.613 20 10 DHCDMO COc1c(O)c(C[NH2+]CC(C)(C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000775033274 1037443159 /nfs/dbraw/zinc/44/31/59/1037443159.db2.gz LEAJQVFVNVBGLF-UHFFFAOYSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCC(C)(C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775033997 1037445632 /nfs/dbraw/zinc/44/56/32/1037445632.db2.gz NVTZUXOCLTUMCD-WCQYABFASA-N 1 1 322.405 3.613 20 10 DHCDMO CN1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@H]1c1ccccc1 ZINC001203657018 1037609379 /nfs/dbraw/zinc/60/93/79/1037609379.db2.gz BYBXROQHCRTZLO-KRWDZBQOSA-N 1 1 316.832 3.534 20 10 DHCDMO Cc1nnc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)s1 ZINC000780743019 1037802359 /nfs/dbraw/zinc/80/23/59/1037802359.db2.gz FCNFVOJDBULLHI-CYBMUJFWSA-N 1 1 316.474 3.688 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC000163911264 1038024942 /nfs/dbraw/zinc/02/49/42/1038024942.db2.gz ZQFRXKYBDKYAKV-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO CC[N@@H+](CCCc1ccc(C)nc1)Cc1ccc(N(C)C)cc1 ZINC000776263374 1038116072 /nfs/dbraw/zinc/11/60/72/1038116072.db2.gz BCEWYTDSOKEBIY-UHFFFAOYSA-N 1 1 311.473 3.911 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC000164473486 1038203018 /nfs/dbraw/zinc/20/30/18/1038203018.db2.gz MIKWNZJYNUCDAF-HOCLYGCPSA-N 1 1 307.459 3.569 20 10 DHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164595945 1038231727 /nfs/dbraw/zinc/23/17/27/1038231727.db2.gz GEXFHBNDXUBZEU-INIZCTEOSA-N 1 1 319.445 3.564 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001190436877 1038314992 /nfs/dbraw/zinc/31/49/92/1038314992.db2.gz NEQHTNCQBCSMSK-PMACEKPBSA-N 1 1 316.489 3.921 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCc2cccnc2)C2CC2)cc1 ZINC001190437194 1038317889 /nfs/dbraw/zinc/31/78/89/1038317889.db2.gz UKEQLQGHXXLNCH-UHFFFAOYSA-N 1 1 309.457 3.745 20 10 DHCDMO CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)c1cc(Cl)ccc1[O-] ZINC000775500210 1038582775 /nfs/dbraw/zinc/58/27/75/1038582775.db2.gz ZSJQCPQIIOMGRH-MRXNPFEDSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1[O-])C[NH+]1CCCC1 ZINC000171141650 1039284903 /nfs/dbraw/zinc/28/49/03/1039284903.db2.gz NJAFUWQPUFQRCP-HOTGVXAUSA-N 1 1 312.457 3.928 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)CCOc2ccccc2)c1O ZINC000761183842 1040476608 /nfs/dbraw/zinc/47/66/08/1040476608.db2.gz BPRDJAXHQGGPGV-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)c1O ZINC000093365101 193239551 /nfs/dbraw/zinc/23/95/51/193239551.db2.gz CUCQKHFATGSUFT-AWEZNQCLSA-N 1 1 318.442 3.675 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc([S@@](C)=O)cc1 ZINC000273481202 130125912 /nfs/dbraw/zinc/12/59/12/130125912.db2.gz MBKJQYSMPFBLEI-YEZLUTFDSA-N 1 1 321.417 3.681 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc2c(cc1O)CCCC2 ZINC000273527081 130132082 /nfs/dbraw/zinc/13/20/82/130132082.db2.gz VNHPKJGONPXUMW-PXAZEXFGSA-N 1 1 311.429 3.722 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](O)c1ccccc1C)c1ccc(F)cc1O ZINC000286234949 131225724 /nfs/dbraw/zinc/22/57/24/131225724.db2.gz SZDDIFDFQOMKLV-SJLPKXTDSA-N 1 1 303.377 3.614 20 10 DHCDMO C[C@H]([NH2+][C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000286892151 131254238 /nfs/dbraw/zinc/25/42/38/131254238.db2.gz DCSJTRCCGVPGKL-YVEFUNNKSA-N 1 1 320.383 3.624 20 10 DHCDMO C[C@@H](O)c1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000294305041 335120815 /nfs/dbraw/zinc/12/08/15/335120815.db2.gz QCUKOKKOQYVGAI-SNVBAGLBSA-N 1 1 309.768 3.528 20 10 DHCDMO CC(C)(O)c1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000294569675 335125797 /nfs/dbraw/zinc/12/57/97/335125797.db2.gz GJBAQJXZNSWUEJ-UHFFFAOYSA-N 1 1 323.795 3.702 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1ccc(F)cc1O ZINC000185261858 333206501 /nfs/dbraw/zinc/20/65/01/333206501.db2.gz CEFBEKYUXNVNPP-LBPRGKRZSA-N 1 1 316.376 3.566 20 10 DHCDMO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2c(F)cncc2F)c1O ZINC000289524035 334165966 /nfs/dbraw/zinc/16/59/66/334165966.db2.gz HFZVMMJSJFYPHT-SECBINFHSA-N 1 1 312.747 3.878 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000305750356 337035543 /nfs/dbraw/zinc/03/55/43/337035543.db2.gz ZHUKPQQIOQOBHJ-SJLPKXTDSA-N 1 1 315.413 3.854 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1C[C@@H](CC)O[C@@]2(CCCOC2)C1 ZINC000377696814 337058933 /nfs/dbraw/zinc/05/89/33/337058933.db2.gz NPQSZUCXRLMYQA-AYBZRNKSSA-N 1 1 319.445 3.503 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000378637690 337077280 /nfs/dbraw/zinc/07/72/80/337077280.db2.gz ODZVTVJMTMIHIA-CQSZACIVSA-N 1 1 302.805 3.505 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccccc1O ZINC000183562710 337192294 /nfs/dbraw/zinc/19/22/94/337192294.db2.gz VMFWGGQNAVLECS-OLZOCXBDSA-N 1 1 309.369 3.854 20 10 DHCDMO Cc1nnc([C@H]([NH2+][C@H](C)c2cc(C)ccc2O)c2ccccc2)[nH]1 ZINC000185324313 337205084 /nfs/dbraw/zinc/20/50/84/337205084.db2.gz PHTWMGYRCBXIHW-FZKQIMNGSA-N 1 1 322.412 3.567 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000121199857 337396257 /nfs/dbraw/zinc/39/62/57/337396257.db2.gz YVKLKACWTRLNDQ-OAHLLOKOSA-N 1 1 307.397 3.648 20 10 DHCDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c(OC)c1 ZINC000320573580 337598366 /nfs/dbraw/zinc/59/83/66/337598366.db2.gz QWWVTEJUKKQDBS-NEPJUHHUSA-N 1 1 319.376 3.960 20 10 DHCDMO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C2CC2)cn1 ZINC000528045458 337785910 /nfs/dbraw/zinc/78/59/10/337785910.db2.gz ZCWJJZYUHYOHPR-VOJFVSQTSA-N 1 1 316.376 3.737 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@H]1CCCc2cccnc21 ZINC000364998495 521353978 /nfs/dbraw/zinc/35/39/78/521353978.db2.gz FVRDDBDVJGXKQN-INIZCTEOSA-N 1 1 312.413 3.695 20 10 DHCDMO CC[C@@H]([NH2+]C1CCN(C(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000180404470 522808885 /nfs/dbraw/zinc/80/88/85/522808885.db2.gz GMUXGANOFQUNED-LJQANCHMSA-N 1 1 303.494 3.666 20 10 DHCDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000297534147 535492502 /nfs/dbraw/zinc/49/25/02/535492502.db2.gz PKVGKLYRVXAENR-MRXNPFEDSA-N 1 1 304.478 3.780 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(OC)ccc1OC)c1ccc(F)cc1O ZINC000285561230 535805751 /nfs/dbraw/zinc/80/57/51/535805751.db2.gz HGHBQAMPHUVDQJ-MRXNPFEDSA-N 1 1 319.376 3.789 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccc(NC(C)=O)c1)c1ccc(F)cc1O ZINC000285765049 535806255 /nfs/dbraw/zinc/80/62/55/535806255.db2.gz SMFUWEDFNQSXTL-QGZVFWFLSA-N 1 1 316.376 3.731 20 10 DHCDMO CC[C@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(F)cc1O ZINC000286272740 535906427 /nfs/dbraw/zinc/90/64/27/535906427.db2.gz VKMSVWRSZFMQEU-AWEZNQCLSA-N 1 1 308.784 3.863 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(F)cc1O ZINC000286327548 535909154 /nfs/dbraw/zinc/90/91/54/535909154.db2.gz YGIVMCRBQFFDJF-BONVTDFDSA-N 1 1 306.381 3.981 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(Cl)c1[O-] ZINC000287893462 535937650 /nfs/dbraw/zinc/93/76/50/535937650.db2.gz ZDMVIGZUKWNJIZ-XHSDSOJGSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc(Cl)c1[O-] ZINC000287893462 535937653 /nfs/dbraw/zinc/93/76/53/535937653.db2.gz ZDMVIGZUKWNJIZ-XHSDSOJGSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(F)cc1O ZINC000285986894 535944122 /nfs/dbraw/zinc/94/41/22/535944122.db2.gz HWWVAPKCJWFLPP-LSDHHAIUSA-N 1 1 307.365 3.861 20 10 DHCDMO COCCc1cc[nH+]c(N[C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000287457403 536831858 /nfs/dbraw/zinc/83/18/58/536831858.db2.gz LRHHVCYMRYWWMJ-AWEZNQCLSA-N 1 1 300.402 3.766 20 10 DHCDMO Cc1cnc(C(C)(C)[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000293495669 1013100020 /nfs/dbraw/zinc/10/00/20/1013100020.db2.gz BCDYQWQTIDCADP-UHFFFAOYSA-N 1 1 314.813 3.975 20 10 DHCDMO Cc1cccc([C@@H](O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC001167107636 1013148414 /nfs/dbraw/zinc/14/84/14/1013148414.db2.gz FPXJDDRKZQCFRH-NRFANRHFSA-N 1 1 324.468 3.759 20 10 DHCDMO CCn1cc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000155247645 1013324000 /nfs/dbraw/zinc/32/40/00/1013324000.db2.gz UQAOSBQSDYQGHI-UHFFFAOYSA-N 1 1 312.461 3.525 20 10 DHCDMO CCOC[C@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000177635328 1013828874 /nfs/dbraw/zinc/82/88/74/1013828874.db2.gz RDVUWPSOAMDBNZ-HNNXBMFYSA-N 1 1 305.462 3.857 20 10 DHCDMO C[N@@H+](CCCNCc1c(O)cccc1Cl)C1CCCCC1 ZINC000083551655 1013985472 /nfs/dbraw/zinc/98/54/72/1013985472.db2.gz RRNHMOPOWSRQCF-UHFFFAOYSA-N 1 1 310.869 3.790 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310343176 1014109142 /nfs/dbraw/zinc/10/91/42/1014109142.db2.gz DOXPGVGMLIKNDB-IEBWSBKVSA-N 1 1 324.468 3.955 20 10 DHCDMO C[N@@H+](Cc1c(O)cccc1Cl)[C@H](CCO)c1ccccc1 ZINC000126893495 1014501730 /nfs/dbraw/zinc/50/17/30/1014501730.db2.gz IGXZMIUBYJHTKF-MRXNPFEDSA-N 1 1 305.805 3.601 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CC[C@@H](c3nccs3)C2)cc1 ZINC000895580520 1015216219 /nfs/dbraw/zinc/21/62/19/1015216219.db2.gz BLOKHZOLUPQEBV-MJSXRHKHSA-N 1 1 313.470 3.712 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000895788066 1015302604 /nfs/dbraw/zinc/30/26/04/1015302604.db2.gz FFQJGZCHQYRACL-NHYWBVRUSA-N 1 1 315.335 3.565 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cnn(C)c2C2CC2)C2CC2)cc1 ZINC000891595897 1015437063 /nfs/dbraw/zinc/43/70/63/1015437063.db2.gz FHZDOOYEGZEFDL-UHFFFAOYSA-N 1 1 324.472 3.528 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1 ZINC000320246195 1015468419 /nfs/dbraw/zinc/46/84/19/1015468419.db2.gz ZHRPBUUHLFQNHU-FQEVSTJZSA-N 1 1 317.521 3.743 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)O[C@H](C)[C@@H]3C)c2c1 ZINC000783542356 1015761323 /nfs/dbraw/zinc/76/13/23/1015761323.db2.gz JYVIWGIVEHZARK-MELADBBJSA-N 1 1 315.413 3.552 20 10 DHCDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000780497582 1015782052 /nfs/dbraw/zinc/78/20/52/1015782052.db2.gz MJXDYHLAOBZIFR-OAHLLOKOSA-N 1 1 317.351 3.552 20 10 DHCDMO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1O ZINC000796838511 1016026171 /nfs/dbraw/zinc/02/61/71/1016026171.db2.gz IHPFYFYWJASWKE-JQFCIGGWSA-N 1 1 309.425 3.903 20 10 DHCDMO CC(C)COC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccco1 ZINC000101596908 1016112048 /nfs/dbraw/zinc/11/20/48/1016112048.db2.gz PPWPCCCOOVOKMQ-QGZVFWFLSA-N 1 1 315.413 3.718 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000184880624 1016412420 /nfs/dbraw/zinc/41/24/20/1016412420.db2.gz IHFZWPDYVRQXNG-CQSZACIVSA-N 1 1 320.483 3.756 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000184880624 1016412430 /nfs/dbraw/zinc/41/24/30/1016412430.db2.gz IHFZWPDYVRQXNG-CQSZACIVSA-N 1 1 320.483 3.756 20 10 DHCDMO CCc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000108927903 1016908231 /nfs/dbraw/zinc/90/82/31/1016908231.db2.gz GMCWJILSJOGRHX-UONOGXRCSA-N 1 1 305.462 3.861 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000185457129 1016935170 /nfs/dbraw/zinc/93/51/70/1016935170.db2.gz JUIRPHPCWBHHFZ-HOCLYGCPSA-N 1 1 314.404 3.851 20 10 DHCDMO C[C@@H]([NH2+]CCCSc1nccs1)c1ccc(F)cc1O ZINC000185489884 1016942485 /nfs/dbraw/zinc/94/24/85/1016942485.db2.gz WBDWTWXGLUPFEF-SNVBAGLBSA-N 1 1 312.435 3.821 20 10 DHCDMO C[N@@H+](Cc1c[nH]nc1-c1ccccc1F)Cc1ccccc1O ZINC000091956806 1032466063 /nfs/dbraw/zinc/46/60/63/1032466063.db2.gz XLZWAFDNWBNICX-UHFFFAOYSA-N 1 1 311.360 3.553 20 10 DHCDMO C[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(N2CCCCCC2)cc1 ZINC000773131948 1032567119 /nfs/dbraw/zinc/56/71/19/1032567119.db2.gz MXBUBYKVXXFGPW-INIZCTEOSA-N 1 1 312.461 3.651 20 10 DHCDMO Cc1ccc([C@H](C)CC[N@H+]2CCCc3cc(O)c(O)cc3C2)o1 ZINC001208170602 1012319863 /nfs/dbraw/zinc/31/98/63/1012319863.db2.gz XVQYQOOGVYTTFS-CYBMUJFWSA-N 1 1 315.413 3.941 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000773264112 1032664332 /nfs/dbraw/zinc/66/43/32/1032664332.db2.gz QPXKMCLAXPCERU-IAGOWNOFSA-N 1 1 303.446 3.648 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000773264114 1032665517 /nfs/dbraw/zinc/66/55/17/1032665517.db2.gz QPXKMCLAXPCERU-SJORKVTESA-N 1 1 303.446 3.648 20 10 DHCDMO CC[N@@H+](CCCC(C)(C)OC(C)=O)Cc1ccc(N(C)C)cc1 ZINC001209157360 1013041584 /nfs/dbraw/zinc/04/15/84/1013041584.db2.gz IYSXYJCNPSJMLG-UHFFFAOYSA-N 1 1 320.477 3.696 20 10 DHCDMO Cc1ccc(C)c(CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCCC2)c1O ZINC001279234307 1017195448 /nfs/dbraw/zinc/19/54/48/1017195448.db2.gz DAMFDTJOIMTVLU-HDICACEKSA-N 1 1 314.473 3.600 20 10 DHCDMO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(F)cc1O ZINC000716294993 1032692245 /nfs/dbraw/zinc/69/22/45/1032692245.db2.gz GNUDYFJASZIZNJ-IGEOTXOUSA-N 1 1 315.388 3.930 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926914330 1032715154 /nfs/dbraw/zinc/71/51/54/1032715154.db2.gz HPUYBXLJOKJBTN-OPQQBVKSSA-N 1 1 321.314 3.682 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nccn2CC(C)C)cc1 ZINC000164771127 1017794069 /nfs/dbraw/zinc/79/40/69/1017794069.db2.gz ULEFOGGYNYQVBB-MRXNPFEDSA-N 1 1 314.477 3.846 20 10 DHCDMO CCOc1ccccc1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756446466 1018317652 /nfs/dbraw/zinc/31/76/52/1018317652.db2.gz QOVLYEVIMDVBPJ-LLVKDONJSA-N 1 1 307.340 3.920 20 10 DHCDMO C[C@@H](Cn1ccnc1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278257991 1018470334 /nfs/dbraw/zinc/47/03/34/1018470334.db2.gz NKLUOLZNMMTCGA-UWVGGRQHSA-N 1 1 314.216 3.635 20 10 DHCDMO COc1ccc(C)cc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858092173 1032762677 /nfs/dbraw/zinc/76/26/77/1032762677.db2.gz QPXHILKWEWVTOQ-UHFFFAOYSA-N 1 1 320.383 3.638 20 10 DHCDMO C[N@H+](Cc1ccc(Br)cc1)Cc1c(O)cccc1F ZINC001137837676 1018660000 /nfs/dbraw/zinc/66/00/00/1018660000.db2.gz QRCVDYBLZUFPPH-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1c(O)cccc1F ZINC001137837676 1018660002 /nfs/dbraw/zinc/66/00/02/1018660002.db2.gz QRCVDYBLZUFPPH-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCN(CC)c1ccc(CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1F ZINC000858133384 1032778780 /nfs/dbraw/zinc/77/87/80/1032778780.db2.gz UQDAQQALKHIIAC-MRXNPFEDSA-N 1 1 321.484 3.634 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CSc3ccccc32)cc1F ZINC000858142350 1032781565 /nfs/dbraw/zinc/78/15/65/1032781565.db2.gz ZFFCOVRALYJFFI-OAHLLOKOSA-N 1 1 320.408 3.967 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@@]1(C)O ZINC001143103489 1019370259 /nfs/dbraw/zinc/37/02/59/1019370259.db2.gz DRXWZSIACMJQAK-AUUYWEPGSA-N 1 1 305.462 3.673 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1ccc(F)cc1O ZINC000170788886 1019434221 /nfs/dbraw/zinc/43/42/21/1019434221.db2.gz YMZGSZXGCSCMAD-CZUORRHYSA-N 1 1 318.392 3.612 20 10 DHCDMO CCCC[N@H+](Cc1cn(C2CCC2)nn1)Cc1ccccc1O ZINC000825788850 1032835080 /nfs/dbraw/zinc/83/50/80/1032835080.db2.gz KRGZFVCBFKMYQQ-UHFFFAOYSA-N 1 1 314.433 3.511 20 10 DHCDMO CCCC[N@@H+](Cc1cn(C2CCC2)nn1)Cc1ccccc1O ZINC000825788850 1032835092 /nfs/dbraw/zinc/83/50/92/1032835092.db2.gz KRGZFVCBFKMYQQ-UHFFFAOYSA-N 1 1 314.433 3.511 20 10 DHCDMO c1nc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000858351663 1032859023 /nfs/dbraw/zinc/85/90/23/1032859023.db2.gz MWBXSTWFOXGGGV-INIZCTEOSA-N 1 1 313.470 3.911 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(Cl)c(Cl)cc1O ZINC000278826916 1019948605 /nfs/dbraw/zinc/94/86/05/1019948605.db2.gz SWABGYUYTLUDBL-BSFTYYOTSA-N 1 1 302.201 3.670 20 10 DHCDMO CCc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000929294496 1020020650 /nfs/dbraw/zinc/02/06/50/1020020650.db2.gz DPAGTVGOEDWDTQ-UHFFFAOYSA-N 1 1 301.434 3.714 20 10 DHCDMO CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(Cl)ccc2[O-])CC1 ZINC000922847782 1020307550 /nfs/dbraw/zinc/30/75/50/1020307550.db2.gz FBUZNTLYQHGEBE-UHFFFAOYSA-N 1 1 308.853 3.542 20 10 DHCDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000732980285 1020309950 /nfs/dbraw/zinc/30/99/50/1020309950.db2.gz WPUUCEUXIGOKSS-LJQANCHMSA-N 1 1 313.397 3.950 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1occc1Br ZINC000735320970 1020717693 /nfs/dbraw/zinc/71/76/93/1020717693.db2.gz FMASCORFEXJQMJ-UHFFFAOYSA-N 1 1 323.234 3.706 20 10 DHCDMO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)C[C@H]1CCCO1 ZINC000738062440 1020861319 /nfs/dbraw/zinc/86/13/19/1020861319.db2.gz YTGUCGJDGLAIKU-CQSZACIVSA-N 1 1 311.381 3.902 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](n3ccnc3)C2)cc1C(C)C ZINC000738159019 1020862185 /nfs/dbraw/zinc/86/21/85/1020862185.db2.gz QBZWNJGEANMGLY-KRWDZBQOSA-N 1 1 313.445 3.858 20 10 DHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000738226259 1020864983 /nfs/dbraw/zinc/86/49/83/1020864983.db2.gz GAHQLBSRKYYPSC-QGZVFWFLSA-N 1 1 305.487 3.989 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@H](C[NH+]3CCCC3)C2)cc1C(C)C ZINC000739875420 1020919046 /nfs/dbraw/zinc/91/90/46/1020919046.db2.gz JNZFEVWMIDPUFB-QGZVFWFLSA-N 1 1 316.489 3.742 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(C)c(C)cc2O)CCO1 ZINC000742163237 1021092909 /nfs/dbraw/zinc/09/29/09/1021092909.db2.gz RUQMACYUAZDNHJ-HXUWFJFHSA-N 1 1 311.425 3.891 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@H](O)c1ccc(C)cc1 ZINC000743839864 1021373335 /nfs/dbraw/zinc/37/33/35/1021373335.db2.gz FVKHILLQBOKYLJ-FQEVSTJZSA-N 1 1 312.457 3.617 20 10 DHCDMO C[N@@H+](CCC1CCCCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000744384239 1021528471 /nfs/dbraw/zinc/52/84/71/1021528471.db2.gz KBEOVRUOMCOEPL-UHFFFAOYSA-N 1 1 316.489 3.925 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000850487307 1021560591 /nfs/dbraw/zinc/56/05/91/1021560591.db2.gz HJXGGKKARLAYEJ-AMIZOPFISA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000850546376 1021597468 /nfs/dbraw/zinc/59/74/68/1021597468.db2.gz YPUWDCNKSDMEPG-KOLCDFICSA-N 1 1 318.244 3.758 20 10 DHCDMO C[C@@H]([NH2+]CC1(CC(N)=O)CCCCC1)c1ccc(Cl)cc1O ZINC000850572771 1021615335 /nfs/dbraw/zinc/61/53/35/1021615335.db2.gz GFLFINCBVAKXBO-GFCCVEGCSA-N 1 1 324.852 3.522 20 10 DHCDMO C[N@@H+](Cc1ccc(Br)s1)Cc1ccccc1O ZINC000109773773 1021745760 /nfs/dbraw/zinc/74/57/60/1021745760.db2.gz WEMWTXIGGHMXKM-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO CCn1c2ccc(F)cc2nc1C[N@H+](C)Cc1ccccc1O ZINC000109772076 1021746517 /nfs/dbraw/zinc/74/65/17/1021746517.db2.gz QBUSUVPOFVIFII-UHFFFAOYSA-N 1 1 313.376 3.533 20 10 DHCDMO CCn1c2ccc(F)cc2nc1C[N@@H+](C)Cc1ccccc1O ZINC000109772076 1021746533 /nfs/dbraw/zinc/74/65/33/1021746533.db2.gz QBUSUVPOFVIFII-UHFFFAOYSA-N 1 1 313.376 3.533 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)cc1C ZINC000066794521 1021756917 /nfs/dbraw/zinc/75/69/17/1021756917.db2.gz GBNZNZDXFJNZSS-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)cc1C ZINC000066794521 1021756930 /nfs/dbraw/zinc/75/69/30/1021756930.db2.gz GBNZNZDXFJNZSS-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1cc2c(cc1O)OCO2 ZINC000746026315 1021826538 /nfs/dbraw/zinc/82/65/38/1021826538.db2.gz GLXPPZOAXKMOOP-UHFFFAOYSA-N 1 1 317.360 3.671 20 10 DHCDMO CO[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000851716766 1021970525 /nfs/dbraw/zinc/97/05/25/1021970525.db2.gz QTZHRLYEYXVTRD-OALUTQOASA-N 1 1 302.462 3.676 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)CC2=Cc3ccccc3OC2)cc1 ZINC000155195634 1022057741 /nfs/dbraw/zinc/05/77/41/1022057741.db2.gz WLIMKGLZRWHYJL-UHFFFAOYSA-N 1 1 308.425 3.660 20 10 DHCDMO CC(C)[NH+](CCCN[C@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000766384470 1022084850 /nfs/dbraw/zinc/08/48/50/1022084850.db2.gz NHDNSFSYAOPTJS-QGZVFWFLSA-N 1 1 305.510 3.912 20 10 DHCDMO COc1ccccc1C[N@@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000179926017 1022094263 /nfs/dbraw/zinc/09/42/63/1022094263.db2.gz QPKZTIBRLOCLRW-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO C[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241442 1022242592 /nfs/dbraw/zinc/24/25/92/1022242592.db2.gz VFFXRVDYUWOLLD-FUHWJXTLSA-N 1 1 315.505 3.525 20 10 DHCDMO C[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241442 1022242598 /nfs/dbraw/zinc/24/25/98/1022242598.db2.gz VFFXRVDYUWOLLD-FUHWJXTLSA-N 1 1 315.505 3.525 20 10 DHCDMO Cc1n[nH]cc1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278824689 1022250762 /nfs/dbraw/zinc/25/07/62/1022250762.db2.gz SSUNVNHAEPUYTO-MRVPVSSYSA-N 1 1 300.189 3.581 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H](O)c1ccccc1 ZINC000111232827 1022252357 /nfs/dbraw/zinc/25/23/57/1022252357.db2.gz SVPDNIRZAUHWHU-HXUWFJFHSA-N 1 1 323.392 3.721 20 10 DHCDMO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cc(OC)ccc2O)n1 ZINC000182410675 1022284277 /nfs/dbraw/zinc/28/42/77/1022284277.db2.gz APZBRPBCQVURNZ-VXGBXAGGSA-N 1 1 319.405 3.538 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)cc1C ZINC000853613711 1022298809 /nfs/dbraw/zinc/29/88/09/1022298809.db2.gz IHPIARZMMJXRRM-TZMCWYRMSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)cc1C ZINC000853613711 1022298818 /nfs/dbraw/zinc/29/88/18/1022298818.db2.gz IHPIARZMMJXRRM-TZMCWYRMSA-N 1 1 317.351 3.551 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000179583977 1022475784 /nfs/dbraw/zinc/47/57/84/1022475784.db2.gz YRUJUUFZIKOGOB-LJQANCHMSA-N 1 1 311.425 3.616 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000179683362 1022508561 /nfs/dbraw/zinc/50/85/61/1022508561.db2.gz UNYNELUAXVMVHA-UHFFFAOYSA-N 1 1 301.386 3.939 20 10 DHCDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 ZINC000180001409 1022607793 /nfs/dbraw/zinc/60/77/93/1022607793.db2.gz BIDORXZSNRTQOK-JKSUJKDBSA-N 1 1 320.452 3.618 20 10 DHCDMO Cc1cccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1O ZINC000180196984 1022658906 /nfs/dbraw/zinc/65/89/06/1022658906.db2.gz COPWKSNBCSFFEG-IBGZPJMESA-N 1 1 324.468 3.655 20 10 DHCDMO Cc1cccc(C[N@H+](C)C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000180196984 1022658933 /nfs/dbraw/zinc/65/89/33/1022658933.db2.gz COPWKSNBCSFFEG-IBGZPJMESA-N 1 1 324.468 3.655 20 10 DHCDMO Cc1cccc(C[N@@H+](C)C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000180196984 1022658939 /nfs/dbraw/zinc/65/89/39/1022658939.db2.gz COPWKSNBCSFFEG-IBGZPJMESA-N 1 1 324.468 3.655 20 10 DHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@@H]3c3ccccc3)cc2)CC1 ZINC000876512585 1033082456 /nfs/dbraw/zinc/08/24/56/1033082456.db2.gz SPFAKVZFOHOWFM-OAQYLSRUSA-N 1 1 322.452 3.595 20 10 DHCDMO COc1cccc(C[N@@H+](C)CCOc2cccc(Cl)c2)c1O ZINC000768211672 1022916135 /nfs/dbraw/zinc/91/61/35/1022916135.db2.gz BXNNDPBFBXRZOB-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC000768214057 1022927126 /nfs/dbraw/zinc/92/71/26/1022927126.db2.gz GXJFMHOTIJDJDG-UHFFFAOYSA-N 1 1 309.409 3.999 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000768227617 1022929396 /nfs/dbraw/zinc/92/93/96/1022929396.db2.gz SBABAKCXKPGEOB-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(F)cc2F)c(O)c1 ZINC000768234243 1022930216 /nfs/dbraw/zinc/93/02/16/1022930216.db2.gz YYIMQCWJWZWEHN-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000768269171 1022935872 /nfs/dbraw/zinc/93/58/72/1022935872.db2.gz GBWLGFHEJPURPS-UHFFFAOYSA-N 1 1 301.386 3.939 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2CCc2ccccc2)c1O ZINC000768319573 1022950169 /nfs/dbraw/zinc/95/01/69/1022950169.db2.gz QWECFPBCDVXNJX-SFHVURJKSA-N 1 1 311.425 3.998 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)cc1OC ZINC000768439444 1022968727 /nfs/dbraw/zinc/96/87/27/1022968727.db2.gz LZPULRBAHVYRPB-NUEKZKHPSA-N 1 1 319.445 3.810 20 10 DHCDMO CCC[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)CC(C)C ZINC000768478098 1022969763 /nfs/dbraw/zinc/96/97/63/1022969763.db2.gz HJLGCRCQIMIUDL-UHFFFAOYSA-N 1 1 308.441 3.530 20 10 DHCDMO CCCCC[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768464020 1022972474 /nfs/dbraw/zinc/97/24/74/1022972474.db2.gz YZVPWDIUGBLWOV-OAHLLOKOSA-N 1 1 307.434 3.954 20 10 DHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000768541268 1022986171 /nfs/dbraw/zinc/98/61/71/1022986171.db2.gz MGTJVICNUMHIME-AWEZNQCLSA-N 1 1 311.853 3.993 20 10 DHCDMO COc1cc(C[N@H+](C)Cc2c(O)cccc2Cl)cc(OC)c1 ZINC000768538537 1022986352 /nfs/dbraw/zinc/98/63/52/1022986352.db2.gz WIFGBUGEMYGPFA-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc(OC)c1 ZINC000768538537 1022986367 /nfs/dbraw/zinc/98/63/67/1022986367.db2.gz WIFGBUGEMYGPFA-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1cccc(C[N@@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1O ZINC000768765699 1023017690 /nfs/dbraw/zinc/01/76/90/1023017690.db2.gz GHVPLDZKNLVDQI-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1O ZINC000768765699 1023017702 /nfs/dbraw/zinc/01/77/02/1023017702.db2.gz GHVPLDZKNLVDQI-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO CCc1nc([C@@H](C)[NH2+]Cc2cc(F)cc(C(C)=O)c2O)cs1 ZINC000184718439 1023084608 /nfs/dbraw/zinc/08/46/08/1023084608.db2.gz ZPVMRYITWJGOCJ-SECBINFHSA-N 1 1 322.405 3.604 20 10 DHCDMO CCC[N@@H+](Cc1cn2cccc(F)c2n1)Cc1ccccc1O ZINC000769201303 1023101192 /nfs/dbraw/zinc/10/11/92/1023101192.db2.gz RHYPQKSDQGQCKH-UHFFFAOYSA-N 1 1 313.376 3.591 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1C ZINC000769232859 1023103799 /nfs/dbraw/zinc/10/37/99/1023103799.db2.gz OPRDNMRQQJUYRX-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(N(C)C)cc3)C2)cc1 ZINC000769244243 1023107948 /nfs/dbraw/zinc/10/79/48/1023107948.db2.gz MPKLCYJFFWCQGR-GOSISDBHSA-N 1 1 310.441 3.751 20 10 DHCDMO c1ccc2c(c1)nc(C[NH2+]Cc1ccc3c(c1)CCO3)n2C1CC1 ZINC000184776188 1023110821 /nfs/dbraw/zinc/11/08/21/1023110821.db2.gz XYODQMRLYNAJMJ-UHFFFAOYSA-N 1 1 319.408 3.596 20 10 DHCDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1C ZINC001172372716 1033106258 /nfs/dbraw/zinc/10/62/58/1033106258.db2.gz GTKIGNGSMKRMKK-MBOZVWFJSA-N 1 1 316.489 3.780 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](n3ccnc3)C2)cc1 ZINC000769311582 1023119363 /nfs/dbraw/zinc/11/93/63/1023119363.db2.gz NDLBELOPYIFSHN-IBGZPJMESA-N 1 1 312.461 3.566 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000769340757 1023128160 /nfs/dbraw/zinc/12/81/60/1023128160.db2.gz XUITVVNUUDVOBN-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000769390606 1023139922 /nfs/dbraw/zinc/13/99/22/1023139922.db2.gz ZZBMGYXLNQHYTG-AWEZNQCLSA-N 1 1 316.420 3.660 20 10 DHCDMO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@H](c2ccccc2)CO1 ZINC000769490978 1023154297 /nfs/dbraw/zinc/15/42/97/1023154297.db2.gz ZZPWYPIQMZVKRI-JXFKEZNVSA-N 1 1 310.441 3.715 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@H](c2ccccc2)CO1 ZINC000769490978 1023154299 /nfs/dbraw/zinc/15/42/99/1023154299.db2.gz ZZPWYPIQMZVKRI-JXFKEZNVSA-N 1 1 310.441 3.715 20 10 DHCDMO CC1(C)C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCCO1 ZINC000769463897 1023158955 /nfs/dbraw/zinc/15/89/55/1023158955.db2.gz SICAUCLAOVOXHW-UHFFFAOYSA-N 1 1 302.462 3.678 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000769469752 1023161605 /nfs/dbraw/zinc/16/16/05/1023161605.db2.gz DSKSWNQFBNUTDG-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000769469752 1023161609 /nfs/dbraw/zinc/16/16/09/1023161609.db2.gz DSKSWNQFBNUTDG-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000769469752 1023161610 /nfs/dbraw/zinc/16/16/10/1023161610.db2.gz DSKSWNQFBNUTDG-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2c(O)cccc2OC)s1 ZINC000769471973 1023163676 /nfs/dbraw/zinc/16/36/76/1023163676.db2.gz ZOFOKPIBBBGYFK-GFCCVEGCSA-N 1 1 320.458 3.921 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC000769557737 1023179286 /nfs/dbraw/zinc/17/92/86/1023179286.db2.gz ADSJTLRTYLRCER-CYBMUJFWSA-N 1 1 303.352 3.968 20 10 DHCDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876683148 1033122949 /nfs/dbraw/zinc/12/29/49/1033122949.db2.gz QAIXNWAEFQBFNT-LJQANCHMSA-N 1 1 316.489 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)cc1 ZINC000770293492 1023292852 /nfs/dbraw/zinc/29/28/52/1023292852.db2.gz PFFJIZAJANLCMR-HKUYNNGSSA-N 1 1 302.462 3.534 20 10 DHCDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770324352 1023296769 /nfs/dbraw/zinc/29/67/69/1023296769.db2.gz JGNSZLUHIWISAT-HXUWFJFHSA-N 1 1 316.489 3.924 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2C[C@H](OCC)C23CCC3)c1 ZINC000770353842 1023304689 /nfs/dbraw/zinc/30/46/89/1023304689.db2.gz VIQRLSVGCPIBJS-MSOLQXFVSA-N 1 1 319.445 3.570 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+](C)[C@H]2C[C@@H](OCC)C23CCC3)c1 ZINC000770353848 1023304732 /nfs/dbraw/zinc/30/47/32/1023304732.db2.gz VIQRLSVGCPIBJS-ZWKOTPCHSA-N 1 1 319.445 3.570 20 10 DHCDMO CC[C@@H](CC(C)C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172407132 1033156655 /nfs/dbraw/zinc/15/66/55/1033156655.db2.gz NGTNYOHDPVFEML-SFHVURJKSA-N 1 1 304.478 3.780 20 10 DHCDMO CN(C)c1ccc(C[NH2+][C@H]2COCc3cccc(Cl)c32)cc1 ZINC000788500376 1023896412 /nfs/dbraw/zinc/89/64/12/1023896412.db2.gz BUERIFFDZOFRLY-KRWDZBQOSA-N 1 1 316.832 3.767 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCS1)c1cccc(C(F)(F)F)c1O ZINC000788629566 1023916621 /nfs/dbraw/zinc/91/66/21/1023916621.db2.gz WJGFPFLRTDHVTE-ZJUUUORDSA-N 1 1 305.365 3.957 20 10 DHCDMO CCCCOCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788568878 1023909400 /nfs/dbraw/zinc/90/94/00/1023909400.db2.gz FCSYANXVFFETOK-LLVKDONJSA-N 1 1 305.340 3.878 20 10 DHCDMO COC[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788612507 1023913785 /nfs/dbraw/zinc/91/37/85/1023913785.db2.gz MPHNKFTYKPMJPV-ZWNOBZJWSA-N 1 1 305.340 3.733 20 10 DHCDMO CC[C@@H](O)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788663536 1023921686 /nfs/dbraw/zinc/92/16/86/1023921686.db2.gz GJQULQJHYXEBPN-GHMZBOCLSA-N 1 1 305.340 3.613 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1CCO)c1cccc(C(F)(F)F)c1O ZINC000788760481 1023929767 /nfs/dbraw/zinc/92/97/67/1023929767.db2.gz BDWNZSLLOIJUPA-COPLHBTASA-N 1 1 317.351 3.613 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000789511424 1024106098 /nfs/dbraw/zinc/10/60/98/1024106098.db2.gz ZYLJHFPHQDIIAI-RDJZCZTQSA-N 1 1 319.445 3.539 20 10 DHCDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000789584867 1024120780 /nfs/dbraw/zinc/12/07/80/1024120780.db2.gz SFZFTSCTFUORMS-OAHLLOKOSA-N 1 1 319.832 3.735 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000882915615 1024172033 /nfs/dbraw/zinc/17/20/33/1024172033.db2.gz VLRWDLCGHMBTFA-HNNXBMFYSA-N 1 1 323.314 3.813 20 10 DHCDMO COc1ccccc1C(C)(C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882971684 1024192396 /nfs/dbraw/zinc/19/23/96/1024192396.db2.gz QFGVOAOIEVGKGD-UHFFFAOYSA-N 1 1 307.340 3.704 20 10 DHCDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC000162653748 1024192893 /nfs/dbraw/zinc/19/28/93/1024192893.db2.gz CZGWGNHZHMMJHH-GOSISDBHSA-N 1 1 321.424 3.788 20 10 DHCDMO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000882986209 1024193912 /nfs/dbraw/zinc/19/39/12/1024193912.db2.gz MGXRFBMYRLRXMU-MRXNPFEDSA-N 1 1 319.351 3.846 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000883152474 1024261451 /nfs/dbraw/zinc/26/14/51/1024261451.db2.gz WPGVYEVLQBCOJW-UHFFFAOYSA-N 1 1 307.315 3.979 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000883288403 1024353231 /nfs/dbraw/zinc/35/32/31/1024353231.db2.gz DAOOYTNZEPZGNB-GOSISDBHSA-N 1 1 323.484 3.598 20 10 DHCDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000131593072 1024395244 /nfs/dbraw/zinc/39/52/44/1024395244.db2.gz VKNSNHPYXZCNJQ-SNVBAGLBSA-N 1 1 321.323 3.592 20 10 DHCDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000131593072 1024395258 /nfs/dbraw/zinc/39/52/58/1024395258.db2.gz VKNSNHPYXZCNJQ-SNVBAGLBSA-N 1 1 321.323 3.592 20 10 DHCDMO COc1ccccc1CC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790947154 1024401928 /nfs/dbraw/zinc/40/19/28/1024401928.db2.gz JPFOHUDGLCVIDI-UHFFFAOYSA-N 1 1 309.768 3.526 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)Cc2ccc(C)cc2)c1O ZINC000314985881 1024421082 /nfs/dbraw/zinc/42/10/82/1024421082.db2.gz GCUVHHWNEASFQB-UHFFFAOYSA-N 1 1 301.361 3.674 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1C ZINC000271249741 1024478026 /nfs/dbraw/zinc/47/80/26/1024478026.db2.gz ICOFHCCFGSXIAV-SJLPKXTDSA-N 1 1 315.413 3.690 20 10 DHCDMO Cc1cnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000271486696 1024520910 /nfs/dbraw/zinc/52/09/10/1024520910.db2.gz IVYCTZRHYXLBAI-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO Cc1cnc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000271486696 1024520919 /nfs/dbraw/zinc/52/09/19/1024520919.db2.gz IVYCTZRHYXLBAI-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792166633 1024641171 /nfs/dbraw/zinc/64/11/71/1024641171.db2.gz FDFPGOPBFZBDDL-GFCCVEGCSA-N 1 1 323.795 3.568 20 10 DHCDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792166633 1024641173 /nfs/dbraw/zinc/64/11/73/1024641173.db2.gz FDFPGOPBFZBDDL-GFCCVEGCSA-N 1 1 323.795 3.568 20 10 DHCDMO CC[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001170225027 1024711366 /nfs/dbraw/zinc/71/13/66/1024711366.db2.gz WVWXXJBNONHNAR-OALUTQOASA-N 1 1 302.462 3.676 20 10 DHCDMO COC(=O)C(C)(C)CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000792820415 1024799253 /nfs/dbraw/zinc/79/92/53/1024799253.db2.gz NOGSLVWGFDDJFY-UHFFFAOYSA-N 1 1 319.445 3.726 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)C2CC2)cc1Cl ZINC000825935389 1033246570 /nfs/dbraw/zinc/24/65/70/1033246570.db2.gz SAZCKLVZWBAYNG-UHFFFAOYSA-N 1 1 302.805 3.914 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C2CC2)O1 ZINC000793221215 1024936055 /nfs/dbraw/zinc/93/60/55/1024936055.db2.gz YAPNJOBTGWILSE-OXJNMPFZSA-N 1 1 314.473 3.676 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccccc2SC)c1 ZINC000793232275 1024949384 /nfs/dbraw/zinc/94/93/84/1024949384.db2.gz KZLKKLXJJIRFDV-UHFFFAOYSA-N 1 1 303.427 3.755 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000793232522 1024949916 /nfs/dbraw/zinc/94/99/16/1024949916.db2.gz XBIPCXPGDHDARO-GZMMTYOYSA-N 1 1 323.742 3.827 20 10 DHCDMO OCC[C@H]1CCCCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000793609676 1025128446 /nfs/dbraw/zinc/12/84/46/1025128446.db2.gz RCWSPMFTUBYZKR-LJQANCHMSA-N 1 1 316.489 3.804 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)cc1C(C)C ZINC000884483363 1025136133 /nfs/dbraw/zinc/13/61/33/1025136133.db2.gz RINXOFHVHNQEPZ-DNVCBOLYSA-N 1 1 303.446 3.825 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)Cc2ccccc2O1 ZINC000793766043 1025156513 /nfs/dbraw/zinc/15/65/13/1025156513.db2.gz FUHNTQHHDKNEBB-AWEZNQCLSA-N 1 1 320.392 3.724 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H](C)c2cnc(C)cn2)cc1 ZINC000794257984 1025242770 /nfs/dbraw/zinc/24/27/70/1025242770.db2.gz PKBGEYCKDBISJA-MRXNPFEDSA-N 1 1 312.461 3.824 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1Cl ZINC000825949533 1033278369 /nfs/dbraw/zinc/27/83/69/1033278369.db2.gz WSVPFVLDYMQIAW-DLBZAZTESA-N 1 1 321.848 3.888 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(F)cc(F)c1O)CCC2 ZINC000894021274 1025654552 /nfs/dbraw/zinc/65/45/52/1025654552.db2.gz QUPRQCNMZMOARX-CQSZACIVSA-N 1 1 324.396 3.945 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(F)cc(F)c1O)CCC2 ZINC000894021274 1025654559 /nfs/dbraw/zinc/65/45/59/1025654559.db2.gz QUPRQCNMZMOARX-CQSZACIVSA-N 1 1 324.396 3.945 20 10 DHCDMO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1c(O)cccc1F ZINC000886509890 1025665346 /nfs/dbraw/zinc/66/53/46/1025665346.db2.gz IFKJWQLGRXZUME-CQSZACIVSA-N 1 1 314.404 3.851 20 10 DHCDMO Cc1csc(CCCC[NH2+][C@H](C)c2c(O)cccc2F)n1 ZINC000886521206 1025673395 /nfs/dbraw/zinc/67/33/95/1025673395.db2.gz WUYVWKLGEYXCKA-GFCCVEGCSA-N 1 1 308.422 3.970 20 10 DHCDMO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886524053 1025674092 /nfs/dbraw/zinc/67/40/92/1025674092.db2.gz BQAICBACBVKYMA-ZDUSSCGKSA-N 1 1 302.393 3.838 20 10 DHCDMO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886540288 1025687431 /nfs/dbraw/zinc/68/74/31/1025687431.db2.gz CBIDJWMUYOJUEL-XHDPSFHLSA-N 1 1 301.361 3.878 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccccc1Cl)c1c(O)cccc1F ZINC000886549477 1025696127 /nfs/dbraw/zinc/69/61/27/1025696127.db2.gz IRWZAJJSDQFOGU-ZUZCIYMTSA-N 1 1 309.768 3.569 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000894088199 1025702379 /nfs/dbraw/zinc/70/23/79/1025702379.db2.gz ITUFGAKOXHBXCN-UHFFFAOYSA-N 1 1 309.278 3.835 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000894088199 1025702393 /nfs/dbraw/zinc/70/23/93/1025702393.db2.gz ITUFGAKOXHBXCN-UHFFFAOYSA-N 1 1 309.278 3.835 20 10 DHCDMO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1c(O)cccc1F ZINC000886555367 1025704450 /nfs/dbraw/zinc/70/44/50/1025704450.db2.gz QSDHSNFDFCWLRQ-UGSOOPFHSA-N 1 1 315.388 3.696 20 10 DHCDMO COCC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(C)o1 ZINC000886586068 1025723080 /nfs/dbraw/zinc/72/30/80/1025723080.db2.gz KKAOEMKZIXVPEL-GXTWGEPZSA-N 1 1 307.365 3.861 20 10 DHCDMO CCN(CC)c1ccc(CNC2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000236914480 1025728576 /nfs/dbraw/zinc/72/85/76/1025728576.db2.gz ZTWGZYVOZBCGHF-UHFFFAOYSA-N 1 1 317.521 3.885 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1c(O)cccc1F ZINC000886594924 1025729253 /nfs/dbraw/zinc/72/92/53/1025729253.db2.gz WXDZBSXENIRYTG-GFCCVEGCSA-N 1 1 303.377 3.610 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1c(O)cccc1F ZINC000886601271 1025730973 /nfs/dbraw/zinc/73/09/73/1025730973.db2.gz NYEIITZEZNCWDL-GFCCVEGCSA-N 1 1 300.377 3.656 20 10 DHCDMO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886609091 1025738137 /nfs/dbraw/zinc/73/81/37/1025738137.db2.gz MEAUCHOPZWLMHH-SNUQEOBHSA-N 1 1 303.377 3.612 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610956 1025738265 /nfs/dbraw/zinc/73/82/65/1025738265.db2.gz OKTNFDGXOXBQJR-ABAIWWIYSA-N 1 1 323.795 3.959 20 10 DHCDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c(OC)c1 ZINC000886641481 1025753210 /nfs/dbraw/zinc/75/32/10/1025753210.db2.gz KSHNSDRKXRADNU-RYUDHWBXSA-N 1 1 319.376 3.960 20 10 DHCDMO Cc1noc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000729684158 1025946844 /nfs/dbraw/zinc/94/68/44/1025946844.db2.gz KADQARAPYRILLY-GFCCVEGCSA-N 1 1 309.369 3.601 20 10 DHCDMO COc1cc(O)c(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000245541282 1026064171 /nfs/dbraw/zinc/06/41/71/1026064171.db2.gz NXKCXBGIRSSWCL-ORAYPTAESA-N 1 1 313.397 3.602 20 10 DHCDMO C[C@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@@H+]1C ZINC000093644406 1026120153 /nfs/dbraw/zinc/12/01/53/1026120153.db2.gz VIZPDUHPMOWJOV-GXFFZTMASA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@H+]1C ZINC000093644406 1026120155 /nfs/dbraw/zinc/12/01/55/1026120155.db2.gz VIZPDUHPMOWJOV-GXFFZTMASA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644406 1026120158 /nfs/dbraw/zinc/12/01/58/1026120158.db2.gz VIZPDUHPMOWJOV-GXFFZTMASA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644406 1026120163 /nfs/dbraw/zinc/12/01/63/1026120163.db2.gz VIZPDUHPMOWJOV-GXFFZTMASA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1ccc(F)cc1O ZINC000289929196 1026237385 /nfs/dbraw/zinc/23/73/85/1026237385.db2.gz VJRSPDYFXFLCPW-DIFFPNOSSA-N 1 1 321.417 3.732 20 10 DHCDMO Oc1ccc(Br)cc1C[NH2+]C1(C(F)F)CCCC1 ZINC000808451115 1026292326 /nfs/dbraw/zinc/29/23/26/1026292326.db2.gz FGTLGLWYIQMJKN-UHFFFAOYSA-N 1 1 320.177 3.822 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2C[C@H](N3CCCC3)C[C@@H]2C)cc1 ZINC000809703298 1026599704 /nfs/dbraw/zinc/59/97/04/1026599704.db2.gz HSANNGNWJYMCIJ-FXAWDEMLSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@H](N3CCCC3)C[C@@H]2C)cc1 ZINC000809703298 1026599713 /nfs/dbraw/zinc/59/97/13/1026599713.db2.gz HSANNGNWJYMCIJ-FXAWDEMLSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)[C@@H](C)CO)cc1 ZINC000809743134 1026613290 /nfs/dbraw/zinc/61/32/90/1026613290.db2.gz RIRZHEJZSXSOTA-KRWDZBQOSA-N 1 1 312.457 3.526 20 10 DHCDMO C[N@@H+](CCCn1ccnc1)Cc1cc(-c2ccccc2)ccc1O ZINC000809752496 1026615562 /nfs/dbraw/zinc/61/55/62/1026615562.db2.gz FDCXGHRSFCLYOO-UHFFFAOYSA-N 1 1 321.424 3.778 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCC(CO)CC2)cc1 ZINC000809765814 1026619962 /nfs/dbraw/zinc/61/99/62/1026619962.db2.gz RLEKRBVOGMUYLO-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765521 1026621030 /nfs/dbraw/zinc/62/10/30/1026621030.db2.gz NSEGANLEUGTAJA-OXQOHEQNSA-N 1 1 324.468 3.831 20 10 DHCDMO Cc1nc(C)c(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000809933032 1026641518 /nfs/dbraw/zinc/64/15/18/1026641518.db2.gz NXYQOTWPTYFPHG-UHFFFAOYSA-N 1 1 313.445 3.914 20 10 DHCDMO CCc1nnc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)s1 ZINC000810260190 1026721091 /nfs/dbraw/zinc/72/10/91/1026721091.db2.gz GVHKUTUYPOGOSE-LLVKDONJSA-N 1 1 311.838 3.700 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCCC3)[C@@H]1[C@@H]1CCCO1 ZINC000811777974 1027081558 /nfs/dbraw/zinc/08/15/58/1027081558.db2.gz WHHGIZISJKUMSN-RBUKOAKNSA-N 1 1 315.457 3.660 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1 ZINC000811784025 1027090508 /nfs/dbraw/zinc/09/05/08/1027090508.db2.gz LWRGIBFRDIHBMY-IBGZPJMESA-N 1 1 322.452 3.646 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1 ZINC000811793251 1027094361 /nfs/dbraw/zinc/09/43/61/1027094361.db2.gz UVSDJPNQKIASQE-WMZOPIPTSA-N 1 1 301.430 3.543 20 10 DHCDMO Cc1c([C@@H]2CCC[N@H+]2Cc2c(O)ccc3ccccc32)cnn1C ZINC000362431357 1027199240 /nfs/dbraw/zinc/19/92/40/1027199240.db2.gz HOVSDIUMVNGTIW-IBGZPJMESA-N 1 1 321.424 3.924 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1cc(C)ccc1O ZINC000812345638 1027257410 /nfs/dbraw/zinc/25/74/10/1027257410.db2.gz HEESXCPREDEAGX-UHFFFAOYSA-N 1 1 300.402 3.677 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)cc1C ZINC000016877843 1027289007 /nfs/dbraw/zinc/28/90/07/1027289007.db2.gz POVLPTDZIASGJR-UHFFFAOYSA-N 1 1 321.424 3.827 20 10 DHCDMO CC[N@@H+](Cc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000158688330 1027612552 /nfs/dbraw/zinc/61/25/52/1027612552.db2.gz OCWFUXCLXMUHSI-UHFFFAOYSA-N 1 1 310.441 3.545 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000779020632 1027853043 /nfs/dbraw/zinc/85/30/43/1027853043.db2.gz NSKLWRNNSLNVSV-AWEZNQCLSA-N 1 1 303.352 3.735 20 10 DHCDMO C[N@@H+](Cc1cc(F)ccc1O)[C@@H]1CCCN(c2ccccc2)C1 ZINC000779021054 1027871931 /nfs/dbraw/zinc/87/19/31/1027871931.db2.gz QPIPGKHTCDUGFE-GOSISDBHSA-N 1 1 314.404 3.632 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1cc(Br)ccc1O ZINC000814174779 1027910729 /nfs/dbraw/zinc/91/07/29/1027910729.db2.gz JSEVNJHDRUDIEW-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO CSC[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000814178938 1027914458 /nfs/dbraw/zinc/91/44/58/1027914458.db2.gz JRLRITADKCADLX-SNVBAGLBSA-N 1 1 303.830 3.760 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000814178938 1027914467 /nfs/dbraw/zinc/91/44/67/1027914467.db2.gz JRLRITADKCADLX-SNVBAGLBSA-N 1 1 303.830 3.760 20 10 DHCDMO CC[C@@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000814179008 1027916659 /nfs/dbraw/zinc/91/66/59/1027916659.db2.gz MRRUWAJXIRDLOE-OAHLLOKOSA-N 1 1 303.406 3.569 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](c3ccccc3)C1)OCO2 ZINC000814226408 1027963330 /nfs/dbraw/zinc/96/33/30/1027963330.db2.gz WMXJNWGCNPERDW-HNNXBMFYSA-N 1 1 311.381 3.501 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000365614511 1027983650 /nfs/dbraw/zinc/98/36/50/1027983650.db2.gz UMLMTZRKEKHVDW-ZFWWWQNUSA-N 1 1 305.809 3.640 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc2cn(C)nc2c1)c1ccc(F)cc1O ZINC000527960651 1028004512 /nfs/dbraw/zinc/00/45/12/1028004512.db2.gz CPVOIDAPNUHZIT-MRXNPFEDSA-N 1 1 313.376 3.659 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc2cn(C)nc2c1)c1ccc(F)cc1O ZINC000527960650 1028006268 /nfs/dbraw/zinc/00/62/68/1028006268.db2.gz CPVOIDAPNUHZIT-INIZCTEOSA-N 1 1 313.376 3.659 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000367378817 1028174233 /nfs/dbraw/zinc/17/42/33/1028174233.db2.gz VDFCVDUQJHECLZ-RDTXWAMCSA-N 1 1 313.397 3.535 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000367378817 1028174247 /nfs/dbraw/zinc/17/42/47/1028174247.db2.gz VDFCVDUQJHECLZ-RDTXWAMCSA-N 1 1 313.397 3.535 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@H]2c2cc(C)on2)c1 ZINC000368046119 1028287491 /nfs/dbraw/zinc/28/74/91/1028287491.db2.gz YOFHHVCOFXQUST-WBMJQRKESA-N 1 1 302.374 3.595 20 10 DHCDMO Cc1cc(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)ccc1N(C)C ZINC000815062441 1028345855 /nfs/dbraw/zinc/34/58/55/1028345855.db2.gz UFKNDCHPEFFCPU-MRXNPFEDSA-N 1 1 312.457 3.830 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2c(F)cncc2F)ccc1N(C)C ZINC000815118007 1028361745 /nfs/dbraw/zinc/36/17/45/1028361745.db2.gz WOWYMHWFAFAMIM-LBPRGKRZSA-N 1 1 305.372 3.585 20 10 DHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)ccc1N(C)C ZINC000815118967 1028365143 /nfs/dbraw/zinc/36/51/43/1028365143.db2.gz NWROIWXOJDAMLI-MOPGFXCFSA-N 1 1 314.473 3.595 20 10 DHCDMO CCc1nocc1C[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000815124144 1028370945 /nfs/dbraw/zinc/37/09/45/1028370945.db2.gz OCQZTLKIXWHJCA-UHFFFAOYSA-N 1 1 305.397 3.512 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1 ZINC000815108919 1028382124 /nfs/dbraw/zinc/38/21/24/1028382124.db2.gz QBFAKQPUXCEHGH-SWLSCSKDSA-N 1 1 300.368 3.915 20 10 DHCDMO Oc1cccc(Cl)c1C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815152041 1028382956 /nfs/dbraw/zinc/38/29/56/1028382956.db2.gz GIAGRKSZAHESRR-UHFFFAOYSA-N 1 1 301.695 3.753 20 10 DHCDMO CCOC1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CCCC1 ZINC000815147366 1028403105 /nfs/dbraw/zinc/40/31/05/1028403105.db2.gz UZHOZUQSPRDUMI-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000368798714 1028410340 /nfs/dbraw/zinc/41/03/40/1028410340.db2.gz SQCHVCQFJPKZAZ-CHWSQXEVSA-N 1 1 318.442 3.798 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@H](c3nccs3)C2)c1 ZINC000368798717 1028410841 /nfs/dbraw/zinc/41/08/41/1028410841.db2.gz SQCHVCQFJPKZAZ-STQMWFEESA-N 1 1 318.442 3.798 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2[O-])CC1 ZINC000815554448 1028539804 /nfs/dbraw/zinc/53/98/04/1028539804.db2.gz ZQZGVVKBDSFLKK-NSHDSACASA-N 1 1 316.367 3.546 20 10 DHCDMO CC[C@H](c1ccccc1O)N1CCC([N@@H+]2CCC[C@H]2C)CC1 ZINC000369888346 1028541825 /nfs/dbraw/zinc/54/18/25/1028541825.db2.gz NXKXAQXCVRQQPG-CRAIPNDOSA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@H](c1ccccc1O)N1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000369888346 1028541835 /nfs/dbraw/zinc/54/18/35/1028541835.db2.gz NXKXAQXCVRQQPG-CRAIPNDOSA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000369928992 1028547718 /nfs/dbraw/zinc/54/77/18/1028547718.db2.gz GFCAPGQSFIOAQB-DOTOQJQBSA-N 1 1 303.427 3.978 20 10 DHCDMO C[C@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cccc(C(F)(F)F)c1O ZINC000815576133 1028548672 /nfs/dbraw/zinc/54/86/72/1028548672.db2.gz KFSLHLXGQQKWTQ-QWRGUYRKSA-N 1 1 316.367 3.544 20 10 DHCDMO CCc1cc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)[nH]n1 ZINC000815580725 1028553478 /nfs/dbraw/zinc/55/34/78/1028553478.db2.gz PLSYREVKZNVBSX-VIFPVBQESA-N 1 1 313.323 3.547 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccc(F)cc1O ZINC000815648174 1028592204 /nfs/dbraw/zinc/59/22/04/1028592204.db2.gz GHNPGQJWMQGLKR-YOEHRIQHSA-N 1 1 309.425 3.761 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000371326623 1028690070 /nfs/dbraw/zinc/69/00/70/1028690070.db2.gz JORIOCGVDQNCKM-OALUTQOASA-N 1 1 314.473 3.535 20 10 DHCDMO CC1(O)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC000371332666 1028693124 /nfs/dbraw/zinc/69/31/24/1028693124.db2.gz AQGBSPFVWAOPRI-YOFSQIOKSA-N 1 1 314.473 3.555 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@H]2CCO)cc1 ZINC000779202604 1028703460 /nfs/dbraw/zinc/70/34/60/1028703460.db2.gz PZBXTZGOVMVFOR-SFHVURJKSA-N 1 1 304.478 3.660 20 10 DHCDMO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1[O-])C[NH+]1CCCCC1 ZINC000816536565 1028924794 /nfs/dbraw/zinc/92/47/94/1028924794.db2.gz CSGMEEGTUCXRKF-INIZCTEOSA-N 1 1 312.457 3.757 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000816592282 1028938391 /nfs/dbraw/zinc/93/83/91/1028938391.db2.gz FSEPNJLCLDLTJS-MRVPVSSYSA-N 1 1 311.706 3.959 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000816592282 1028938380 /nfs/dbraw/zinc/93/83/80/1028938380.db2.gz FSEPNJLCLDLTJS-MRVPVSSYSA-N 1 1 311.706 3.959 20 10 DHCDMO Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816593184 1028939009 /nfs/dbraw/zinc/93/90/09/1028939009.db2.gz HWEFEYGYTJKTLT-QGZVFWFLSA-N 1 1 321.424 3.659 20 10 DHCDMO OCCC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCCCC1 ZINC000816555133 1028940950 /nfs/dbraw/zinc/94/09/50/1028940950.db2.gz VCSRSJIFRFOWST-UHFFFAOYSA-N 1 1 315.816 3.607 20 10 DHCDMO Cc1nc(C[NH2+]Cc2cc(Cl)c(F)cc2O)sc1C ZINC000816554305 1028941187 /nfs/dbraw/zinc/94/11/87/1028941187.db2.gz UPLJZQDGTBRVQZ-UHFFFAOYSA-N 1 1 300.786 3.548 20 10 DHCDMO CC[NH+]1CCC(CC[NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000816553994 1028942178 /nfs/dbraw/zinc/94/21/78/1028942178.db2.gz LYDUIXFHIDVIRS-UHFFFAOYSA-N 1 1 312.457 3.757 20 10 DHCDMO C[C@H]1[C@@H](N2CCCC2)CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816610051 1028958903 /nfs/dbraw/zinc/95/89/03/1028958903.db2.gz WKUOGVJKJDFBCF-KXBFYZLASA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1ccc2ccccc2c1O ZINC000816610051 1028958916 /nfs/dbraw/zinc/95/89/16/1028958916.db2.gz WKUOGVJKJDFBCF-KXBFYZLASA-N 1 1 310.441 3.604 20 10 DHCDMO CCc1ccc([C@H]2CC[N@@H+](Cc3cccc(OC)c3O)C2)cc1 ZINC000816619855 1028967984 /nfs/dbraw/zinc/96/79/84/1028967984.db2.gz YHZGDOYNVADHEL-KRWDZBQOSA-N 1 1 311.425 3.953 20 10 DHCDMO COc1cc2c(cc1Cl)C[N@@H+](Cc1cc(C)ccc1O)CC2 ZINC000816665181 1028984021 /nfs/dbraw/zinc/98/40/21/1028984021.db2.gz WIPLEMIHLWMZDI-UHFFFAOYSA-N 1 1 317.816 3.921 20 10 DHCDMO Cc1nc2c(s1)CCC[C@H]2C[N@H+](C)Cc1ccccc1O ZINC000373594310 1029091531 /nfs/dbraw/zinc/09/15/31/1029091531.db2.gz NVDCJZGERKRUIF-AWEZNQCLSA-N 1 1 302.443 3.709 20 10 DHCDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000817413277 1029152898 /nfs/dbraw/zinc/15/28/98/1029152898.db2.gz VNFLLCQQTPOTMC-JKSUJKDBSA-N 1 1 311.425 3.510 20 10 DHCDMO Cc1cc(C)cc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938502 1029281048 /nfs/dbraw/zinc/28/10/48/1029281048.db2.gz LTSSXHXXEBSJJO-OXJNMPFZSA-N 1 1 311.473 3.720 20 10 DHCDMO CCC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817941172 1029282151 /nfs/dbraw/zinc/28/21/51/1029282151.db2.gz JGUMAPNTGRGUMD-ZWKOTPCHSA-N 1 1 317.502 3.945 20 10 DHCDMO Cc1cc(F)ccc1[C@@H](C)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940004 1029284246 /nfs/dbraw/zinc/28/42/46/1029284246.db2.gz DTOJPNWGEQWTLM-AUUYWEPGSA-N 1 1 315.436 3.551 20 10 DHCDMO CCC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817941163 1029285066 /nfs/dbraw/zinc/28/50/66/1029285066.db2.gz JGUMAPNTGRGUMD-MSOLQXFVSA-N 1 1 317.502 3.945 20 10 DHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817943320 1029288984 /nfs/dbraw/zinc/28/89/84/1029288984.db2.gz UJKSWHIAKNWGRI-RTBURBONSA-N 1 1 315.436 3.632 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817980389 1029317689 /nfs/dbraw/zinc/31/76/89/1029317689.db2.gz ALWSEEDHXFKREE-OSMZGAPFSA-N 1 1 316.367 3.579 20 10 DHCDMO C[C@H](NCCC[NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817983444 1029320714 /nfs/dbraw/zinc/32/07/14/1029320714.db2.gz DOVSYQXJQFDLKB-KRWDZBQOSA-N 1 1 315.505 3.860 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccncc1F ZINC000823371807 1030268884 /nfs/dbraw/zinc/26/88/84/1030268884.db2.gz KPLHBYCUNQJETN-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccncc1F ZINC000823371807 1030268895 /nfs/dbraw/zinc/26/88/95/1030268895.db2.gz KPLHBYCUNQJETN-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCOC1)c1ccc(F)cc1O ZINC000866513364 1030340086 /nfs/dbraw/zinc/34/00/86/1030340086.db2.gz VHOGCXUXHPMASF-OWQGQXMQSA-N 1 1 307.409 3.777 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccc(Cl)cc1O ZINC000866530901 1030350361 /nfs/dbraw/zinc/35/03/61/1030350361.db2.gz NRWNOSHSOGBYAC-CHWSQXEVSA-N 1 1 309.837 3.903 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1O ZINC000824695762 1030613209 /nfs/dbraw/zinc/61/32/09/1030613209.db2.gz CJRNXQCDICPTJG-BBWFWOEESA-N 1 1 323.864 3.870 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)cc1C ZINC000824690790 1030614261 /nfs/dbraw/zinc/61/42/61/1030614261.db2.gz LYWLBSOCJDFPFG-QGZVFWFLSA-N 1 1 319.832 3.828 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C(C)(C)C ZINC000824721296 1030620303 /nfs/dbraw/zinc/62/03/03/1030620303.db2.gz CMBIITVPXFXERO-CYBMUJFWSA-N 1 1 310.394 3.613 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)cc1Cl ZINC000824926811 1030674569 /nfs/dbraw/zinc/67/45/69/1030674569.db2.gz HKQBZJPCJVZJTC-BLLLJJGKSA-N 1 1 319.836 3.634 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825133920 1030729549 /nfs/dbraw/zinc/72/95/49/1030729549.db2.gz QDSJDLSPNUPAEU-HXUWFJFHSA-N 1 1 314.473 3.679 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)cc1 ZINC000825133258 1030734741 /nfs/dbraw/zinc/73/47/41/1030734741.db2.gz AYBREEIRXKUWGS-LJQANCHMSA-N 1 1 302.462 3.535 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@H]1n1cccn1)c1ccc(F)cc1O ZINC000248531318 1030736708 /nfs/dbraw/zinc/73/67/08/1030736708.db2.gz XUNUIWRNLPQUFI-APHBMKBZSA-N 1 1 303.381 3.562 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CC[C@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926904403 1030977913 /nfs/dbraw/zinc/97/79/13/1030977913.db2.gz HKGWJGNZXUIRRF-DRCTWCGVSA-N 1 1 321.314 3.682 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccsc1)OCO2 ZINC000054513361 1030980978 /nfs/dbraw/zinc/98/09/78/1030980978.db2.gz IINHQHRJWYQSLP-ZDUSSCGKSA-N 1 1 303.383 3.520 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(F)cc1O ZINC000927089799 1031079816 /nfs/dbraw/zinc/07/98/16/1031079816.db2.gz FRJLGHSBZPTQEO-MRXNPFEDSA-N 1 1 301.361 3.707 20 10 DHCDMO COc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c(C)c1OC ZINC000927122828 1031105646 /nfs/dbraw/zinc/10/56/46/1031105646.db2.gz JXJPIXXOGSGEEL-LBPRGKRZSA-N 1 1 319.376 3.708 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2cc[nH]c2n1 ZINC001144187937 1031322419 /nfs/dbraw/zinc/32/24/19/1031322419.db2.gz PLBDLURQVLUJDW-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CCC1CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144299204 1031439863 /nfs/dbraw/zinc/43/98/63/1031439863.db2.gz RJXCIKZTZSAUGN-UHFFFAOYSA-N 1 1 316.214 3.916 20 10 DHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1[O-] ZINC001144308092 1031459154 /nfs/dbraw/zinc/45/91/54/1031459154.db2.gz OKQVDBIXXKDGBO-ZDUSSCGKSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144308092 1031459163 /nfs/dbraw/zinc/45/91/63/1031459163.db2.gz OKQVDBIXXKDGBO-ZDUSSCGKSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144308092 1031459166 /nfs/dbraw/zinc/45/91/66/1031459166.db2.gz OKQVDBIXXKDGBO-ZDUSSCGKSA-N 1 1 316.214 3.914 20 10 DHCDMO Cc1noc(C)c1C[C@@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293604784 1031538268 /nfs/dbraw/zinc/53/82/68/1031538268.db2.gz LILIAEDBVWATOT-MRVPVSSYSA-N 1 1 312.772 3.510 20 10 DHCDMO Cc1csc([C@@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)n1 ZINC000293624252 1031544695 /nfs/dbraw/zinc/54/46/95/1031544695.db2.gz MSBRLJDUYQOBOR-QMMMGPOBSA-N 1 1 314.813 3.843 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)c1O ZINC000293631427 1031547409 /nfs/dbraw/zinc/54/74/09/1031547409.db2.gz LNPKHBDIFGWIJA-KRWDZBQOSA-N 1 1 321.848 3.745 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872260077 1031565560 /nfs/dbraw/zinc/56/55/60/1031565560.db2.gz IBYBYOFFOVYSFT-QGZVFWFLSA-N 1 1 319.445 3.715 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000293734770 1031593443 /nfs/dbraw/zinc/59/34/43/1031593443.db2.gz WSKDIWKKCURQMB-GFCCVEGCSA-N 1 1 313.800 3.766 20 10 DHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000293912891 1031693881 /nfs/dbraw/zinc/69/38/81/1031693881.db2.gz LWPGCYLVHZNYOV-HNNXBMFYSA-N 1 1 306.768 3.917 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](c3ncc(C)s3)C2)c1 ZINC000361048229 1031697248 /nfs/dbraw/zinc/69/72/48/1031697248.db2.gz KODCJZTUPBZMLH-ZDUSSCGKSA-N 1 1 318.442 3.545 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000361064775 1031704915 /nfs/dbraw/zinc/70/49/15/1031704915.db2.gz BTJRWYRHDRJBJP-UHFFFAOYSA-N 1 1 307.409 3.703 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1 ZINC000846105383 1031879844 /nfs/dbraw/zinc/87/98/44/1031879844.db2.gz TVHIVPBSWWRJFR-IVZVJUQRSA-N 1 1 306.400 3.887 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c(O)c1 ZINC000877470001 1033311535 /nfs/dbraw/zinc/31/15/35/1033311535.db2.gz CJGKSYRQISRIPG-CQSZACIVSA-N 1 1 323.396 3.525 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)c1O ZINC000877812331 1033463318 /nfs/dbraw/zinc/46/33/18/1033463318.db2.gz MXPPLQCTRNSIFA-CQSZACIVSA-N 1 1 303.324 3.565 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)c1O ZINC000877814406 1033466928 /nfs/dbraw/zinc/46/69/28/1033466928.db2.gz YKDNKEKNWJEWPY-AWEZNQCLSA-N 1 1 318.442 3.545 20 10 DHCDMO CO[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001172921098 1033468754 /nfs/dbraw/zinc/46/87/54/1033468754.db2.gz XXAQKEGRYXMFMY-STQMWFEESA-N 1 1 320.820 3.641 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Br)CCC1(F)F ZINC000862369994 1033834374 /nfs/dbraw/zinc/83/43/74/1033834374.db2.gz GLHDQGCEOPFFCW-SECBINFHSA-N 1 1 320.177 3.632 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1F ZINC000862403944 1033842557 /nfs/dbraw/zinc/84/25/57/1033842557.db2.gz YRWJFJHBBWLKNB-HNNXBMFYSA-N 1 1 316.342 3.652 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1F ZINC000862403944 1033842569 /nfs/dbraw/zinc/84/25/69/1033842569.db2.gz YRWJFJHBBWLKNB-HNNXBMFYSA-N 1 1 316.342 3.652 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862482562 1033865027 /nfs/dbraw/zinc/86/50/27/1033865027.db2.gz JVOGUKHSVKBPFG-GOSISDBHSA-N 1 1 317.816 3.529 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000863295521 1034058122 /nfs/dbraw/zinc/05/81/22/1034058122.db2.gz WZNSDUANVWWUMF-CABCVRRESA-N 1 1 321.486 3.865 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](COC)c2ccco2)cc1F ZINC000177573961 1034167446 /nfs/dbraw/zinc/16/74/46/1034167446.db2.gz YSMDNILTLXEOHI-MRXNPFEDSA-N 1 1 320.408 3.742 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCCOC2)cc1F ZINC000119746597 1034232164 /nfs/dbraw/zinc/23/21/64/1034232164.db2.gz HXHPCGNCASSHEU-INIZCTEOSA-N 1 1 308.441 3.530 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000794663716 1034319679 /nfs/dbraw/zinc/31/96/79/1034319679.db2.gz VDFDRAFSPCZBRD-YGRLFVJLSA-N 1 1 310.319 3.713 20 10 DHCDMO Cc1c[nH+]ccc1-n1c(=N)ccc(/N=N/c2ccccc2)c1N ZINC001174536591 1034453106 /nfs/dbraw/zinc/45/31/06/1034453106.db2.gz GBXBXFAUKSQVPP-QNUODCBWSA-N 1 1 304.357 3.658 20 10 DHCDMO CC[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(C)cc1O ZINC000794812759 1034520844 /nfs/dbraw/zinc/52/08/44/1034520844.db2.gz FTDHBBLKAAJQLF-KRWDZBQOSA-N 1 1 304.478 3.863 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)c1 ZINC000185459283 1034547801 /nfs/dbraw/zinc/54/78/01/1034547801.db2.gz YRONCSAAWQMDJN-CQSZACIVSA-N 1 1 316.420 3.752 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)cc1 ZINC000865404450 1034627294 /nfs/dbraw/zinc/62/72/94/1034627294.db2.gz LDHMHVQXHLJQIJ-UHFFFAOYSA-N 1 1 310.228 3.744 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1C ZINC000186422586 1034629914 /nfs/dbraw/zinc/62/99/14/1034629914.db2.gz SAYUQFZQSLUMFA-UHFFFAOYSA-N 1 1 318.417 3.602 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CC[C@H](O)C1)c1cc(Cl)c(Cl)cc1O ZINC000193348909 1034842302 /nfs/dbraw/zinc/84/23/02/1034842302.db2.gz OSGNWHIEIXSHPE-AEJSXWLSSA-N 1 1 304.217 3.511 20 10 DHCDMO CCCOc1ccc(CN[C@@H](C)C[NH+]2CCC(C)CC2)cc1C ZINC001179148649 1035467323 /nfs/dbraw/zinc/46/73/23/1035467323.db2.gz QHHZPYQQOQRDAV-SFHVURJKSA-N 1 1 318.505 3.994 20 10 DHCDMO CC1(C)CCC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)O1 ZINC001179740387 1035495665 /nfs/dbraw/zinc/49/56/65/1035495665.db2.gz NAYHSIDSCXTFGL-SNVBAGLBSA-N 1 1 301.789 3.622 20 10 DHCDMO CC[NH+](CC)CC[C@@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC001179830070 1035510000 /nfs/dbraw/zinc/51/00/00/1035510000.db2.gz KEOBZFLMLGDUEL-GOSISDBHSA-N 1 1 317.521 3.887 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc(Cl)cc2O)C1 ZINC001180042988 1035572407 /nfs/dbraw/zinc/57/24/07/1035572407.db2.gz NQJIOXOWLZKFFU-VBQJREDUSA-N 1 1 322.880 3.883 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(O)c1 ZINC001180077784 1035585801 /nfs/dbraw/zinc/58/58/01/1035585801.db2.gz VJAISQNBKQOBMC-QGZVFWFLSA-N 1 1 311.425 3.774 20 10 DHCDMO COc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247835 1035593861 /nfs/dbraw/zinc/59/38/61/1035593861.db2.gz AMLLGETVDJYYPA-SJLPKXTDSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC001193247835 1035593864 /nfs/dbraw/zinc/59/38/64/1035593864.db2.gz AMLLGETVDJYYPA-SJLPKXTDSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247835 1035593867 /nfs/dbraw/zinc/59/38/67/1035593867.db2.gz AMLLGETVDJYYPA-SJLPKXTDSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247836 1035594509 /nfs/dbraw/zinc/59/45/09/1035594509.db2.gz AMLLGETVDJYYPA-WMZOPIPTSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC001193247836 1035594520 /nfs/dbraw/zinc/59/45/20/1035594520.db2.gz AMLLGETVDJYYPA-WMZOPIPTSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247836 1035594529 /nfs/dbraw/zinc/59/45/29/1035594529.db2.gz AMLLGETVDJYYPA-WMZOPIPTSA-N 1 1 316.489 3.746 20 10 DHCDMO C[N@@H+](Cc1ccc(Br)cc1O)C[C@@H]1CC=CCC1 ZINC001180311262 1035640915 /nfs/dbraw/zinc/64/09/15/1035640915.db2.gz ZSCHWLOLSFNHAL-GFCCVEGCSA-N 1 1 310.235 3.943 20 10 DHCDMO C[N@H+](Cc1ccc(Br)cc1O)C[C@@H]1CC=CCC1 ZINC001180311262 1035640927 /nfs/dbraw/zinc/64/09/27/1035640927.db2.gz ZSCHWLOLSFNHAL-GFCCVEGCSA-N 1 1 310.235 3.943 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1CC2(CCC2)CO1 ZINC001193838304 1035735966 /nfs/dbraw/zinc/73/59/66/1035735966.db2.gz ITSCSCQECXMJBM-KRWDZBQOSA-N 1 1 303.446 3.954 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180970702 1035799655 /nfs/dbraw/zinc/79/96/55/1035799655.db2.gz WBKRXVGVKNVVRO-KCJUWKMLSA-N 1 1 309.278 3.833 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001180970702 1035799663 /nfs/dbraw/zinc/79/96/63/1035799663.db2.gz WBKRXVGVKNVVRO-KCJUWKMLSA-N 1 1 309.278 3.833 20 10 DHCDMO [O-]c1c(F)c(F)ccc1CN1CC(Cc2ccccc2Cl)C1 ZINC001181544440 1035936364 /nfs/dbraw/zinc/93/63/64/1035936364.db2.gz QWYCQPNPUXSYFK-UHFFFAOYSA-N 1 1 323.770 3.998 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccco1)c1cc(Cl)c(Cl)cc1O ZINC000774115006 1036156779 /nfs/dbraw/zinc/15/67/79/1036156779.db2.gz JJDFBXIYULBZEV-ISVAXAHUSA-N 1 1 316.184 3.676 20 10 DHCDMO C[C@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774160828 1036208924 /nfs/dbraw/zinc/20/89/24/1036208924.db2.gz BRPYQBRKCZQCPR-UWVGGRQHSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647614 1036212054 /nfs/dbraw/zinc/21/20/54/1036212054.db2.gz ZCVCVHCPXJYDMA-SFHVURJKSA-N 1 1 323.484 3.631 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647614 1036212069 /nfs/dbraw/zinc/21/20/69/1036212069.db2.gz ZCVCVHCPXJYDMA-SFHVURJKSA-N 1 1 323.484 3.631 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647613 1036212910 /nfs/dbraw/zinc/21/29/10/1036212910.db2.gz ZCVCVHCPXJYDMA-GOSISDBHSA-N 1 1 323.484 3.631 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCN(C)CC2)cc1 ZINC000775647613 1036212941 /nfs/dbraw/zinc/21/29/41/1036212941.db2.gz ZCVCVHCPXJYDMA-GOSISDBHSA-N 1 1 323.484 3.631 20 10 DHCDMO C[C@H]([NH2+]CCOCC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774174023 1036213449 /nfs/dbraw/zinc/21/34/49/1036213449.db2.gz NFVFSHCSLMWMJJ-VIFPVBQESA-N 1 1 304.217 3.776 20 10 DHCDMO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCC[C@H]1C ZINC001195358060 1036225909 /nfs/dbraw/zinc/22/59/09/1036225909.db2.gz KCKWXYFIFGUPRR-CVEARBPZSA-N 1 1 319.445 3.584 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207483 1036228788 /nfs/dbraw/zinc/22/87/88/1036228788.db2.gz VUYBQELILONETQ-DCAQKATOSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207483 1036228807 /nfs/dbraw/zinc/22/88/07/1036228807.db2.gz VUYBQELILONETQ-DCAQKATOSA-N 1 1 317.260 3.832 20 10 DHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc(OC)ccc1O ZINC000775654314 1036242625 /nfs/dbraw/zinc/24/26/25/1036242625.db2.gz YCZBLHDQAQDDHP-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CCC[N@@H+](C)CC(C)(C)NCc1ccc(N(CC)CC)c(F)c1 ZINC001203223705 1036268174 /nfs/dbraw/zinc/26/81/74/1036268174.db2.gz ZMJDLSSIWNGQNV-UHFFFAOYSA-N 1 1 323.500 3.882 20 10 DHCDMO CCCN(C)CC(C)(C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001203223705 1036268192 /nfs/dbraw/zinc/26/81/92/1036268192.db2.gz ZMJDLSSIWNGQNV-UHFFFAOYSA-N 1 1 323.500 3.882 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C[C@H](C)O)c1O ZINC000775659631 1036273117 /nfs/dbraw/zinc/27/31/17/1036273117.db2.gz ZRXGHSFQODKJAC-AWEZNQCLSA-N 1 1 319.832 3.737 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774349883 1036314385 /nfs/dbraw/zinc/31/43/85/1036314385.db2.gz VZXNDMRWMYUCOV-VHSXEESVSA-N 1 1 304.217 3.776 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@H](CCO)c1ccccc1 ZINC000775698702 1036473631 /nfs/dbraw/zinc/47/36/31/1036473631.db2.gz QXYSAAGPTUCXOR-MRXNPFEDSA-N 1 1 323.795 3.740 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC001182960426 1036487701 /nfs/dbraw/zinc/48/77/01/1036487701.db2.gz RFHYELFRJPFSPS-QGZVFWFLSA-N 1 1 304.340 3.696 20 10 DHCDMO CC1(C)CCC(O)(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC001183046057 1036506095 /nfs/dbraw/zinc/50/60/95/1036506095.db2.gz SLSNOZCXYANNHV-UHFFFAOYSA-N 1 1 315.816 3.606 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](C1CCC1)[C@H]1CCCO1 ZINC001183123211 1036520588 /nfs/dbraw/zinc/52/05/88/1036520588.db2.gz MVJVIZMJFFISPH-HZPDHXFCSA-N 1 1 313.800 3.622 20 10 DHCDMO CCN1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715929 1036534431 /nfs/dbraw/zinc/53/44/31/1036534431.db2.gz MIHRYYSLKIBPLM-CJNGLKHVSA-N 1 1 310.869 3.659 20 10 DHCDMO CCN1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715929 1036534441 /nfs/dbraw/zinc/53/44/41/1036534441.db2.gz MIHRYYSLKIBPLM-CJNGLKHVSA-N 1 1 310.869 3.659 20 10 DHCDMO COCC[N@@H+](Cc1ccc(C)o1)Cc1cc(Cl)cc(C)c1O ZINC000775724763 1036565297 /nfs/dbraw/zinc/56/52/97/1036565297.db2.gz IAHWOXCVJOHOPT-UHFFFAOYSA-N 1 1 323.820 3.904 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H](CC(=O)OC(C)(C)C)C2)c1O ZINC000775737517 1036587762 /nfs/dbraw/zinc/58/77/62/1036587762.db2.gz JFEIEHSBRWJTDI-OAHLLOKOSA-N 1 1 319.445 3.644 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@@H+](C(C)C)C2CC2)c1O ZINC000915202703 1036697006 /nfs/dbraw/zinc/69/70/06/1036697006.db2.gz MLCQRQFYKAIHJV-UHFFFAOYSA-N 1 1 313.397 3.705 20 10 DHCDMO CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2F)C12CCC2 ZINC001183920316 1036712293 /nfs/dbraw/zinc/71/22/93/1036712293.db2.gz WWPGFRNQEFXSEH-HOTGVXAUSA-N 1 1 307.409 3.747 20 10 DHCDMO CCOc1ccc(CC[N@@H+](C)Cc2cc(F)ccc2O)cc1 ZINC001184229289 1036781805 /nfs/dbraw/zinc/78/18/05/1036781805.db2.gz QSROBHKSOUJOJL-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO COc1ccc(CNC[C@@H](C2CCCCC2)[NH+](C)C)cc1C ZINC000915684545 1037132629 /nfs/dbraw/zinc/13/26/29/1037132629.db2.gz SXEOVZBTLMTYAJ-SFHVURJKSA-N 1 1 304.478 3.604 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H]2CCC(C)C)ccc1[N+](=O)[O-] ZINC000774910649 1037201866 /nfs/dbraw/zinc/20/18/66/1037201866.db2.gz UCVAREZRPUXDCX-CQSZACIVSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2CCC(C)C)ccc1[N+](=O)[O-] ZINC000774910649 1037201878 /nfs/dbraw/zinc/20/18/78/1037201878.db2.gz UCVAREZRPUXDCX-CQSZACIVSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H](C)CCCC(C)C)ccc1[N+](=O)[O-] ZINC000774941829 1037248575 /nfs/dbraw/zinc/24/85/75/1037248575.db2.gz FHIQSQHMUIEONB-LBPRGKRZSA-N 1 1 310.394 3.613 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000776014804 1037299080 /nfs/dbraw/zinc/29/90/80/1037299080.db2.gz QNZSIFISLYBBKV-IBGZPJMESA-N 1 1 313.372 3.553 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c1 ZINC000776013868 1037304713 /nfs/dbraw/zinc/30/47/13/1037304713.db2.gz JOQFIEJVXJRRJJ-HXUWFJFHSA-N 1 1 309.409 3.722 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776012127 1037305689 /nfs/dbraw/zinc/30/56/89/1037305689.db2.gz CZCFQLNVGUGONW-SMDDNHRTSA-N 1 1 317.351 3.954 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000774975056 1037318572 /nfs/dbraw/zinc/31/85/72/1037318572.db2.gz NZXKISTUAGUJNC-JTQLQIEISA-N 1 1 322.386 3.530 20 10 DHCDMO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775005225 1037365384 /nfs/dbraw/zinc/36/53/84/1037365384.db2.gz QKPMPIIEXPHMMF-GXTWGEPZSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H](C)CCC(C)(C)C)ccc1[N+](=O)[O-] ZINC000775026952 1037431842 /nfs/dbraw/zinc/43/18/42/1037431842.db2.gz BZWQSURGRZGKRB-NSHDSACASA-N 1 1 310.394 3.613 20 10 DHCDMO Oc1cccc(NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1O ZINC001201474932 1037739679 /nfs/dbraw/zinc/73/96/79/1037739679.db2.gz NZCFUBTXGKBPGH-SJORKVTESA-N 1 1 322.408 3.831 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCC12CCOCC2 ZINC000775156611 1037767218 /nfs/dbraw/zinc/76/72/18/1037767218.db2.gz GAPDGPGBVJXINH-UHFFFAOYSA-N 1 1 309.409 3.814 20 10 DHCDMO C[C@@H](CSc1ncc(C(C)(C)C)s1)C[NH+]1CCOCC1 ZINC001188942803 1038015839 /nfs/dbraw/zinc/01/58/39/1038015839.db2.gz UKLAUGSWVDJMAQ-GFCCVEGCSA-N 1 1 314.520 3.501 20 10 DHCDMO COc1ccc(N2CC[NH+]([C@H](C)c3ccccc3F)CC2)cc1 ZINC000916984593 1038102439 /nfs/dbraw/zinc/10/24/39/1038102439.db2.gz KCOZXUVNTHGJKQ-OAHLLOKOSA-N 1 1 314.404 3.718 20 10 DHCDMO COc1ccc(OCC[N@@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000917066449 1038157759 /nfs/dbraw/zinc/15/77/59/1038157759.db2.gz GZVZKZWFRWHDMI-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(C)cc3)CC2)cc1 ZINC000917089661 1038187380 /nfs/dbraw/zinc/18/73/80/1038187380.db2.gz BRWFQDMARDLDNZ-UHFFFAOYSA-N 1 1 310.441 3.716 20 10 DHCDMO COC[C@@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C(C)C ZINC001192014510 1038579934 /nfs/dbraw/zinc/57/99/34/1038579934.db2.gz SSVLPYVFYMPIMY-QGZVFWFLSA-N 1 1 317.429 3.906 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1O ZINC000775522715 1038633843 /nfs/dbraw/zinc/63/38/43/1038633843.db2.gz YMVCSTBJLBIRHV-UONOGXRCSA-N 1 1 305.809 3.887 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCS[C@H](C(C)C)C2)c1O ZINC000761203785 1040577492 /nfs/dbraw/zinc/57/74/92/1040577492.db2.gz MGRPVKLFYPFLLL-AWEZNQCLSA-N 1 1 315.866 3.628 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)c(O)c1 ZINC000092729618 185336545 /nfs/dbraw/zinc/33/65/45/185336545.db2.gz CIMGMNBAHWWNSX-MRXNPFEDSA-N 1 1 315.417 3.631 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)c(O)c1 ZINC000092729618 185336546 /nfs/dbraw/zinc/33/65/46/185336546.db2.gz CIMGMNBAHWWNSX-MRXNPFEDSA-N 1 1 315.417 3.631 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(C)ccc1O)CCC2 ZINC000093365151 193240133 /nfs/dbraw/zinc/24/01/33/193240133.db2.gz HEVPZJLPMPYMNR-HNNXBMFYSA-N 1 1 302.443 3.975 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000273300311 130105358 /nfs/dbraw/zinc/10/53/58/130105358.db2.gz BEXJUCSDLSBIPL-SJKOYZFVSA-N 1 1 311.381 3.517 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)c(O)c1C ZINC000273525898 130132231 /nfs/dbraw/zinc/13/22/31/130132231.db2.gz VCLLMCATTRIGHI-BLLLJJGKSA-N 1 1 321.367 3.671 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1O ZINC000273533379 130133335 /nfs/dbraw/zinc/13/33/35/130133335.db2.gz WVRSSGFZYVQJJB-GHMZBOCLSA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@@H]([NH2+]CCC1(O)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000284195992 131057734 /nfs/dbraw/zinc/05/77/34/131057734.db2.gz BJBGKDGQMPKXJL-SECBINFHSA-N 1 1 304.217 3.655 20 10 DHCDMO C[C@@]12CC[N@@H+](Cc3cc(F)ccc3O)C[C@@H]1C2(Cl)Cl ZINC000284381861 131075714 /nfs/dbraw/zinc/07/57/14/131075714.db2.gz OKZDVAUNNXPPBI-QWHCGFSZSA-N 1 1 304.192 3.547 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(NC(C)=O)cc1)c1ccc(F)cc1O ZINC000285543441 131179855 /nfs/dbraw/zinc/17/98/55/131179855.db2.gz GBDNYTQPDBQETB-QGZVFWFLSA-N 1 1 316.376 3.731 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1ccc(F)cc1O ZINC000285806842 131203102 /nfs/dbraw/zinc/20/31/02/131203102.db2.gz VQRAFIXCJSHDHO-OAHLLOKOSA-N 1 1 317.360 3.543 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(F)cc1O ZINC000286161794 131223157 /nfs/dbraw/zinc/22/31/57/131223157.db2.gz PWINEUGLLFKJBT-SJKOYZFVSA-N 1 1 303.377 3.826 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(F)cc1O ZINC000286225538 131225500 /nfs/dbraw/zinc/22/55/00/131225500.db2.gz SNGZBXSYSFNNKD-MRXNPFEDSA-N 1 1 302.393 3.838 20 10 DHCDMO CN(c1ccc(C[NH2+][C@@H]2CCn3ccnc32)cc1)C1CCCCC1 ZINC000297864396 132037592 /nfs/dbraw/zinc/03/75/92/132037592.db2.gz UHVDETBJIXGKKE-LJQANCHMSA-N 1 1 324.472 3.887 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC(C)=C(C)C3)cc2)CC1 ZINC000295849689 335140094 /nfs/dbraw/zinc/14/00/94/335140094.db2.gz BCTFKKYKHNLQIL-UHFFFAOYSA-N 1 1 314.473 3.844 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H](C)CCO)c1cc(Cl)c(Cl)cc1O ZINC000297269545 335152580 /nfs/dbraw/zinc/15/25/80/335152580.db2.gz KQPFMRVRQYEKIF-VHSXEESVSA-N 1 1 306.233 3.758 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000271362397 334021460 /nfs/dbraw/zinc/02/14/60/334021460.db2.gz NPNMQTASPHGNMK-ZBFHGGJFSA-N 1 1 303.427 3.542 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC2(CCOCC2)CC1 ZINC000375315974 337007846 /nfs/dbraw/zinc/00/78/46/337007846.db2.gz CMZFOONLKLBZBB-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1 ZINC000375531017 337012906 /nfs/dbraw/zinc/01/29/06/337012906.db2.gz YQSVPCQJJPXCPG-YQVWRLOYSA-N 1 1 303.446 3.606 20 10 DHCDMO C[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(F)cc1O ZINC000376131952 337027987 /nfs/dbraw/zinc/02/79/87/337027987.db2.gz QAJGWUJCLMKUCK-ZDUSSCGKSA-N 1 1 300.377 3.699 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000377631069 337056904 /nfs/dbraw/zinc/05/69/04/337056904.db2.gz SLSNMOQQJSVHPC-UKRRQHHQSA-N 1 1 317.351 3.623 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@@H](CC)O[C@@]2(CCCOC2)C1 ZINC000377697529 337058896 /nfs/dbraw/zinc/05/88/96/337058896.db2.gz NPQSZUCXRLMYQA-SUMDDJOVSA-N 1 1 319.445 3.503 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000377835784 337062176 /nfs/dbraw/zinc/06/21/76/337062176.db2.gz WLVGGUYVJYCQJA-JYJNAYRXSA-N 1 1 319.445 3.600 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@H]2c2ccc(C)o2)c1 ZINC000378445161 337072871 /nfs/dbraw/zinc/07/28/71/337072871.db2.gz SHZIIEDUUDCAOJ-HNNXBMFYSA-N 1 1 319.426 3.592 20 10 DHCDMO COc1cccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c1O ZINC000360078041 337085055 /nfs/dbraw/zinc/08/50/55/337085055.db2.gz FVFAENXZIHATOS-KRWDZBQOSA-N 1 1 315.438 3.691 20 10 DHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000179963870 337172794 /nfs/dbraw/zinc/17/27/94/337172794.db2.gz MJJAVYQZDUEGFS-LBPRGKRZSA-N 1 1 308.834 3.882 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)c1O ZINC000180629065 337176775 /nfs/dbraw/zinc/17/67/75/337176775.db2.gz ZJPREEKHMBVWND-OAHLLOKOSA-N 1 1 307.777 3.521 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccco3)C2)c1O ZINC000180629065 337176776 /nfs/dbraw/zinc/17/67/76/337176776.db2.gz ZJPREEKHMBVWND-OAHLLOKOSA-N 1 1 307.777 3.521 20 10 DHCDMO C[C@H]([NH2+]C1CCN(c2cccs2)CC1)c1ccc(F)cc1O ZINC000185692324 337250130 /nfs/dbraw/zinc/25/01/30/337250130.db2.gz WSRQQVPAUGQYAL-LBPRGKRZSA-N 1 1 320.433 3.912 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000121139244 337396298 /nfs/dbraw/zinc/39/62/98/337396298.db2.gz PQPBYNGWYNGIFE-QGZVFWFLSA-N 1 1 320.392 3.594 20 10 DHCDMO CC[C@H]([NH2+]C1CCN(C(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000180404454 522560391 /nfs/dbraw/zinc/56/03/91/522560391.db2.gz GMUXGANOFQUNED-IBGZPJMESA-N 1 1 303.494 3.666 20 10 DHCDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c1 ZINC000124240319 524178102 /nfs/dbraw/zinc/17/81/02/524178102.db2.gz CZVZOAAQHRPAOV-QGZVFWFLSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1O ZINC000180545843 524405438 /nfs/dbraw/zinc/40/54/38/524405438.db2.gz XFHAZDSCKUFOEO-CJNGLKHVSA-N 1 1 303.427 3.724 20 10 DHCDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)cc1O ZINC000368482636 525639184 /nfs/dbraw/zinc/63/91/84/525639184.db2.gz NVBWUJYGJREPPQ-YNHOBRIKSA-N 1 1 305.324 3.843 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c1O ZINC000131579114 525916843 /nfs/dbraw/zinc/91/68/43/525916843.db2.gz CRHGXMMKYQGYER-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1)c1ccc(F)cc1O ZINC000285535308 535898972 /nfs/dbraw/zinc/89/89/72/535898972.db2.gz BWMFJIJGCWLGKG-INIZCTEOSA-N 1 1 316.376 3.601 20 10 DHCDMO Cc1cnc(C2CC[NH+](Cc3cc(F)cc(F)c3O)CC2)s1 ZINC000894564692 1013421063 /nfs/dbraw/zinc/42/10/63/1013421063.db2.gz CZOJGUBVSALOPU-UHFFFAOYSA-N 1 1 324.396 3.815 20 10 DHCDMO CC(=O)c1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)on1 ZINC000846803413 1032086775 /nfs/dbraw/zinc/08/67/75/1032086775.db2.gz CGOZFZWWFQILPX-UHFFFAOYSA-N 1 1 314.385 3.528 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)c1 ZINC000160628759 1014337636 /nfs/dbraw/zinc/33/76/36/1014337636.db2.gz DSSMQWZZWRDOFJ-UHFFFAOYSA-N 1 1 307.340 3.934 20 10 DHCDMO CN1CC[C@@]2(C1)CCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474503 1014430657 /nfs/dbraw/zinc/43/06/57/1014430657.db2.gz ODXLFQOQZVIIPL-HXUWFJFHSA-N 1 1 316.489 3.607 20 10 DHCDMO CN1CC[C@@]2(C1)CCC[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474503 1014430663 /nfs/dbraw/zinc/43/06/63/1014430663.db2.gz ODXLFQOQZVIIPL-HXUWFJFHSA-N 1 1 316.489 3.607 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001167474151 1015056388 /nfs/dbraw/zinc/05/63/88/1015056388.db2.gz PYYOFLGPJOKZQR-ZWKOTPCHSA-N 1 1 304.478 3.778 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](c3nccs3)C2)c(Cl)c1 ZINC000895585451 1015212757 /nfs/dbraw/zinc/21/27/57/1015212757.db2.gz XRTRHMOJNZTHJJ-LLVKDONJSA-N 1 1 308.834 3.800 20 10 DHCDMO Cc1cc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)ccc1N(C)C ZINC001167558573 1016535103 /nfs/dbraw/zinc/53/51/03/1016535103.db2.gz PEVSMZQAHBLIES-MSOLQXFVSA-N 1 1 304.503 3.921 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)CCC3CC3)cc2)CC1 ZINC000294851044 1032180880 /nfs/dbraw/zinc/18/08/80/1032180880.db2.gz BCBOKVNFUDZRPV-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cc(Cl)c(Cl)cc1O ZINC000840815271 1017076627 /nfs/dbraw/zinc/07/66/27/1017076627.db2.gz DHUMPUXLMKEEQY-BDAKNGLRSA-N 1 1 314.216 3.844 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)cc1 ZINC000773135309 1032568173 /nfs/dbraw/zinc/56/81/73/1032568173.db2.gz COGVFAIKZFPSCP-ZIAGYGMSSA-N 1 1 315.465 3.796 20 10 DHCDMO CCc1ccc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)o1 ZINC000160185663 1011952842 /nfs/dbraw/zinc/95/28/42/1011952842.db2.gz MTTSVJHTFHKSMQ-KRWDZBQOSA-N 1 1 315.413 3.729 20 10 DHCDMO COc1ccc(C[N@@H+](C)C(C)(C)c2ccccc2)c(O)c1OC ZINC000894295175 1012204325 /nfs/dbraw/zinc/20/43/25/1012204325.db2.gz PEQLHZUPAFJVOQ-UHFFFAOYSA-N 1 1 315.413 3.777 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1C ZINC000729852090 1032658317 /nfs/dbraw/zinc/65/83/17/1032658317.db2.gz NSVUJDNWLIWGRF-HXUWFJFHSA-N 1 1 311.425 3.973 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1C ZINC000773256177 1032661004 /nfs/dbraw/zinc/66/10/04/1032661004.db2.gz BFYJGAWEQRCGSU-DLBZAZTESA-N 1 1 303.446 3.648 20 10 DHCDMO Cc1cc([O-])c(C[NH+]2CCC(CC[NH+](C)C)CC2)c(Cl)c1 ZINC000840911929 1017459574 /nfs/dbraw/zinc/45/95/74/1017459574.db2.gz USCRLYKFCBSHIV-UHFFFAOYSA-N 1 1 310.869 3.518 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1O ZINC000363533851 1018013499 /nfs/dbraw/zinc/01/34/99/1018013499.db2.gz JWUKISVENJHYTK-UAGQMJEPSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533851 1018013515 /nfs/dbraw/zinc/01/35/15/1018013515.db2.gz JWUKISVENJHYTK-UAGQMJEPSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533851 1018013527 /nfs/dbraw/zinc/01/35/27/1018013527.db2.gz JWUKISVENJHYTK-UAGQMJEPSA-N 1 1 310.441 3.823 20 10 DHCDMO Cc1nc(C)c(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000741806240 1018274088 /nfs/dbraw/zinc/27/40/88/1018274088.db2.gz QKDKHMHLMMOYJD-UHFFFAOYSA-N 1 1 315.486 3.991 20 10 DHCDMO C[C@H]1OCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)[C@@H]1C ZINC000765099783 1018476178 /nfs/dbraw/zinc/47/61/78/1018476178.db2.gz KEWGZLSTKRQTLS-CHWSQXEVSA-N 1 1 311.381 3.901 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1O ZINC000187593056 1019755768 /nfs/dbraw/zinc/75/57/68/1019755768.db2.gz OGPHEZLAUMRMSU-LBPRGKRZSA-N 1 1 319.351 3.669 20 10 DHCDMO CO[C@H]1CCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000728049922 1019867672 /nfs/dbraw/zinc/86/76/72/1019867672.db2.gz NRPLUIJMUPNBMF-AWEZNQCLSA-N 1 1 311.381 3.902 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cn2ccc(-c3ccccc3)n2)cc1 ZINC000731657222 1020128452 /nfs/dbraw/zinc/12/84/52/1020128452.db2.gz FFSRGUXCIWNXOD-UHFFFAOYSA-N 1 1 320.440 3.706 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cn2ccc(-c3ccccc3)n2)cc1 ZINC000731657222 1020128462 /nfs/dbraw/zinc/12/84/62/1020128462.db2.gz FFSRGUXCIWNXOD-UHFFFAOYSA-N 1 1 320.440 3.706 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCC3(CCCCC3)C1)OCO2 ZINC000732191449 1020205452 /nfs/dbraw/zinc/20/54/52/1020205452.db2.gz YFHXVKKZKKAINL-UHFFFAOYSA-N 1 1 303.402 3.667 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccc(F)cc1O ZINC000186332243 1020241667 /nfs/dbraw/zinc/24/16/67/1020241667.db2.gz SRUHQWDJMTUSRB-NJSLBKSFSA-N 1 1 316.420 3.873 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1ccc(F)cc1O ZINC000858452449 1032903437 /nfs/dbraw/zinc/90/34/37/1032903437.db2.gz CGAMEDAWJZYYPL-FUHWJXTLSA-N 1 1 315.388 3.714 20 10 DHCDMO CCCC[N@@H+](Cc1nccn1C(C)C)Cc1ccccc1O ZINC000282474415 1020573653 /nfs/dbraw/zinc/57/36/53/1020573653.db2.gz ODRXNNPCKMMCRW-UHFFFAOYSA-N 1 1 301.434 3.972 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490325 1032918139 /nfs/dbraw/zinc/91/81/39/1032918139.db2.gz GFWNYCYCWRQUJS-HOTGVXAUSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490325 1032918147 /nfs/dbraw/zinc/91/81/47/1032918147.db2.gz GFWNYCYCWRQUJS-HOTGVXAUSA-N 1 1 312.457 3.928 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC000187594055 1020806363 /nfs/dbraw/zinc/80/63/63/1020806363.db2.gz LJPNEKJRMJRNCL-GFCCVEGCSA-N 1 1 319.351 3.669 20 10 DHCDMO CCc1cc(C[N@H+]2CCCO[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000738160316 1020863454 /nfs/dbraw/zinc/86/34/54/1020863454.db2.gz IKTLCBQNIGZJHV-CQSZACIVSA-N 1 1 305.462 3.863 20 10 DHCDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738244047 1020867827 /nfs/dbraw/zinc/86/78/27/1020867827.db2.gz ULQCKVOMLQTEDX-MRXNPFEDSA-N 1 1 311.381 3.630 20 10 DHCDMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000738298935 1020871064 /nfs/dbraw/zinc/87/10/64/1020871064.db2.gz JGKGFEDJDSUCON-UHFFFAOYSA-N 1 1 324.468 3.772 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CO[C@@H](C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000858547052 1032941043 /nfs/dbraw/zinc/94/10/43/1032941043.db2.gz HYDXSNQTFNUPEY-KPWYMIHSSA-N 1 1 316.228 3.917 20 10 DHCDMO CCN(CC)c1ccc(CNCC2([NH+](C)C)CCCC2)cc1F ZINC000740000316 1020923312 /nfs/dbraw/zinc/92/33/12/1020923312.db2.gz ARTAVUCCEOHPRB-UHFFFAOYSA-N 1 1 321.484 3.636 20 10 DHCDMO CO[C@H]1C[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858592460 1032957656 /nfs/dbraw/zinc/95/76/56/1032957656.db2.gz CGTHWECXWOSQOW-BBBLOLIVSA-N 1 1 304.217 3.775 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@](C)(F)CC2)c(O)c1 ZINC001140850995 1021248397 /nfs/dbraw/zinc/24/83/97/1021248397.db2.gz XTGJZSAUPZVZKI-SFHVURJKSA-N 1 1 308.441 3.953 20 10 DHCDMO CCC[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)C(C)(C)C ZINC001202466796 1021257580 /nfs/dbraw/zinc/25/75/80/1021257580.db2.gz QAVJJJFUTKMJCH-IBGZPJMESA-N 1 1 317.521 3.743 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCCCC1)OCO2 ZINC000917477799 1021272116 /nfs/dbraw/zinc/27/21/16/1021272116.db2.gz JHSGXJXAKVLIHU-OAHLLOKOSA-N 1 1 303.402 3.666 20 10 DHCDMO CCN(CC)[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743394074 1021281273 /nfs/dbraw/zinc/28/12/73/1021281273.db2.gz CINLEZHZRJXFSH-KRWDZBQOSA-N 1 1 304.478 3.740 20 10 DHCDMO CCN(CC)[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743394074 1021281281 /nfs/dbraw/zinc/28/12/81/1021281281.db2.gz CINLEZHZRJXFSH-KRWDZBQOSA-N 1 1 304.478 3.740 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H](C)S1 ZINC000743378269 1021283613 /nfs/dbraw/zinc/28/36/13/1021283613.db2.gz UXZSRULNLWAZQI-TXEJJXNPSA-N 1 1 309.475 3.721 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)CC1CCC1 ZINC000743840580 1021374611 /nfs/dbraw/zinc/37/46/11/1021374611.db2.gz GDNAEUXTNPYONZ-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3cccc(OC4CC4)c3F)ccc21 ZINC000850217695 1021444989 /nfs/dbraw/zinc/44/49/89/1021444989.db2.gz JKNXIUPACNQCAJ-UHFFFAOYSA-N 1 1 311.360 3.866 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000850408691 1021515639 /nfs/dbraw/zinc/51/56/39/1021515639.db2.gz CSKXHIUMKKUQAH-XQAQDONZSA-N 1 1 321.754 3.752 20 10 DHCDMO COC1CC(CC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850481915 1021556715 /nfs/dbraw/zinc/55/67/15/1021556715.db2.gz KZIXMJPMCYKOHT-VOMCLLRMSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H]([NH2+][C@H]1C=CCC1)c1cc(Br)c(F)cc1O ZINC000850510701 1021568834 /nfs/dbraw/zinc/56/88/34/1021568834.db2.gz WPAVVXGFFSRSIF-IUCAKERBSA-N 1 1 300.171 3.663 20 10 DHCDMO COc1ccnc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)c1F ZINC000850536414 1021589328 /nfs/dbraw/zinc/58/93/28/1021589328.db2.gz KEKGJHGPHZBQJS-JTQLQIEISA-N 1 1 324.783 3.748 20 10 DHCDMO C[C@H]([NH2+]CC1(C(=O)OC(C)(C)C)CCC1)c1ccc(F)cc1O ZINC000850573962 1021616079 /nfs/dbraw/zinc/61/60/79/1021616079.db2.gz UIKVMJHBMQMINF-LBPRGKRZSA-N 1 1 323.408 3.694 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1nccn1C ZINC000850573034 1021616520 /nfs/dbraw/zinc/61/65/20/1021616520.db2.gz SODZCZXZYXLTJW-UWVGGRQHSA-N 1 1 313.323 3.556 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H](C)O)c1ccc(F)cc1O ZINC000850583639 1021621794 /nfs/dbraw/zinc/62/17/94/1021621794.db2.gz MYJGPDFDHBFDNL-ULFGMLNVSA-N 1 1 303.377 3.694 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)C[C@@H](C)O)cc1 ZINC000776522080 1021819600 /nfs/dbraw/zinc/81/96/00/1021819600.db2.gz ZIXVAJAUYCJADG-QGZVFWFLSA-N 1 1 312.457 3.526 20 10 DHCDMO CO[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000851716769 1021972932 /nfs/dbraw/zinc/97/29/32/1021972932.db2.gz QTZHRLYEYXVTRD-RTBURBONSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000179683262 1022076585 /nfs/dbraw/zinc/07/65/85/1022076585.db2.gz OHBQKBOOSRINAA-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@H](C)c1cccc(OC)c1 ZINC000179723312 1022078143 /nfs/dbraw/zinc/07/81/43/1022078143.db2.gz FJMWTSVILAHXJZ-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)c(F)c1)Cc1ccccc1O ZINC000110737193 1022150065 /nfs/dbraw/zinc/15/00/65/1022150065.db2.gz MRNBNJCLJSMVAE-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO C[C@@H](CC[NH2+][C@@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183541022 1022180785 /nfs/dbraw/zinc/18/07/85/1022180785.db2.gz QMDWPXZUOFGKRC-IRXDYDNUSA-N 1 1 312.457 3.953 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1[O-] ZINC000853239123 1022240346 /nfs/dbraw/zinc/24/03/46/1022240346.db2.gz AKDOHSUEZDQAOY-DZGCQCFKSA-N 1 1 322.880 3.818 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[O-] ZINC000853241902 1022242791 /nfs/dbraw/zinc/24/27/91/1022242791.db2.gz YSFTWMVCEBYGTK-CRAIPNDOSA-N 1 1 320.452 3.694 20 10 DHCDMO Cc1cc(C)n(-c2ccc(C[N@H+](C)Cc3ccccc3O)cc2)n1 ZINC000111236423 1022253043 /nfs/dbraw/zinc/25/30/43/1022253043.db2.gz DNOKMMILEAKFFO-UHFFFAOYSA-N 1 1 321.424 3.827 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CSc3ccccc3C2)cc1 ZINC001172210179 1033043613 /nfs/dbraw/zinc/04/36/13/1033043613.db2.gz VSUBTCUBXBFPOQ-GOSISDBHSA-N 1 1 312.482 3.901 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccncc2)cc1F ZINC000183747526 1022348047 /nfs/dbraw/zinc/34/80/47/1022348047.db2.gz XLBTUKLQWZMERL-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2)c1 ZINC000756432674 1022360854 /nfs/dbraw/zinc/36/08/54/1022360854.db2.gz LCBBGMADWZWMBC-ZIAGYGMSSA-N 1 1 313.397 3.899 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccc(C#N)cc2)C(C)C)c1 ZINC000179696080 1022506126 /nfs/dbraw/zinc/50/61/26/1022506126.db2.gz ZAMVEEXIHYLABI-UHFFFAOYSA-N 1 1 310.397 3.683 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC000179679325 1022507262 /nfs/dbraw/zinc/50/72/62/1022507262.db2.gz LEWOPAPJNAZWCF-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)cc1OC ZINC000179682166 1022507409 /nfs/dbraw/zinc/50/74/09/1022507409.db2.gz GYIRHIXMMOMECL-CQSZACIVSA-N 1 1 315.413 3.911 20 10 DHCDMO CCC[N@@H+](Cc1ccc(C#N)cc1)Cc1cc(OC)ccc1O ZINC000179721369 1022512347 /nfs/dbraw/zinc/51/23/47/1022512347.db2.gz YOVYFWXGGKHPPC-UHFFFAOYSA-N 1 1 310.397 3.685 20 10 DHCDMO COc1cccc(OCCC[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000186066359 1022548402 /nfs/dbraw/zinc/54/84/02/1022548402.db2.gz CHLBIMMZYLRGAB-CYBMUJFWSA-N 1 1 319.376 3.660 20 10 DHCDMO C[N@H+](Cc1cc(F)ccc1O)Cc1ccccc1N1CCCC1 ZINC000179890670 1022565974 /nfs/dbraw/zinc/56/59/74/1022565974.db2.gz WDWXLUNRACDMMP-UHFFFAOYSA-N 1 1 314.404 3.764 20 10 DHCDMO Oc1ccc(O)c(C[N@H+]2CC[C@H](c3ccccc3Cl)C2)c1 ZINC001141159215 1022650423 /nfs/dbraw/zinc/65/04/23/1022650423.db2.gz CHBNTKCQRXWRJZ-LBPRGKRZSA-N 1 1 303.789 3.741 20 10 DHCDMO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cccc(Br)c1O ZINC000763650288 1022682299 /nfs/dbraw/zinc/68/22/99/1022682299.db2.gz YOBLBNIKIDTMDK-LLVKDONJSA-N 1 1 310.235 3.919 20 10 DHCDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cccc(Br)c1O ZINC000763650288 1022682303 /nfs/dbraw/zinc/68/23/03/1022682303.db2.gz YOBLBNIKIDTMDK-LLVKDONJSA-N 1 1 310.235 3.919 20 10 DHCDMO C[N@H+](Cc1ccns1)Cc1ccc(N2CCCCC2)cc1 ZINC000876511394 1033081603 /nfs/dbraw/zinc/08/16/03/1033081603.db2.gz HBRFKZZVPYFTQL-UHFFFAOYSA-N 1 1 301.459 3.765 20 10 DHCDMO C[N@@H+](Cc1ccns1)Cc1ccc(N2CCCCC2)cc1 ZINC000876511394 1033081616 /nfs/dbraw/zinc/08/16/16/1033081616.db2.gz HBRFKZZVPYFTQL-UHFFFAOYSA-N 1 1 301.459 3.765 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)c1 ZINC000768162342 1022907189 /nfs/dbraw/zinc/90/71/89/1022907189.db2.gz BSSANNQAIYCKQF-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCOc2cccc(C)c2)c1 ZINC000768212604 1022923689 /nfs/dbraw/zinc/92/36/89/1022923689.db2.gz MSHVIGJEAXIKHU-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCOc2ccccc2C)c1 ZINC000768213775 1022927885 /nfs/dbraw/zinc/92/78/85/1022927885.db2.gz SRVUOFIZGNWSOG-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)c2ccc(OC)cc2)c(O)c1 ZINC000768235876 1022930179 /nfs/dbraw/zinc/93/01/79/1022930179.db2.gz AJWHWLJIRUSXSA-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO CCOc1ccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c(O)c1 ZINC000768230063 1022931172 /nfs/dbraw/zinc/93/11/72/1022931172.db2.gz QFLDLKDVGAJTET-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)c(O)c1 ZINC000768230063 1022931175 /nfs/dbraw/zinc/93/11/75/1022931175.db2.gz QFLDLKDVGAJTET-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)c(F)c2)C2CC2)o1 ZINC000768257524 1022932304 /nfs/dbraw/zinc/93/23/04/1022932304.db2.gz KPMAYGFBVPBYPZ-UHFFFAOYSA-N 1 1 302.393 3.958 20 10 DHCDMO CCCn1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000768256318 1022934040 /nfs/dbraw/zinc/93/40/40/1022934040.db2.gz BVDOBZGWSGNHRQ-UHFFFAOYSA-N 1 1 312.461 3.524 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C)[C@H](C)C(C)C)c1O ZINC000768268333 1022935120 /nfs/dbraw/zinc/93/51/20/1022935120.db2.gz HWVNUAINNAIOCB-SNVBAGLBSA-N 1 1 316.239 3.640 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccc(C)o2)C2CC2)c1 ZINC000768258960 1022935457 /nfs/dbraw/zinc/93/54/57/1022935457.db2.gz ZYNBMOYOXYPWMT-UHFFFAOYSA-N 1 1 301.386 3.857 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(OC)ccc1F)c1ccc(F)cc1O ZINC000857081186 1022944497 /nfs/dbraw/zinc/94/44/97/1022944497.db2.gz MUWUORLRFQJDJO-INIZCTEOSA-N 1 1 307.340 3.920 20 10 DHCDMO CCC[C@H](C)[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000768338695 1022947457 /nfs/dbraw/zinc/94/74/57/1022947457.db2.gz OHJXFBTWHWSPIN-JTQLQIEISA-N 1 1 316.239 3.784 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2C2CCCCC2)cc1OC ZINC000768440942 1022967077 /nfs/dbraw/zinc/96/70/77/1022967077.db2.gz BDTCXEYUKKRFMA-MRXNPFEDSA-N 1 1 319.445 3.954 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1CCOC[C@H]1c1ccccc1)CCCC2 ZINC000768465755 1022973106 /nfs/dbraw/zinc/97/31/06/1022973106.db2.gz KOBOSSCYZOAOCB-FQEVSTJZSA-N 1 1 323.436 3.845 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCOC[C@H]1c1ccccc1)CCCC2 ZINC000768465755 1022973110 /nfs/dbraw/zinc/97/31/10/1022973110.db2.gz KOBOSSCYZOAOCB-FQEVSTJZSA-N 1 1 323.436 3.845 20 10 DHCDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768462956 1022973546 /nfs/dbraw/zinc/97/35/46/1022973546.db2.gz PGKWZPVSURMDFA-UKRRQHHQSA-N 1 1 307.434 3.810 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCC[C@@H]2C2CC2)c1 ZINC000781913752 1022981710 /nfs/dbraw/zinc/98/17/10/1022981710.db2.gz SZGDSIMKJARXRI-CQSZACIVSA-N 1 1 310.235 3.838 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000781913752 1022981717 /nfs/dbraw/zinc/98/17/17/1022981717.db2.gz SZGDSIMKJARXRI-CQSZACIVSA-N 1 1 310.235 3.838 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](CC)CCc2cccs2)c1 ZINC000768758283 1023023109 /nfs/dbraw/zinc/02/31/09/1023023109.db2.gz MVFWIORELOUOEA-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876572467 1033095490 /nfs/dbraw/zinc/09/54/90/1033095490.db2.gz DUIKUAITTULBCV-APWZRJJASA-N 1 1 316.489 3.658 20 10 DHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)c1ccc(F)cc1 ZINC000768911386 1023052904 /nfs/dbraw/zinc/05/29/04/1023052904.db2.gz NJDRGOSAJPQDLS-GFCCVEGCSA-N 1 1 317.360 3.843 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000769106889 1023085848 /nfs/dbraw/zinc/08/58/48/1023085848.db2.gz RLMIDRMLSQXTSF-GOSISDBHSA-N 1 1 313.397 3.834 20 10 DHCDMO COc1ccc2c(c1)C[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC000769122445 1023087531 /nfs/dbraw/zinc/08/75/31/1023087531.db2.gz ZGJHDTUREGRNGN-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cc(C)ccc1O ZINC000769188237 1023099012 /nfs/dbraw/zinc/09/90/12/1023099012.db2.gz GLENMHJSPQUPIM-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769319692 1023121664 /nfs/dbraw/zinc/12/16/64/1023121664.db2.gz WZCAVIYXAQBULU-INIZCTEOSA-N 1 1 313.397 3.747 20 10 DHCDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C ZINC001172372714 1033106659 /nfs/dbraw/zinc/10/66/59/1033106659.db2.gz GTKIGNGSMKRMKK-FUHIMQAGSA-N 1 1 316.489 3.780 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000769333766 1023124769 /nfs/dbraw/zinc/12/47/69/1023124769.db2.gz KXSNBOZACWALJI-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CCCCC3)C2)cc1 ZINC000769330521 1023125307 /nfs/dbraw/zinc/12/53/07/1023125307.db2.gz OPPXUXVKIGPMHA-HXUWFJFHSA-N 1 1 315.505 3.593 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](N3CCCCC3)C2)cc1 ZINC000769330521 1023125312 /nfs/dbraw/zinc/12/53/12/1023125312.db2.gz OPPXUXVKIGPMHA-HXUWFJFHSA-N 1 1 315.505 3.593 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000184811895 1023130045 /nfs/dbraw/zinc/13/00/45/1023130045.db2.gz ICWANQILHSGFNJ-HXUWFJFHSA-N 1 1 309.409 3.640 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000769390607 1023138968 /nfs/dbraw/zinc/13/89/68/1023138968.db2.gz ZZBMGYXLNQHYTG-CQSZACIVSA-N 1 1 316.420 3.660 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CCC1 ZINC000769442980 1023150489 /nfs/dbraw/zinc/15/04/89/1023150489.db2.gz NZISXSBLJJOKGS-UHFFFAOYSA-N 1 1 303.406 3.569 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC3(CCOCC3)C2)cc1 ZINC000769446131 1023154147 /nfs/dbraw/zinc/15/41/47/1023154147.db2.gz NXSHCRJORPJFGW-UHFFFAOYSA-N 1 1 316.489 3.925 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H](c2ccccc2)CO1 ZINC000769490983 1023154747 /nfs/dbraw/zinc/15/47/47/1023154747.db2.gz ZZPWYPIQMZVKRI-OXQOHEQNSA-N 1 1 310.441 3.715 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H](c2ccccc2)CO1 ZINC000769490983 1023154750 /nfs/dbraw/zinc/15/47/50/1023154750.db2.gz ZZPWYPIQMZVKRI-OXQOHEQNSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000769497793 1023166364 /nfs/dbraw/zinc/16/63/64/1023166364.db2.gz BHULPBXEVHQXMB-NVXWUHKLSA-N 1 1 311.425 3.854 20 10 DHCDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769503401 1023168229 /nfs/dbraw/zinc/16/82/29/1023168229.db2.gz JYGSESKJBYRNMF-QGZVFWFLSA-N 1 1 302.462 3.535 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)C[C@@H]2CCOC2)cc1 ZINC000769532178 1023173743 /nfs/dbraw/zinc/17/37/43/1023173743.db2.gz HSEVBNJHSYIAEH-SFHVURJKSA-N 1 1 304.478 3.781 20 10 DHCDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769537050 1023175414 /nfs/dbraw/zinc/17/54/14/1023175414.db2.gz HCQSIOZKZVJDNR-HNNXBMFYSA-N 1 1 308.441 3.530 20 10 DHCDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876683147 1033119189 /nfs/dbraw/zinc/11/91/89/1033119189.db2.gz QAIXNWAEFQBFNT-IBGZPJMESA-N 1 1 316.489 3.658 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)cc1 ZINC000770305314 1023295452 /nfs/dbraw/zinc/29/54/52/1023295452.db2.gz SJYFTUQVFDLPMS-NRFANRHFSA-N 1 1 324.468 3.586 20 10 DHCDMO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770324348 1023297013 /nfs/dbraw/zinc/29/70/13/1023297013.db2.gz JGNSZLUHIWISAT-FQEVSTJZSA-N 1 1 316.489 3.924 20 10 DHCDMO CCOc1ccc(C[N@H+](C)[C@@H]2C[C@H](OCC)C23CCC3)c(O)c1 ZINC000770352452 1023304243 /nfs/dbraw/zinc/30/42/43/1023304243.db2.gz NWRKERXYBLFSIP-MSOLQXFVSA-N 1 1 319.445 3.570 20 10 DHCDMO CC(C)(C)C1=CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000770387137 1023309695 /nfs/dbraw/zinc/30/96/95/1023309695.db2.gz WYXUGBNNXSOMPH-UHFFFAOYSA-N 1 1 314.473 3.701 20 10 DHCDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000770510040 1023316736 /nfs/dbraw/zinc/31/67/36/1023316736.db2.gz VURWMPZSMLUGSI-VQIMIIECSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1cc2c(cc1CNc1ccc3c(c1)[nH+]cn3C)O[C@H](C)C2 ZINC000770589375 1023326718 /nfs/dbraw/zinc/32/67/18/1023326718.db2.gz QHUOIZFZQZQRBI-GFCCVEGCSA-N 1 1 323.396 3.517 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(C)cc1O)CCC2 ZINC000876732531 1033128487 /nfs/dbraw/zinc/12/84/87/1033128487.db2.gz YGFFUSSSPVFHCS-HNNXBMFYSA-N 1 1 302.443 3.975 20 10 DHCDMO CCOc1ccccc1CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000756686305 1023459928 /nfs/dbraw/zinc/45/99/28/1023459928.db2.gz SBOPFLGFYFMQRL-ZDUSSCGKSA-N 1 1 303.377 3.823 20 10 DHCDMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000771924210 1023485530 /nfs/dbraw/zinc/48/55/30/1023485530.db2.gz DGGLUCMQEANQNA-UHFFFAOYSA-N 1 1 324.468 3.934 20 10 DHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c(O)c1 ZINC000876804188 1033147691 /nfs/dbraw/zinc/14/76/91/1033147691.db2.gz NJHKSAXROSNMEX-NVXWUHKLSA-N 1 1 317.454 3.850 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000876805391 1033148267 /nfs/dbraw/zinc/14/82/67/1033148267.db2.gz ZQPSIWDTOJEIQX-YOEHRIQHSA-N 1 1 317.454 3.850 20 10 DHCDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000785990252 1023648862 /nfs/dbraw/zinc/64/88/62/1023648862.db2.gz ZYVZEUSUWVPKRL-HLIPFELVSA-N 1 1 316.489 3.658 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2c(C)cccc2C)c1 ZINC000756757432 1023702590 /nfs/dbraw/zinc/70/25/90/1023702590.db2.gz BXENBBCLVJKEHV-AWEZNQCLSA-N 1 1 313.397 3.646 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1CCSC1 ZINC000787041878 1023752510 /nfs/dbraw/zinc/75/25/10/1023752510.db2.gz LXCSYTMJAFDXKY-AWEZNQCLSA-N 1 1 303.427 3.741 20 10 DHCDMO CCC[C@@H](CCO)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788615330 1023913843 /nfs/dbraw/zinc/91/38/43/1023913843.db2.gz ZHFDNVDNJYAHGI-RYUDHWBXSA-N 1 1 319.367 3.860 20 10 DHCDMO CCC[C@H](CCO)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788615327 1023913963 /nfs/dbraw/zinc/91/39/63/1023913963.db2.gz ZHFDNVDNJYAHGI-NWDGAFQWSA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@H]([NH2+]CCN1CCC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788612437 1023914640 /nfs/dbraw/zinc/91/46/40/1023914640.db2.gz MGHRXHMVLNFFEW-RYUDHWBXSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]CCOC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000788707463 1023924478 /nfs/dbraw/zinc/92/44/78/1023924478.db2.gz YMQQCDAGQHVODJ-SNVBAGLBSA-N 1 1 305.340 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1cnn(C)c1 ZINC000278858263 1023968982 /nfs/dbraw/zinc/96/89/82/1023968982.db2.gz WEQGJDITEOVYHY-BDAKNGLRSA-N 1 1 314.216 3.844 20 10 DHCDMO C[C@@H]1CC[C@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)O1 ZINC000789306487 1024041631 /nfs/dbraw/zinc/04/16/31/1024041631.db2.gz OYADKLYAJXCICS-VQIMIIECSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000789568140 1024116826 /nfs/dbraw/zinc/11/68/26/1024116826.db2.gz XAHHUWFNKWFIMH-FQEVSTJZSA-N 1 1 311.425 3.796 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000165235081 1024140226 /nfs/dbraw/zinc/14/02/26/1024140226.db2.gz IGSHGEXTUKWFGR-KDOFPFPSSA-N 1 1 316.445 3.946 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000165234825 1024141154 /nfs/dbraw/zinc/14/11/54/1024141154.db2.gz IGSHGEXTUKWFGR-KSSFIOAISA-N 1 1 316.445 3.946 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000165234956 1024141690 /nfs/dbraw/zinc/14/16/90/1024141690.db2.gz IGSHGEXTUKWFGR-RDTXWAMCSA-N 1 1 316.445 3.946 20 10 DHCDMO CC1(C)CC[N@H+](Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000789763599 1024160432 /nfs/dbraw/zinc/16/04/32/1024160432.db2.gz MFXKYELMABJQSY-UHFFFAOYSA-N 1 1 303.830 3.902 20 10 DHCDMO CC1(C)CC[N@@H+](Cc2c(O)ccc(Cl)c2F)CCS1 ZINC000789763599 1024160434 /nfs/dbraw/zinc/16/04/34/1024160434.db2.gz MFXKYELMABJQSY-UHFFFAOYSA-N 1 1 303.830 3.902 20 10 DHCDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882899477 1024165068 /nfs/dbraw/zinc/16/50/68/1024165068.db2.gz NYLFWBGALWHGNX-VIFPVBQESA-N 1 1 311.303 3.669 20 10 DHCDMO CC(C)(C)Oc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cn1 ZINC000883084687 1024237386 /nfs/dbraw/zinc/23/73/86/1024237386.db2.gz ZFAHUGRWABJAIM-UHFFFAOYSA-N 1 1 322.355 3.533 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000883199914 1024284883 /nfs/dbraw/zinc/28/48/83/1024284883.db2.gz UAEDGGPQVYSFTN-ZYHUDNBSSA-N 1 1 307.262 3.657 20 10 DHCDMO Cc1c(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)cccc1[N+](=O)[O-] ZINC000790696041 1024357854 /nfs/dbraw/zinc/35/78/54/1024357854.db2.gz PKBSLUAFFWGIIV-JTQLQIEISA-N 1 1 322.311 3.738 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]C2(c3ncccn3)CCC2)c2c1c(F)ccc2O ZINC000883311627 1024362813 /nfs/dbraw/zinc/36/28/13/1024362813.db2.gz HENKAAOEXAOKJZ-DGCLKSJQSA-N 1 1 313.376 3.539 20 10 DHCDMO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1cc2c(cc1O)CCCC2 ZINC000883311556 1024363564 /nfs/dbraw/zinc/36/35/64/1024363564.db2.gz DTOJQXKGRLGRAW-CQSZACIVSA-N 1 1 323.440 3.791 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccnn2-c2ccccc2)cc1 ZINC000790901184 1024400726 /nfs/dbraw/zinc/40/07/26/1024400726.db2.gz KWNGUAMBSLOLDR-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO C[C@@H](COc1ccccc1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790962275 1024407594 /nfs/dbraw/zinc/40/75/94/1024407594.db2.gz KGRWYOIISPUFOB-NSHDSACASA-N 1 1 309.768 3.742 20 10 DHCDMO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790989247 1024410884 /nfs/dbraw/zinc/41/08/84/1024410884.db2.gz AJUNFIXJMRVGNQ-UKRRQHHQSA-N 1 1 315.816 3.868 20 10 DHCDMO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790991697 1024414010 /nfs/dbraw/zinc/41/40/10/1024414010.db2.gz ZJYQMAISASGPHK-VXGBXAGGSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCC[C@H]1CCCC[C@@H]1O ZINC000790976995 1024421782 /nfs/dbraw/zinc/42/17/82/1024421782.db2.gz DHYYVWNCFAQZKP-RISCZKNCSA-N 1 1 315.816 3.606 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000791577747 1024519421 /nfs/dbraw/zinc/51/94/21/1024519421.db2.gz DKBKYDIQWQBPSD-OQPBUACISA-N 1 1 319.298 3.507 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000791577747 1024519427 /nfs/dbraw/zinc/51/94/27/1024519427.db2.gz DKBKYDIQWQBPSD-OQPBUACISA-N 1 1 319.298 3.507 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000791577750 1024519566 /nfs/dbraw/zinc/51/95/66/1024519566.db2.gz DKBKYDIQWQBPSD-SDBXPKJASA-N 1 1 319.298 3.507 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000791577750 1024519568 /nfs/dbraw/zinc/51/95/68/1024519568.db2.gz DKBKYDIQWQBPSD-SDBXPKJASA-N 1 1 319.298 3.507 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(N(C)C)cc1 ZINC000271599145 1024548883 /nfs/dbraw/zinc/54/88/83/1024548883.db2.gz ZKZBJDZLZCVTCV-CZUORRHYSA-N 1 1 315.465 3.796 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000792181925 1024644352 /nfs/dbraw/zinc/64/43/52/1024644352.db2.gz WIGGMFSFQMOTQS-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC000792181925 1024644358 /nfs/dbraw/zinc/64/43/58/1024644358.db2.gz WIGGMFSFQMOTQS-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CCN(CC)c1ccc(CNC[C@H](C)C[NH+]2CCCCC2)cc1 ZINC000321078256 1024649727 /nfs/dbraw/zinc/64/97/27/1024649727.db2.gz RCLWHRYENOUWET-SFHVURJKSA-N 1 1 317.521 3.744 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(F)cc2C)c1O ZINC000792711314 1024786286 /nfs/dbraw/zinc/78/62/86/1024786286.db2.gz IODFAUUCKIUSAS-UHFFFAOYSA-N 1 1 303.377 3.789 20 10 DHCDMO CC[C@@H]([NH2+]CCCCNc1ccccn1)c1ccc(F)cc1O ZINC000796739924 1024796509 /nfs/dbraw/zinc/79/65/09/1024796509.db2.gz BDEYQIPGYREDCX-MRXNPFEDSA-N 1 1 317.408 3.859 20 10 DHCDMO C[C@H]1CSCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792823520 1024799600 /nfs/dbraw/zinc/79/96/00/1024799600.db2.gz UFJUJBDFFQSOJD-NSHDSACASA-N 1 1 318.408 3.709 20 10 DHCDMO C[C@H]1CSCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792823520 1024799609 /nfs/dbraw/zinc/79/96/09/1024799609.db2.gz UFJUJBDFFQSOJD-NSHDSACASA-N 1 1 318.408 3.709 20 10 DHCDMO C[C@@H]1CSCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792823519 1024800579 /nfs/dbraw/zinc/80/05/79/1024800579.db2.gz UFJUJBDFFQSOJD-LLVKDONJSA-N 1 1 318.408 3.709 20 10 DHCDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792823519 1024800595 /nfs/dbraw/zinc/80/05/95/1024800595.db2.gz UFJUJBDFFQSOJD-LLVKDONJSA-N 1 1 318.408 3.709 20 10 DHCDMO Cc1csc(C(C)(C)[NH2+]Cc2ccc(N(C)C)c(F)c2)n1 ZINC000116382067 1024857456 /nfs/dbraw/zinc/85/74/56/1024857456.db2.gz GGZZZGPSCHULBA-UHFFFAOYSA-N 1 1 307.438 3.682 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)cc1F ZINC000793609667 1025130811 /nfs/dbraw/zinc/13/08/11/1025130811.db2.gz QYFIXSSLUXFPAN-RTBURBONSA-N 1 1 320.452 3.815 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000793790760 1025163964 /nfs/dbraw/zinc/16/39/64/1025163964.db2.gz KWIXZUNPCFBVGI-AWEZNQCLSA-N 1 1 305.487 3.846 20 10 DHCDMO CC[C@H](Cc1ccc2c(c1)OCO2)[N@@H+](C)Cc1ccccc1O ZINC001170451573 1025298943 /nfs/dbraw/zinc/29/89/43/1025298943.db2.gz ZFBQKWNYIHKMMT-MRXNPFEDSA-N 1 1 313.397 3.574 20 10 DHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877337016 1033286977 /nfs/dbraw/zinc/28/69/77/1033286977.db2.gz VXPWPLQLQYOAIP-GOSISDBHSA-N 1 1 316.489 3.802 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1c(O)cccc1F ZINC000886490062 1025650204 /nfs/dbraw/zinc/65/02/04/1025650204.db2.gz YMDFTIMDBZAAAP-WCQYABFASA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc2c(c1)OCO2 ZINC000886498653 1025654451 /nfs/dbraw/zinc/65/44/51/1025654451.db2.gz KOAKWWJLLWKFRG-QWRGUYRKSA-N 1 1 303.333 3.672 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894042374 1025667584 /nfs/dbraw/zinc/66/75/84/1025667584.db2.gz NEMAZGPKWDJIBP-LBPRGKRZSA-N 1 1 319.351 3.669 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894042374 1025667591 /nfs/dbraw/zinc/66/75/91/1025667591.db2.gz NEMAZGPKWDJIBP-LBPRGKRZSA-N 1 1 319.351 3.669 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2c([O-])cccc2F)c1 ZINC000886522103 1025674444 /nfs/dbraw/zinc/67/44/44/1025674444.db2.gz CFJNBMWUYHOSQD-CQSZACIVSA-N 1 1 316.420 3.834 20 10 DHCDMO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886540311 1025687643 /nfs/dbraw/zinc/68/76/43/1025687643.db2.gz CMWCWAWXDYFDIL-DZKIICNBSA-N 1 1 317.404 3.737 20 10 DHCDMO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886543779 1025690094 /nfs/dbraw/zinc/69/00/94/1025690094.db2.gz VIQYUOABLZJBCE-PEBVRCNWSA-N 1 1 321.367 3.833 20 10 DHCDMO COc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886547973 1025697116 /nfs/dbraw/zinc/69/71/16/1025697116.db2.gz VLIZJOFZUKLGRF-SMDDNHRTSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1c(O)cccc1F ZINC000886557201 1025703103 /nfs/dbraw/zinc/70/31/03/1025703103.db2.gz WAJFEHNZIJFFRL-DRONIGIMSA-N 1 1 321.417 3.681 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)c1c(O)cccc1F ZINC000886558234 1025704622 /nfs/dbraw/zinc/70/46/22/1025704622.db2.gz FCESFVUBDYCWDO-XPGAZNKBSA-N 1 1 313.463 3.562 20 10 DHCDMO C[C@@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1c(O)cccc1F ZINC000886561988 1025710236 /nfs/dbraw/zinc/71/02/36/1025710236.db2.gz ODIRJMDWYILMGO-GFCCVEGCSA-N 1 1 311.397 3.694 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1c(O)cccc1F ZINC000886615782 1025738805 /nfs/dbraw/zinc/73/88/05/1025738805.db2.gz NOGXPQXIQFSAFW-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO COC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc(OC)c1 ZINC000886636776 1025750646 /nfs/dbraw/zinc/75/06/46/1025750646.db2.gz UYPXBYJMKZEFFO-LRDDRELGSA-N 1 1 319.376 3.578 20 10 DHCDMO COc1ccc([C@H]([NH2+][C@@H](C)c2c(O)cccc2F)C2CC2)cn1 ZINC000886644969 1025757289 /nfs/dbraw/zinc/75/72/89/1025757289.db2.gz OYLSYFJXMPBVOQ-BBATYDOGSA-N 1 1 316.376 3.737 20 10 DHCDMO COc1ccc([C@@H]([NH2+][C@@H](C)c2c(O)cccc2F)C2CC2)cn1 ZINC000886644970 1025757474 /nfs/dbraw/zinc/75/74/74/1025757474.db2.gz OYLSYFJXMPBVOQ-VOJFVSQTSA-N 1 1 316.376 3.737 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)[C@H](O)c1ccccc1 ZINC000886649428 1025761584 /nfs/dbraw/zinc/76/15/84/1025761584.db2.gz AKHYCKZWOQVXJG-HNJNHCNJSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)cc1O ZINC000806179763 1025836653 /nfs/dbraw/zinc/83/66/53/1025836653.db2.gz GZVAGKISXPYGTR-UFBFGSQYSA-N 1 1 320.177 3.993 20 10 DHCDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCN1C ZINC000093643818 1026119633 /nfs/dbraw/zinc/11/96/33/1026119633.db2.gz GCEYNGOCJYGTGA-FXAWDEMLSA-N 1 1 315.505 3.591 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1 ZINC000093769048 1026129139 /nfs/dbraw/zinc/12/91/39/1026129139.db2.gz HJIQAJRQSCZMRF-DYVFJYSZSA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](N3CCCC3)[C@H]2C)cc1C(C)C ZINC000808191520 1026225207 /nfs/dbraw/zinc/22/52/07/1026225207.db2.gz MSIJMAXQWMIBTI-VQIMIIECSA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](N3CCCC3)[C@H]2C)cc1C(C)C ZINC000808191520 1026225221 /nfs/dbraw/zinc/22/52/21/1026225221.db2.gz MSIJMAXQWMIBTI-VQIMIIECSA-N 1 1 316.489 3.883 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1ccc(F)cc1O ZINC000289929191 1026237003 /nfs/dbraw/zinc/23/70/03/1026237003.db2.gz VJRSPDYFXFLCPW-APPDUMDISA-N 1 1 321.417 3.732 20 10 DHCDMO CN(C)c1ccccc1C[N@@H+](C)Cc1c(O)ccc2ccncc21 ZINC000808235555 1026240596 /nfs/dbraw/zinc/24/05/96/1026240596.db2.gz UKJZSVQKOVZYPN-UHFFFAOYSA-N 1 1 321.424 3.638 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC=C(c3ccnn3C)CC2)cc1 ZINC000809690226 1026585380 /nfs/dbraw/zinc/58/53/80/1026585380.db2.gz KUMXBJOLHFKAHV-UHFFFAOYSA-N 1 1 324.472 3.556 20 10 DHCDMO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700201 1026587925 /nfs/dbraw/zinc/58/79/25/1026587925.db2.gz ACNVTONEKXUGKH-NEPJUHHUSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700201 1026587934 /nfs/dbraw/zinc/58/79/34/1026587934.db2.gz ACNVTONEKXUGKH-NEPJUHHUSA-N 1 1 315.816 3.700 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)c1O ZINC000809701177 1026588944 /nfs/dbraw/zinc/58/89/44/1026588944.db2.gz VESDYJMAEZVSNW-BBRMVZONSA-N 1 1 311.853 3.870 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2C[C@H](C)O)c1O ZINC000809701181 1026589469 /nfs/dbraw/zinc/58/94/69/1026589469.db2.gz VESDYJMAEZVSNW-XJKSGUPXSA-N 1 1 311.853 3.870 20 10 DHCDMO CCC[N@@H+](CCc1ccccn1)Cc1cc(OCC)ccc1O ZINC000809734448 1026597604 /nfs/dbraw/zinc/59/76/04/1026597604.db2.gz GVHXUWXPEKYSEC-UHFFFAOYSA-N 1 1 314.429 3.641 20 10 DHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000809764950 1026621083 /nfs/dbraw/zinc/62/10/83/1026621083.db2.gz JUHLDRNRJNSKKS-QGZVFWFLSA-N 1 1 301.409 3.870 20 10 DHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(N(C)C)cc1)C2 ZINC000810097869 1026677761 /nfs/dbraw/zinc/67/77/61/1026677761.db2.gz NFICAXSVHOAERD-UHFFFAOYSA-N 1 1 322.452 3.809 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)C1CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000810259410 1026719906 /nfs/dbraw/zinc/71/99/06/1026719906.db2.gz IPLDMJMFDKFUGD-LKFCYVNXSA-N 1 1 318.244 3.901 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)Nc2cc(C3CC3)cc[nH+]2)c1 ZINC000810258343 1026720638 /nfs/dbraw/zinc/72/06/38/1026720638.db2.gz MNSYCZIKOGMTBC-NSHDSACASA-N 1 1 312.369 3.624 20 10 DHCDMO CSC1(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCC1 ZINC000811453273 1027004307 /nfs/dbraw/zinc/00/43/07/1027004307.db2.gz IHGRWCMPPHQEIB-MRXNPFEDSA-N 1 1 321.486 3.659 20 10 DHCDMO Clc1nccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1Cl ZINC000811477188 1027016363 /nfs/dbraw/zinc/01/63/63/1027016363.db2.gz IHUSQGAYRGEDHS-UHFFFAOYSA-N 1 1 309.196 3.613 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)[C@@H]1C1CC1 ZINC000811513330 1027028709 /nfs/dbraw/zinc/02/87/09/1027028709.db2.gz GFWODFALIXUWDV-CQSZACIVSA-N 1 1 310.235 3.775 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1O ZINC000811513523 1027029595 /nfs/dbraw/zinc/02/95/95/1027029595.db2.gz JVEGUEIANKNWOH-MRXNPFEDSA-N 1 1 307.821 3.819 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)CC(C)(C)C ZINC000812794928 1027422070 /nfs/dbraw/zinc/42/20/70/1027422070.db2.gz INYWSNCDQWFVQJ-UHFFFAOYSA-N 1 1 308.441 3.530 20 10 DHCDMO CCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000296488227 1027651964 /nfs/dbraw/zinc/65/19/64/1027651964.db2.gz KWIOLTRXLZQFBQ-INIZCTEOSA-N 1 1 304.478 3.922 20 10 DHCDMO C[C@H]1C[C@@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)CCO1 ZINC000778985418 1027717507 /nfs/dbraw/zinc/71/75/07/1027717507.db2.gz SYRAMOQQLSUAKX-HOTGVXAUSA-N 1 1 315.413 3.803 20 10 DHCDMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)o1 ZINC000813883582 1027749185 /nfs/dbraw/zinc/74/91/85/1027749185.db2.gz ALISMVIPYJHWBN-VIFPVBQESA-N 1 1 310.344 3.770 20 10 DHCDMO CCCc1nc(C)c(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)o1 ZINC000813883574 1027750941 /nfs/dbraw/zinc/75/09/41/1027750941.db2.gz ALISMVIPYJHWBN-SECBINFHSA-N 1 1 310.344 3.770 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1noc(-c2ccccc2)n1 ZINC000296986520 1027772322 /nfs/dbraw/zinc/77/23/22/1027772322.db2.gz SDGNWKQZRQXKCM-SWLSCSKDSA-N 1 1 321.380 3.780 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1O ZINC000814169043 1027926452 /nfs/dbraw/zinc/92/64/52/1027926452.db2.gz CHKXDVAPCGPGPW-GXTWGEPZSA-N 1 1 301.764 3.831 20 10 DHCDMO CC(C)Oc1cccc(C[N@@H+](C)Cc2cc(F)ccc2O)c1 ZINC000779033248 1027958173 /nfs/dbraw/zinc/95/81/73/1027958173.db2.gz PREKTVGRBKASIY-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO C[C@@H](Nc1[nH+]c2ccc(F)cc2n1C)c1ccc(N(C)C)cc1 ZINC000814259437 1027974109 /nfs/dbraw/zinc/97/41/09/1027974109.db2.gz NUPWPNVPMUCLMG-GFCCVEGCSA-N 1 1 312.392 3.952 20 10 DHCDMO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cc2c(cc1O)CCCC2 ZINC000159721271 1028188418 /nfs/dbraw/zinc/18/84/18/1028188418.db2.gz WVIZZXZFXNCLPK-UHFFFAOYSA-N 1 1 316.832 3.951 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H]1C=CCCCCC1 ZINC000815011731 1028326231 /nfs/dbraw/zinc/32/62/31/1028326231.db2.gz YDYYGMDKSMVSRD-LJQANCHMSA-N 1 1 314.473 3.844 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)cc1F ZINC000815009406 1028326546 /nfs/dbraw/zinc/32/65/46/1028326546.db2.gz DRSATFIKGZEOTA-UHFFFAOYSA-N 1 1 316.420 3.841 20 10 DHCDMO Cc1cc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)ccc1N(C)C ZINC000815058539 1028343113 /nfs/dbraw/zinc/34/31/13/1028343113.db2.gz HWZGVMMUFFDYBH-NRFANRHFSA-N 1 1 324.468 3.543 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000368795111 1028412138 /nfs/dbraw/zinc/41/21/38/1028412138.db2.gz DZCLNDOPFZVMGE-GOEBONIOSA-N 1 1 312.413 3.648 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000368798716 1028412231 /nfs/dbraw/zinc/41/22/31/1028412231.db2.gz SQCHVCQFJPKZAZ-QWHCGFSZSA-N 1 1 318.442 3.798 20 10 DHCDMO Cc1cc(C)c(O)c(CN2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000216347989 1028419961 /nfs/dbraw/zinc/41/99/61/1028419961.db2.gz XPFOBHFGKYMTBI-UHFFFAOYSA-N 1 1 324.468 3.635 20 10 DHCDMO CC[C@H](c1ccccc1O)N1CCC([N@@H+]2CCC[C@@H]2C)CC1 ZINC000369888347 1028540796 /nfs/dbraw/zinc/54/07/96/1028540796.db2.gz NXKXAQXCVRQQPG-MAUKXSAKSA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@H](c1ccccc1O)N1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000369888347 1028540812 /nfs/dbraw/zinc/54/08/12/1028540812.db2.gz NXKXAQXCVRQQPG-MAUKXSAKSA-N 1 1 302.462 3.792 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@H](O)C1)c1cccc(C(F)(F)F)c1O ZINC000815582245 1028554514 /nfs/dbraw/zinc/55/45/14/1028554514.db2.gz AYKYIGTWFATLKE-SRVKXCTJSA-N 1 1 317.351 3.613 20 10 DHCDMO CCc1cc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)on1 ZINC000815582596 1028554606 /nfs/dbraw/zinc/55/46/06/1028554606.db2.gz KRHJFUJOWZDSHA-SECBINFHSA-N 1 1 314.307 3.812 20 10 DHCDMO CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1(C)C ZINC000815587471 1028557149 /nfs/dbraw/zinc/55/71/49/1028557149.db2.gz KUBTYQCMBCDWKV-OASPWFOLSA-N 1 1 317.351 3.875 20 10 DHCDMO COCCC1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815596662 1028562151 /nfs/dbraw/zinc/56/21/51/1028562151.db2.gz AGCQHLMRXSGMLS-LLVKDONJSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000815627560 1028576722 /nfs/dbraw/zinc/57/67/22/1028576722.db2.gz DDAVFNJZONAEOI-YGRLFVJLSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000815627559 1028577565 /nfs/dbraw/zinc/57/75/65/1028577565.db2.gz DDAVFNJZONAEOI-QMTHXVAHSA-N 1 1 317.351 3.613 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000371326626 1028689564 /nfs/dbraw/zinc/68/95/64/1028689564.db2.gz JORIOCGVDQNCKM-RTBURBONSA-N 1 1 314.473 3.535 20 10 DHCDMO C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccc(F)cc1O ZINC000371865323 1028769551 /nfs/dbraw/zinc/76/95/51/1028769551.db2.gz UFGFNDBVWJLMPQ-CYBMUJFWSA-N 1 1 307.409 3.921 20 10 DHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000371871236 1028770925 /nfs/dbraw/zinc/77/09/25/1028770925.db2.gz YLNVKQBFUFOLRA-ZBEGNZNMSA-N 1 1 317.360 3.714 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC000190138679 1028824109 /nfs/dbraw/zinc/82/41/09/1028824109.db2.gz JRVVPRRAJDMDJN-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC000190138679 1028824130 /nfs/dbraw/zinc/82/41/30/1028824130.db2.gz JRVVPRRAJDMDJN-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000372595044 1028874987 /nfs/dbraw/zinc/87/49/87/1028874987.db2.gz OVLKJTMUCCPYMP-MJGOQNOKSA-N 1 1 313.397 3.622 20 10 DHCDMO C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc2ccccc2c1O ZINC000816482744 1028892912 /nfs/dbraw/zinc/89/29/12/1028892912.db2.gz RIRULDUVOYRIBD-UHFFFAOYSA-N 1 1 321.376 3.906 20 10 DHCDMO Oc1c(C[N@@H+]2CCC[C@@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816492902 1028895848 /nfs/dbraw/zinc/89/58/48/1028895848.db2.gz JBXUMVKEENPHHL-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816492902 1028895866 /nfs/dbraw/zinc/89/58/66/1028895866.db2.gz JBXUMVKEENPHHL-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)ccc2ccccc21 ZINC000816494030 1028896106 /nfs/dbraw/zinc/89/61/06/1028896106.db2.gz WHUNXKXVILYCGX-INIZCTEOSA-N 1 1 307.397 3.648 20 10 DHCDMO CCOc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816535676 1028923557 /nfs/dbraw/zinc/92/35/57/1028923557.db2.gz WKALDROPDFFJDE-UHFFFAOYSA-N 1 1 309.768 3.873 20 10 DHCDMO Cc1sccc1C[NH2+]Cc1cccc(Br)c1O ZINC000816592943 1028937868 /nfs/dbraw/zinc/93/78/68/1028937868.db2.gz ZHFFRZCWBJYEFV-UHFFFAOYSA-N 1 1 312.232 3.814 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@H]1c1ccccc1)OCO2 ZINC000816630364 1028951883 /nfs/dbraw/zinc/95/18/83/1028951883.db2.gz BLAIDKDDBGXDNJ-LJQANCHMSA-N 1 1 323.392 3.848 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1 ZINC000816642594 1028969901 /nfs/dbraw/zinc/96/99/01/1028969901.db2.gz DYSZZHWLOJBZBZ-OAHLLOKOSA-N 1 1 317.351 3.632 20 10 DHCDMO Cn1cc(Cl)c(C[N@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000817274055 1029115843 /nfs/dbraw/zinc/11/58/43/1029115843.db2.gz AHXDKXIOGUSSBZ-UHFFFAOYSA-N 1 1 319.836 3.724 20 10 DHCDMO Cn1cc(Cl)c(C[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000817274055 1029115852 /nfs/dbraw/zinc/11/58/52/1029115852.db2.gz AHXDKXIOGUSSBZ-UHFFFAOYSA-N 1 1 319.836 3.724 20 10 DHCDMO C[N@@H+](Cc1cn2c(n1)CCCC2)Cc1c(O)ccc2ccccc21 ZINC000373882191 1029161244 /nfs/dbraw/zinc/16/12/44/1029161244.db2.gz OQHKJAYNFUIMRN-UHFFFAOYSA-N 1 1 321.424 3.710 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000817585550 1029213474 /nfs/dbraw/zinc/21/34/74/1029213474.db2.gz GOLUKRXWOSTPBU-CLTVBZQCSA-N 1 1 306.425 3.542 20 10 DHCDMO Cc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)c1 ZINC000817938346 1029281911 /nfs/dbraw/zinc/28/19/11/1029281911.db2.gz JEENDUJWLWOCOT-OXJNMPFZSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1Cl ZINC000817939019 1029282004 /nfs/dbraw/zinc/28/20/04/1029282004.db2.gz XPOYKPQSCXNHRE-UGSOOPFHSA-N 1 1 317.864 3.757 20 10 DHCDMO Cc1cccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000817941097 1029284307 /nfs/dbraw/zinc/28/43/07/1029284307.db2.gz IUXTZEBIDQFUDN-OXJNMPFZSA-N 1 1 311.473 3.720 20 10 DHCDMO CC[C@@H]([NH2+]CCC[NH2+]C(C)C)c1ccc(C(F)(F)F)cc1[O-] ZINC000817951787 1029295554 /nfs/dbraw/zinc/29/55/54/1029295554.db2.gz ANNWTCHTILQDGX-CQSZACIVSA-N 1 1 318.383 3.840 20 10 DHCDMO CCCNCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817963248 1029299413 /nfs/dbraw/zinc/29/94/13/1029299413.db2.gz SUJBRQNSPJYEDG-LJQANCHMSA-N 1 1 312.457 3.655 20 10 DHCDMO CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817962056 1029300503 /nfs/dbraw/zinc/30/05/03/1029300503.db2.gz HIZZKBWPERLZPA-QWRGUYRKSA-N 1 1 304.356 3.579 20 10 DHCDMO CCC[NH2+]CC[NH2+][C@H](CC)c1cc(Cl)cc(Cl)c1[O-] ZINC000817963053 1029301368 /nfs/dbraw/zinc/30/13/68/1029301368.db2.gz RGHXBNDYTFZORJ-CYBMUJFWSA-N 1 1 305.249 3.739 20 10 DHCDMO C[C@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817983009 1029320700 /nfs/dbraw/zinc/32/07/00/1029320700.db2.gz XMWVYAHBHCRTFI-ZANVPECISA-N 1 1 317.260 3.867 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)Cc2ccoc2)c1 ZINC000781897059 1029436214 /nfs/dbraw/zinc/43/62/14/1029436214.db2.gz CDMKBKYRSICYTM-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1cc(Br)c([O-])c(C[N@@H+](C)Cc2ccoc2)c1 ZINC000781897059 1029436205 /nfs/dbraw/zinc/43/62/05/1029436205.db2.gz CDMKBKYRSICYTM-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3O)C2)s1 ZINC000374893471 1029489653 /nfs/dbraw/zinc/48/96/53/1029489653.db2.gz JGMQLEZSNNDDDM-LBPRGKRZSA-N 1 1 306.406 3.676 20 10 DHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)cs1 ZINC000772854919 1029889208 /nfs/dbraw/zinc/88/92/08/1029889208.db2.gz DEDVCXMKIYRQHK-LBPRGKRZSA-N 1 1 301.459 3.685 20 10 DHCDMO CC(C)n1cncc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000822442269 1030023231 /nfs/dbraw/zinc/02/32/31/1030023231.db2.gz BBIWDQZXCSIURO-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO COc1cccc(C[N@H+](C)Cc2nc3ccccc3s2)c1O ZINC000120797509 1030071618 /nfs/dbraw/zinc/07/16/18/1030071618.db2.gz RIWQEBGVNKSUHX-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2nc3ccccc3s2)c1O ZINC000120797509 1030071634 /nfs/dbraw/zinc/07/16/34/1030071634.db2.gz RIWQEBGVNKSUHX-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](CC)[C@@H](C)c2cccnc2)c1 ZINC000290557551 1030106415 /nfs/dbraw/zinc/10/64/15/1030106415.db2.gz SCZDJKABHPOSEJ-AWEZNQCLSA-N 1 1 300.402 3.769 20 10 DHCDMO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000924649492 1030149226 /nfs/dbraw/zinc/14/92/26/1030149226.db2.gz QSJNFMYECBQRLP-KRWDZBQOSA-N 1 1 311.429 3.750 20 10 DHCDMO CC(C)[N@@H+](CCO)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823386968 1030275443 /nfs/dbraw/zinc/27/54/43/1030275443.db2.gz RGPDOVPCPCURSH-UHFFFAOYSA-N 1 1 318.486 3.587 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccc(Cl)cc1O ZINC000866530904 1030348780 /nfs/dbraw/zinc/34/87/80/1030348780.db2.gz NRWNOSHSOGBYAC-QWHCGFSZSA-N 1 1 309.837 3.903 20 10 DHCDMO CC[C@@H](c1ccc(C)cc1O)[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925755199 1030482520 /nfs/dbraw/zinc/48/25/20/1030482520.db2.gz UTRBQJZBEGONOZ-KRWDZBQOSA-N 1 1 312.413 3.629 20 10 DHCDMO CC[N@@H+](Cc1cnc2cc(C)ccn12)Cc1ccc(N(C)C)cc1 ZINC001136893137 1030577234 /nfs/dbraw/zinc/57/72/34/1030577234.db2.gz ZCWCSLKFWKJHRA-UHFFFAOYSA-N 1 1 322.456 3.731 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccnn2CC2CC2)C2CC2)cc1 ZINC000824555227 1030582750 /nfs/dbraw/zinc/58/27/50/1030582750.db2.gz CRLMBPYXDXCIKO-UHFFFAOYSA-N 1 1 324.472 3.524 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccnn2CC2CC2)C2CC2)cc1 ZINC000824555227 1030582765 /nfs/dbraw/zinc/58/27/65/1030582765.db2.gz CRLMBPYXDXCIKO-UHFFFAOYSA-N 1 1 324.472 3.524 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(OCC(F)F)cc1)CC2 ZINC001136940817 1030652060 /nfs/dbraw/zinc/65/20/60/1030652060.db2.gz QZTMQRCUBPRREC-UHFFFAOYSA-N 1 1 319.351 3.594 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C3CCOCC3)C2)cc1Cl ZINC000824895339 1030660957 /nfs/dbraw/zinc/66/09/57/1030660957.db2.gz UQOYSPBLWMWVQO-AWEZNQCLSA-N 1 1 309.837 3.603 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1 ZINC000246907449 1030660869 /nfs/dbraw/zinc/66/08/69/1030660869.db2.gz UOMRTWQXMMFPHH-DOTOQJQBSA-N 1 1 317.454 3.850 20 10 DHCDMO Cc1ccc2c(C[N@H+]3CCCc4cc(O)c(O)cc4C3)c[nH]c2c1 ZINC001136975521 1030685710 /nfs/dbraw/zinc/68/57/10/1030685710.db2.gz KHHDFBNKLORFHT-UHFFFAOYSA-N 1 1 322.408 3.836 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000927115375 1031101115 /nfs/dbraw/zinc/10/11/15/1031101115.db2.gz LGJWXQHCBHRFJC-YJYMSZOUSA-N 1 1 315.388 3.886 20 10 DHCDMO CCOC(C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)OCC ZINC000123654924 1031226774 /nfs/dbraw/zinc/22/67/74/1031226774.db2.gz CTVCKQJCDFNZTF-UHFFFAOYSA-N 1 1 320.477 3.508 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccc(O)c1F ZINC000872026962 1031410060 /nfs/dbraw/zinc/41/00/60/1031410060.db2.gz AGHSCEJFCZJHAN-LLVKDONJSA-N 1 1 306.356 3.587 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+](CC1CC1)C1CC1 ZINC001144307874 1031456586 /nfs/dbraw/zinc/45/65/86/1031456586.db2.gz KAPXEUVNHPUMSA-UHFFFAOYSA-N 1 1 314.198 3.668 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+](CC1CC1)C1CC1 ZINC001144307874 1031456595 /nfs/dbraw/zinc/45/65/95/1031456595.db2.gz KAPXEUVNHPUMSA-UHFFFAOYSA-N 1 1 314.198 3.668 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]Cc2ncc(Cl)s2)c2c1c(F)ccc2O ZINC000872114836 1031505823 /nfs/dbraw/zinc/50/58/23/1031505823.db2.gz COPGUYXVUVNQFA-APPZFPTMSA-N 1 1 312.797 3.979 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872260406 1031565817 /nfs/dbraw/zinc/56/58/17/1031565817.db2.gz PSMDERGAMPMJSU-MRXNPFEDSA-N 1 1 309.837 3.969 20 10 DHCDMO CC(C)(C)[N@@H+](Cc1ccccc1)Cc1c(O)cc(O)cc1O ZINC001144500296 1031645942 /nfs/dbraw/zinc/64/59/42/1031645942.db2.gz QTDKQCYLULIRGV-UHFFFAOYSA-N 1 1 301.386 3.604 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c(O)c1 ZINC001144509275 1031665095 /nfs/dbraw/zinc/66/50/95/1031665095.db2.gz RMPCDXYOYCJWLG-OAHLLOKOSA-N 1 1 319.788 3.794 20 10 DHCDMO CC(=O)Nc1ccc2c(c1)C[N@H+](Cc1cc(C)c(C)cc1O)CC2 ZINC000872811685 1031666602 /nfs/dbraw/zinc/66/66/02/1031666602.db2.gz OELAUYJNGVXBPL-UHFFFAOYSA-N 1 1 324.424 3.526 20 10 DHCDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144514556 1031672009 /nfs/dbraw/zinc/67/20/09/1031672009.db2.gz KLHLRUPQXBPLTO-JTQLQIEISA-N 1 1 307.777 3.650 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(C)cccc2C)c(O)c1OC ZINC000897624619 1031747284 /nfs/dbraw/zinc/74/72/84/1031747284.db2.gz RRWQAXDROIYFPP-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000873260765 1031780261 /nfs/dbraw/zinc/78/02/61/1031780261.db2.gz HDESRKBOHULUJM-UZMCECQYSA-N 1 1 308.853 3.617 20 10 DHCDMO CC(C)O[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000846012846 1031804125 /nfs/dbraw/zinc/80/41/25/1031804125.db2.gz BHVJZSJGFXFQLI-GFCCVEGCSA-N 1 1 301.789 3.574 20 10 DHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000846012846 1031804136 /nfs/dbraw/zinc/80/41/36/1031804136.db2.gz BHVJZSJGFXFQLI-GFCCVEGCSA-N 1 1 301.789 3.574 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846055212 1031847290 /nfs/dbraw/zinc/84/72/90/1031847290.db2.gz UKACSOFVLWXFSO-UHFFFAOYSA-N 1 1 305.727 3.806 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1Cl ZINC000897941564 1031891660 /nfs/dbraw/zinc/89/16/60/1031891660.db2.gz BUHMQZNLLWVEDY-UHFFFAOYSA-N 1 1 308.809 3.929 20 10 DHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001142527146 1031905918 /nfs/dbraw/zinc/90/59/18/1031905918.db2.gz MEZNNQOGQDVGNV-GFCCVEGCSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001142527146 1031905935 /nfs/dbraw/zinc/90/59/35/1031905935.db2.gz MEZNNQOGQDVGNV-GFCCVEGCSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001142527146 1031905950 /nfs/dbraw/zinc/90/59/50/1031905950.db2.gz MEZNNQOGQDVGNV-GFCCVEGCSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1c(CN2CCC([NH2+]C3CCC3)CC2)ccc2ccccc21 ZINC000897983033 1031910472 /nfs/dbraw/zinc/91/04/72/1031910472.db2.gz WDEBWHIOPVEKGA-UHFFFAOYSA-N 1 1 310.441 3.652 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)[C@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000846189345 1031923397 /nfs/dbraw/zinc/92/33/97/1031923397.db2.gz TVGUCFKLJHPZBV-IXDGSTSKSA-N 1 1 317.404 3.868 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)ccc2O)o1 ZINC000137065484 1033321170 /nfs/dbraw/zinc/32/11/70/1033321170.db2.gz NGYWSBVKXQACAL-INIZCTEOSA-N 1 1 301.386 3.777 20 10 DHCDMO Cc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(O)c1 ZINC000877519666 1033332990 /nfs/dbraw/zinc/33/29/90/1033332990.db2.gz ZEHHAKMEENOLML-AABGKKOBSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1ccc(Br)cc1O ZINC000825980187 1033369272 /nfs/dbraw/zinc/36/92/72/1033369272.db2.gz UNFMSDWXFGRABG-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000191278166 1033390055 /nfs/dbraw/zinc/39/00/55/1033390055.db2.gz QRMXRWHYSHCQTB-UHFFFAOYSA-N 1 1 315.461 3.680 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1C ZINC000877674937 1033407304 /nfs/dbraw/zinc/40/73/04/1033407304.db2.gz XMWIZLKMMSSYSE-MOPGFXCFSA-N 1 1 311.425 3.707 20 10 DHCDMO CO[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001172921095 1033469241 /nfs/dbraw/zinc/46/92/41/1033469241.db2.gz XXAQKEGRYXMFMY-CHWSQXEVSA-N 1 1 320.820 3.641 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CC[C@@H](C(F)(F)F)O1 ZINC000877823525 1033474366 /nfs/dbraw/zinc/47/43/66/1033474366.db2.gz MCKZFXXIVOMUBJ-ZANVPECISA-N 1 1 323.742 3.587 20 10 DHCDMO Cc1c(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)ccnc1F ZINC000862219770 1033782607 /nfs/dbraw/zinc/78/26/07/1033782607.db2.gz SMORFTXORWJUMS-UHFFFAOYSA-N 1 1 313.420 3.760 20 10 DHCDMO Cc1ccoc1C[N@@H+](C)Cc1c(O)cccc1Br ZINC000862374352 1033833410 /nfs/dbraw/zinc/83/34/10/1033833410.db2.gz LVYZUAHYXBSDJK-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1c(O)cccc1Br ZINC000862374352 1033833423 /nfs/dbraw/zinc/83/34/23/1033833423.db2.gz LVYZUAHYXBSDJK-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173863373 1033886592 /nfs/dbraw/zinc/88/65/92/1033886592.db2.gz NPRRBGNYYUFDAZ-CYBMUJFWSA-N 1 1 315.417 3.982 20 10 DHCDMO CC(C)C(=O)CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000808736159 1034250268 /nfs/dbraw/zinc/25/02/68/1034250268.db2.gz LQHFONJTCHBKKH-UHFFFAOYSA-N 1 1 301.386 3.603 20 10 DHCDMO CCc1cccc(CN2CCC(CC)([NH+]3CCCC3)CC2)c1O ZINC000864050952 1034277603 /nfs/dbraw/zinc/27/76/03/1034277603.db2.gz WQFXYOMOSXXGOW-UHFFFAOYSA-N 1 1 316.489 3.795 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000184998370 1034519131 /nfs/dbraw/zinc/51/91/31/1034519131.db2.gz LSJMPBKVLYXVSN-GJZGRUSLSA-N 1 1 314.404 3.708 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cn1 ZINC000185085216 1034528319 /nfs/dbraw/zinc/52/83/19/1034528319.db2.gz ZRPJBRUOTDOCSW-CYBMUJFWSA-N 1 1 317.408 3.623 20 10 DHCDMO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185737626 1034571500 /nfs/dbraw/zinc/57/15/00/1034571500.db2.gz RETCEYUXWAIXCX-DZKIICNBSA-N 1 1 317.404 3.737 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2C2CCOCC2)cc1 ZINC000777438651 1034743149 /nfs/dbraw/zinc/74/31/49/1034743149.db2.gz ACMXXJNQJDKFGS-FQEVSTJZSA-N 1 1 316.489 3.924 20 10 DHCDMO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958402 1035560935 /nfs/dbraw/zinc/56/09/35/1035560935.db2.gz ZNGPGHSFFAXTKP-HOCLYGCPSA-N 1 1 315.816 3.820 20 10 DHCDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958402 1035560951 /nfs/dbraw/zinc/56/09/51/1035560951.db2.gz ZNGPGHSFFAXTKP-HOCLYGCPSA-N 1 1 315.816 3.820 20 10 DHCDMO COc1ccc(C[N@@H+](CC2CC2)C2CCCCC2)c(O)c1OC ZINC001180048893 1035565112 /nfs/dbraw/zinc/56/51/12/1035565112.db2.gz YJXHRJDWNXOCPP-UHFFFAOYSA-N 1 1 319.445 3.954 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](OCC3CC3)C2)cc1 ZINC000773846964 1035638397 /nfs/dbraw/zinc/63/83/97/1035638397.db2.gz MJSGGXGHWJWFQC-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO CCc1cccc(C[N@H+]2CCC(C)=C(Br)C2)c1O ZINC001181254609 1035884837 /nfs/dbraw/zinc/88/48/37/1035884837.db2.gz IYLFXXNJXBDQBC-UHFFFAOYSA-N 1 1 310.235 3.829 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCCC3(CCOCC3)C2)c1 ZINC001181360307 1035895500 /nfs/dbraw/zinc/89/55/00/1035895500.db2.gz FNXPXLKNIFYCII-UHFFFAOYSA-N 1 1 303.446 3.908 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc2c1OCC2 ZINC001181554434 1035940367 /nfs/dbraw/zinc/94/03/67/1035940367.db2.gz DGKADVDOUCZHBA-UHFFFAOYSA-N 1 1 322.452 3.854 20 10 DHCDMO C[N@H+](Cc1cc(C2CC2)no1)Cc1ccc(N2CCCC2)cc1 ZINC001181556444 1035940434 /nfs/dbraw/zinc/94/04/34/1035940434.db2.gz WSOJOPUODUHSHR-UHFFFAOYSA-N 1 1 311.429 3.784 20 10 DHCDMO C[N@@H+](Cc1cc(C2CC2)no1)Cc1ccc(N2CCCC2)cc1 ZINC001181556444 1035940442 /nfs/dbraw/zinc/94/04/42/1035940442.db2.gz WSOJOPUODUHSHR-UHFFFAOYSA-N 1 1 311.429 3.784 20 10 DHCDMO CC(C)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@H](CO)C(C)C ZINC001181891532 1036036392 /nfs/dbraw/zinc/03/63/92/1036036392.db2.gz BJPSTHZRNNUFKS-BLLLJJGKSA-N 1 1 317.832 3.563 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CCCCC1 ZINC000775636928 1036134376 /nfs/dbraw/zinc/13/43/76/1036134376.db2.gz JEAIFUZCTZVLBM-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CCCCC1 ZINC000775636928 1036134385 /nfs/dbraw/zinc/13/43/85/1036134385.db2.gz JEAIFUZCTZVLBM-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCN(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774168272 1036211242 /nfs/dbraw/zinc/21/12/42/1036211242.db2.gz ZOKAZCUQMFGYHC-ZJUUUORDSA-N 1 1 315.244 3.586 20 10 DHCDMO C[C@H]([NH2+]CC1(O)CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774189318 1036217329 /nfs/dbraw/zinc/21/73/29/1036217329.db2.gz WBCOMOXEWSKMTF-VIFPVBQESA-N 1 1 304.217 3.655 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2[O-])cc(OC)c1 ZINC000775654310 1036241498 /nfs/dbraw/zinc/24/14/98/1036241498.db2.gz XWRVRWIVMRICGE-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO CC[C@@H](O)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774252237 1036256561 /nfs/dbraw/zinc/25/65/61/1036256561.db2.gz KIECACFFUXDIBV-VHSXEESVSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@@H]([NH2+]CC1(CO)CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774356069 1036312166 /nfs/dbraw/zinc/31/21/66/1036312166.db2.gz MRKGCQUYXWJUQX-SNVBAGLBSA-N 1 1 318.244 3.902 20 10 DHCDMO CCC[N@@H+](Cc1ccc2c(c1)ncn2C)Cc1ccccc1O ZINC000775667540 1036329860 /nfs/dbraw/zinc/32/98/60/1036329860.db2.gz KQDHFRYOHWRDIT-UHFFFAOYSA-N 1 1 309.413 3.691 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC001195790699 1036347904 /nfs/dbraw/zinc/34/79/04/1036347904.db2.gz VWFGCQHLIAAGDJ-UHFFFAOYSA-N 1 1 323.440 3.745 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@H]2CCC[C@H](C)C2)cc1 ZINC001195790684 1036349066 /nfs/dbraw/zinc/34/90/66/1036349066.db2.gz VKIRIRFCRGYNHI-IRXDYDNUSA-N 1 1 304.478 3.890 20 10 DHCDMO CCc1cnc(C[NH2+]Cc2ccc(N(CC)CC)cc2)s1 ZINC000230706728 1036397289 /nfs/dbraw/zinc/39/72/89/1036397289.db2.gz MZMLANNFRSENBM-UHFFFAOYSA-N 1 1 303.475 3.842 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000775699141 1036473833 /nfs/dbraw/zinc/47/38/33/1036473833.db2.gz ZZRIALIPMZCJDS-SFHVURJKSA-N 1 1 315.438 3.691 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182968711 1036489076 /nfs/dbraw/zinc/48/90/76/1036489076.db2.gz DWPXPQLQMHVDQX-SJCJKPOMSA-N 1 1 313.388 3.760 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001182978098 1036501235 /nfs/dbraw/zinc/50/12/35/1036501235.db2.gz IPJNEKNZLQXQGK-HXUWFJFHSA-N 1 1 310.441 3.714 20 10 DHCDMO Oc1ccc([C@@H]2CC[N@H+](Cc3cc(Cl)c(F)cc3O)C2)cc1 ZINC001183156611 1036541429 /nfs/dbraw/zinc/54/14/29/1036541429.db2.gz OAJHGNGCSSROHU-GFCCVEGCSA-N 1 1 321.779 3.880 20 10 DHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C2)cc1 ZINC001183156611 1036541440 /nfs/dbraw/zinc/54/14/40/1036541440.db2.gz OAJHGNGCSSROHU-GFCCVEGCSA-N 1 1 321.779 3.880 20 10 DHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCOC2(C1)CCCCCC2 ZINC000775725127 1036566005 /nfs/dbraw/zinc/56/60/05/1036566005.db2.gz IWDIFQJGYQEOQL-UHFFFAOYSA-N 1 1 309.837 3.971 20 10 DHCDMO C[C@@H]1CCOCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000774650717 1036629855 /nfs/dbraw/zinc/62/98/55/1036629855.db2.gz ROBOOJXTIYGECP-CYBMUJFWSA-N 1 1 311.381 3.902 20 10 DHCDMO COCc1ccccc1/C=C(/C)C[NH2+]Cc1c(O)cccc1F ZINC001183919604 1036712830 /nfs/dbraw/zinc/71/28/30/1036712830.db2.gz MQTALVXBELFLHC-UVTDQMKNSA-N 1 1 315.388 3.871 20 10 DHCDMO CC[N@@H+](Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(OC)cc1 ZINC001203875562 1036757975 /nfs/dbraw/zinc/75/79/75/1036757975.db2.gz QCRFPRCKUIKRMS-CQSZACIVSA-N 1 1 315.413 3.560 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCc3cc(F)ccc3C2)cc1 ZINC001168444269 1036852752 /nfs/dbraw/zinc/85/27/52/1036852752.db2.gz GOLVZHIDXQGRRN-FQEVSTJZSA-N 1 1 312.432 3.881 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCc3cc(F)ccc3C2)cc1 ZINC001168444270 1036853021 /nfs/dbraw/zinc/85/30/21/1036853021.db2.gz GOLVZHIDXQGRRN-HXUWFJFHSA-N 1 1 312.432 3.881 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCO2)ccc1N(C)C ZINC001198686052 1037108966 /nfs/dbraw/zinc/10/89/66/1037108966.db2.gz QNUZCXAAZNRGBR-MOPGFXCFSA-N 1 1 302.462 3.595 20 10 DHCDMO CCCCCC[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001199059941 1037190942 /nfs/dbraw/zinc/19/09/42/1037190942.db2.gz JZBMZKZGDREMMC-SFHVURJKSA-N 1 1 317.521 3.887 20 10 DHCDMO CCCCC[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911611 1037207154 /nfs/dbraw/zinc/20/71/54/1037207154.db2.gz ICAMMDXQMCOIMM-CQSZACIVSA-N 1 1 322.405 3.854 20 10 DHCDMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911611 1037207167 /nfs/dbraw/zinc/20/71/67/1037207167.db2.gz ICAMMDXQMCOIMM-CQSZACIVSA-N 1 1 322.405 3.854 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1O)CC1(C)COC1 ZINC000776010149 1037305247 /nfs/dbraw/zinc/30/52/47/1037305247.db2.gz MMBIMOVNXVGLFD-INIZCTEOSA-N 1 1 311.425 3.992 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000776015667 1037308796 /nfs/dbraw/zinc/30/87/96/1037308796.db2.gz XBHMRFYVJSAFRX-ZYHUDNBSSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCC[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775014922 1037398056 /nfs/dbraw/zinc/39/80/56/1037398056.db2.gz XHWUCAFRTNLEMN-TZMCWYRMSA-N 1 1 322.405 3.613 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000775020559 1037425764 /nfs/dbraw/zinc/42/57/64/1037425764.db2.gz JSCHTLOTQWEVCP-CHWSQXEVSA-N 1 1 322.405 3.615 20 10 DHCDMO c1sc(C[NH2+]Cc2ccc(N3CCCC3)cc2)nc1C1CC1 ZINC001201588181 1037792561 /nfs/dbraw/zinc/79/25/61/1037792561.db2.gz XHZBEIFIEPMBMX-UHFFFAOYSA-N 1 1 313.470 3.911 20 10 DHCDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000775204613 1038002387 /nfs/dbraw/zinc/00/23/87/1038002387.db2.gz AHDCXZPNIJSHOU-KRWDZBQOSA-N 1 1 316.489 3.924 20 10 DHCDMO CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491787 1038567769 /nfs/dbraw/zinc/56/77/69/1038567769.db2.gz JUMZOESCHPTYQJ-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491787 1038567776 /nfs/dbraw/zinc/56/77/76/1038567776.db2.gz JUMZOESCHPTYQJ-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493278 1038569292 /nfs/dbraw/zinc/56/92/92/1038569292.db2.gz WXICDCCGKNTXIR-BLLLJJGKSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493278 1038569298 /nfs/dbraw/zinc/56/92/98/1038569298.db2.gz WXICDCCGKNTXIR-BLLLJJGKSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493281 1038569467 /nfs/dbraw/zinc/56/94/67/1038569467.db2.gz WXICDCCGKNTXIR-MLGOLLRUSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493281 1038569471 /nfs/dbraw/zinc/56/94/71/1038569471.db2.gz WXICDCCGKNTXIR-MLGOLLRUSA-N 1 1 308.853 3.571 20 10 DHCDMO Cc1cc(C[N@@H+]2CCN(C)CC2(C)C)ccc1N1CCCCC1 ZINC001192262097 1038615463 /nfs/dbraw/zinc/61/54/63/1038615463.db2.gz QSVFTYMTDXAYIM-UHFFFAOYSA-N 1 1 315.505 3.511 20 10 DHCDMO Cc1cc(CN2CC[N@@H+](C)CC2(C)C)ccc1N1CCCCC1 ZINC001192262097 1038615465 /nfs/dbraw/zinc/61/54/65/1038615465.db2.gz QSVFTYMTDXAYIM-UHFFFAOYSA-N 1 1 315.505 3.511 20 10 DHCDMO Cc1cc(CN2CC[N@H+](C)CC2(C)C)ccc1N1CCCCC1 ZINC001192262097 1038615472 /nfs/dbraw/zinc/61/54/72/1038615472.db2.gz QSVFTYMTDXAYIM-UHFFFAOYSA-N 1 1 315.505 3.511 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]CC2(CN(C)C)CCCC2)c2c1c(F)ccc2O ZINC000760896580 1039031891 /nfs/dbraw/zinc/03/18/91/1039031891.db2.gz HGAOYXZFZVQWJS-UKRRQHHQSA-N 1 1 320.452 3.791 20 10 DHCDMO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(N(C)C)cc1 ZINC000760896543 1039037144 /nfs/dbraw/zinc/03/71/44/1039037144.db2.gz GLGAWBABVBRCTP-INIZCTEOSA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@H](NCC1(C[NH+](C)C)CCCC1)c1ccc(N(C)C)cc1 ZINC000760896543 1039037158 /nfs/dbraw/zinc/03/71/58/1039037158.db2.gz GLGAWBABVBRCTP-INIZCTEOSA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000172097101 1039738581 /nfs/dbraw/zinc/73/85/81/1039738581.db2.gz JJXMFVRVYJTHDF-SFHVURJKSA-N 1 1 324.468 3.759 20 10 DHCDMO Nc1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC001120370989 1040602113 /nfs/dbraw/zinc/60/21/13/1040602113.db2.gz LUQGRFPNQISXIA-MRXNPFEDSA-N 1 1 302.443 3.512 20 10 DHCDMO CCC[N@@H+](Cc1ccc(NC(C)=O)cc1)Cc1ccccc1O ZINC000092704994 185334012 /nfs/dbraw/zinc/33/40/12/185334012.db2.gz WOFGUQPJFIXNSF-UHFFFAOYSA-N 1 1 312.413 3.763 20 10 DHCDMO CCOc1cccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000091901607 193124622 /nfs/dbraw/zinc/12/46/22/193124622.db2.gz FHPJANPVAHUGDU-UHFFFAOYSA-N 1 1 317.351 3.955 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1ccc(F)cc1O ZINC000062745230 184251998 /nfs/dbraw/zinc/25/19/98/184251998.db2.gz ZETPFIUTIRZRGS-FZMZJTMJSA-N 1 1 308.422 3.546 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2(c3ccccc3)CC2)c1 ZINC000273345714 130109347 /nfs/dbraw/zinc/10/93/47/130109347.db2.gz ANXXGCFMUXVWRB-ZDUSSCGKSA-N 1 1 311.381 3.519 20 10 DHCDMO Cc1cccc2oc(CC[NH2+][C@H](C)c3ccc(F)cc3O)nc21 ZINC000273598762 130141408 /nfs/dbraw/zinc/14/14/08/130141408.db2.gz ROVHMMHMACAVAO-GFCCVEGCSA-N 1 1 314.360 3.874 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)n(C)n1 ZINC000284385487 131076132 /nfs/dbraw/zinc/07/61/32/131076132.db2.gz OYISLDYCXUQTOX-SECBINFHSA-N 1 1 314.216 3.592 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c1 ZINC000284407307 131078371 /nfs/dbraw/zinc/07/83/71/131078371.db2.gz QDXAZPPHFBMPGX-UONOGXRCSA-N 1 1 300.229 3.716 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc(F)cc1O ZINC000285616415 131186424 /nfs/dbraw/zinc/18/64/24/131186424.db2.gz KMROVOKRVJEIPW-CQSZACIVSA-N 1 1 303.333 3.501 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccc(F)cc1O ZINC000286302506 131229256 /nfs/dbraw/zinc/22/92/56/131229256.db2.gz XBKJXJPLSDPZFP-CABCVRRESA-N 1 1 307.365 3.943 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1[O-] ZINC000286880216 131253663 /nfs/dbraw/zinc/25/36/63/131253663.db2.gz CIXNXORSGOMYKY-WFASDCNBSA-N 1 1 319.836 3.545 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287728638 131297960 /nfs/dbraw/zinc/29/79/60/131297960.db2.gz PAWLVEYWRJGUKS-BLLLJJGKSA-N 1 1 321.852 3.928 20 10 DHCDMO CC[C@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(C)cc1O ZINC000287748056 131298717 /nfs/dbraw/zinc/29/87/17/131298717.db2.gz ZEOSTKBREYOUPC-INIZCTEOSA-N 1 1 300.402 3.848 20 10 DHCDMO Cc1cnn(C)c1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000289071546 131356512 /nfs/dbraw/zinc/35/65/12/131356512.db2.gz JUQGQGQJQYSXKC-UHFFFAOYSA-N 1 1 313.445 3.769 20 10 DHCDMO COc1ccc(CN[C@@H](C[NH+](C)C)c2ccc(F)cc2)cc1C ZINC000290057789 131449101 /nfs/dbraw/zinc/44/91/01/131449101.db2.gz GXYZKGIOSCBDCV-SFHVURJKSA-N 1 1 316.420 3.535 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)CCCCO)c1cc(Cl)c(Cl)cc1O ZINC000296281560 335143020 /nfs/dbraw/zinc/14/30/20/335143020.db2.gz FAOJDBGCKCJFAO-VHSXEESVSA-N 1 1 306.233 3.901 20 10 DHCDMO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc(F)ccc2O)cs1 ZINC000273460898 334047329 /nfs/dbraw/zinc/04/73/29/334047329.db2.gz CQDIWLMCQHGBMN-ZJUUUORDSA-N 1 1 310.394 3.546 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1O ZINC000285739903 334149600 /nfs/dbraw/zinc/14/96/00/334149600.db2.gz RCOMHDQFMORARA-KRWDZBQOSA-N 1 1 302.393 3.838 20 10 DHCDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc(F)cc1O ZINC000368586511 336848685 /nfs/dbraw/zinc/84/86/85/336848685.db2.gz YUKTZULHPCMAJE-YMNVWFMLSA-N 1 1 305.324 3.843 20 10 DHCDMO COc1ccccc1C1CC([NH2+]Cc2cccc(F)c2O)C1 ZINC000368601766 336848927 /nfs/dbraw/zinc/84/89/27/336848927.db2.gz LEZZCCBQMNWRSS-UHFFFAOYSA-N 1 1 301.361 3.576 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000375255466 337006611 /nfs/dbraw/zinc/00/66/11/337006611.db2.gz GNAJJCICETUFCD-NVXWUHKLSA-N 1 1 313.445 3.532 20 10 DHCDMO COc1ccc(N2CCC([N@@H+](C)CCCCCF)CC2)cc1 ZINC000375361141 337009115 /nfs/dbraw/zinc/00/91/15/337009115.db2.gz JFQQSGFMAOLGCP-UHFFFAOYSA-N 1 1 308.441 3.736 20 10 DHCDMO CN1CCc2cc(C[NH2+]Cc3ncc(C(C)(C)C)s3)ccc21 ZINC000377047771 337046029 /nfs/dbraw/zinc/04/60/29/337046029.db2.gz QHWNKHYIVMKEEL-UHFFFAOYSA-N 1 1 315.486 3.723 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000377615649 337056322 /nfs/dbraw/zinc/05/63/22/337056322.db2.gz MZDWLXVAXLBXMD-CABCVRRESA-N 1 1 301.390 3.762 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000377615649 337056323 /nfs/dbraw/zinc/05/63/23/337056323.db2.gz MZDWLXVAXLBXMD-CABCVRRESA-N 1 1 301.390 3.762 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1O ZINC000378439664 337072761 /nfs/dbraw/zinc/07/27/61/337072761.db2.gz STQDMIKJAFAPLH-CYBMUJFWSA-N 1 1 317.820 3.524 20 10 DHCDMO Oc1c(Cl)cccc1CN1CCO[C@@H](c2ccsc2)C1 ZINC000180545519 337176279 /nfs/dbraw/zinc/17/62/79/337176279.db2.gz SMGUDUXGDSVSJT-CQSZACIVSA-N 1 1 309.818 3.681 20 10 DHCDMO C[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cc(F)ccc1O ZINC000186052880 337253252 /nfs/dbraw/zinc/25/32/52/337253252.db2.gz SJQAMOIUCAUPTP-ZDUSSCGKSA-N 1 1 323.371 3.839 20 10 DHCDMO C[N@H+]1Cc2ccc(NCc3c(O)ccc(Cl)c3F)cc2C1 ZINC000191407967 337296791 /nfs/dbraw/zinc/29/67/91/337296791.db2.gz CHEZRHFTVXITTK-UHFFFAOYSA-N 1 1 306.768 3.742 20 10 DHCDMO C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc2ccccc2c1[O-] ZINC000273388122 341635452 /nfs/dbraw/zinc/63/54/52/341635452.db2.gz DFDOMFOOWLEEDF-HNNXBMFYSA-N 1 1 312.457 3.928 20 10 DHCDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000156408817 522375046 /nfs/dbraw/zinc/37/50/46/522375046.db2.gz JANBNDDGMSFOQW-WMLDXEAASA-N 1 1 302.418 3.692 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccccc2)cc1OC ZINC000159623391 522772373 /nfs/dbraw/zinc/77/23/73/522772373.db2.gz FRYASCDUIMGNIY-MRXNPFEDSA-N 1 1 313.397 3.747 20 10 DHCDMO COc1cc(O)c(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160316476 522779460 /nfs/dbraw/zinc/77/94/60/522779460.db2.gz NXKCXBGIRSSWCL-DJJJIMSYSA-N 1 1 313.397 3.602 20 10 DHCDMO Cc1cccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1O ZINC000191576746 524434929 /nfs/dbraw/zinc/43/49/29/524434929.db2.gz RCOSGNOKHZUNED-ZDUSSCGKSA-N 1 1 315.417 3.982 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@H](c2ccsc2)O1 ZINC000180223353 524611024 /nfs/dbraw/zinc/61/10/24/524611024.db2.gz KAVPSZNBLCOJHS-MEDUHNTESA-N 1 1 307.390 3.555 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@H](c2ccsc2)O1 ZINC000180223353 524611033 /nfs/dbraw/zinc/61/10/33/524611033.db2.gz KAVPSZNBLCOJHS-MEDUHNTESA-N 1 1 307.390 3.555 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2csc(C)n2)c1O ZINC000189919112 525941090 /nfs/dbraw/zinc/94/10/90/525941090.db2.gz JNXSQALZPNZRJK-AWEZNQCLSA-N 1 1 304.415 3.503 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1[O-] ZINC000286880214 535804699 /nfs/dbraw/zinc/80/46/99/535804699.db2.gz CIXNXORSGOMYKY-SWLSCSKDSA-N 1 1 319.836 3.545 20 10 DHCDMO Cc1csc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000037988436 1013299396 /nfs/dbraw/zinc/29/93/96/1013299396.db2.gz HXZOJJLYHXVABE-UHFFFAOYSA-N 1 1 301.459 3.732 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000894431158 1013357905 /nfs/dbraw/zinc/35/79/05/1013357905.db2.gz NQJONHXJOVQTBP-DGCLKSJQSA-N 1 1 317.351 3.872 20 10 DHCDMO Cc1ccc(C2CC[NH+](Cc3cc(F)cc(F)c3O)CC2)cn1 ZINC000894441325 1013358470 /nfs/dbraw/zinc/35/84/70/1013358470.db2.gz LYDAMXLYOXIXEM-UHFFFAOYSA-N 1 1 318.367 3.753 20 10 DHCDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461199 1013378121 /nfs/dbraw/zinc/37/81/21/1013378121.db2.gz CYURPFHMYNVYSC-BZNIZROVSA-N 1 1 304.340 3.649 20 10 DHCDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461199 1013378112 /nfs/dbraw/zinc/37/81/12/1013378112.db2.gz CYURPFHMYNVYSC-BZNIZROVSA-N 1 1 304.340 3.649 20 10 DHCDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461201 1013378786 /nfs/dbraw/zinc/37/87/86/1013378786.db2.gz CYURPFHMYNVYSC-ZBEGNZNMSA-N 1 1 304.340 3.649 20 10 DHCDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461201 1013378803 /nfs/dbraw/zinc/37/88/03/1013378803.db2.gz CYURPFHMYNVYSC-ZBEGNZNMSA-N 1 1 304.340 3.649 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(O)cc1F ZINC001140129656 1013466744 /nfs/dbraw/zinc/46/67/44/1013466744.db2.gz HWURPMMCTRKATD-UHFFFAOYSA-N 1 1 302.393 3.619 20 10 DHCDMO C[N@@H+](Cc1c(O)cccc1Cl)[C@@H](CCO)c1ccccc1 ZINC000126893230 1014500693 /nfs/dbraw/zinc/50/06/93/1014500693.db2.gz IGXZMIUBYJHTKF-INIZCTEOSA-N 1 1 305.805 3.601 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cc1 ZINC000121281315 1014981813 /nfs/dbraw/zinc/98/18/13/1014981813.db2.gz PTNZHDNHHPNLOE-KRWDZBQOSA-N 1 1 312.461 3.636 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000121281315 1014981820 /nfs/dbraw/zinc/98/18/20/1014981820.db2.gz PTNZHDNHHPNLOE-KRWDZBQOSA-N 1 1 312.461 3.636 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000121281315 1014981830 /nfs/dbraw/zinc/98/18/30/1014981830.db2.gz PTNZHDNHHPNLOE-KRWDZBQOSA-N 1 1 312.461 3.636 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000294675104 1032108816 /nfs/dbraw/zinc/10/88/16/1032108816.db2.gz MMELASPPYZUMMZ-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO CC[C@@H]([NH2+]CCOc1ccc(OC)cc1)c1ccc(F)cc1O ZINC000796676036 1015081289 /nfs/dbraw/zinc/08/12/89/1015081289.db2.gz PVWDQKJMOCSYBD-QGZVFWFLSA-N 1 1 319.376 3.660 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000707129729 1015085933 /nfs/dbraw/zinc/08/59/33/1015085933.db2.gz RIYPILTVMMDWQI-FZMZJTMJSA-N 1 1 310.235 3.919 20 10 DHCDMO CC[C@H]1COCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000738081760 1015159580 /nfs/dbraw/zinc/15/95/80/1015159580.db2.gz ODWDICSDGCSKOW-AWEZNQCLSA-N 1 1 311.381 3.902 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895846536 1015329766 /nfs/dbraw/zinc/32/97/66/1015329766.db2.gz PWGMHKZRQGFHDH-UYAOXDASSA-N 1 1 314.473 3.678 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896229465 1015513891 /nfs/dbraw/zinc/51/38/91/1015513891.db2.gz ZBIYRWZYFIZXHC-LBPRGKRZSA-N 1 1 323.717 3.912 20 10 DHCDMO CCc1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)c1O ZINC000896422358 1015580282 /nfs/dbraw/zinc/58/02/82/1015580282.db2.gz AUAQSAWAUNZTNG-DOTOQJQBSA-N 1 1 301.361 3.516 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1 ZINC000896531773 1015619442 /nfs/dbraw/zinc/61/94/42/1015619442.db2.gz OWLWIMIDDLXUQR-AWEZNQCLSA-N 1 1 302.443 3.612 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000896639606 1015693493 /nfs/dbraw/zinc/69/34/93/1015693493.db2.gz XCSGCYRYUYUPSP-HIFRSBDPSA-N 1 1 300.377 3.742 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1cnc(C2CCCC2)s1 ZINC000896642015 1015694886 /nfs/dbraw/zinc/69/48/86/1015694886.db2.gz VZKBXCCQIGQRQA-UHFFFAOYSA-N 1 1 306.406 3.935 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)O[C@H](C)[C@H]3C)c2c1 ZINC000783542354 1015760446 /nfs/dbraw/zinc/76/04/46/1015760446.db2.gz JYVIWGIVEHZARK-BFHYXJOUSA-N 1 1 315.413 3.552 20 10 DHCDMO Cn1ccnc1[C@@H]1[N@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000294746421 1032139733 /nfs/dbraw/zinc/13/97/33/1032139733.db2.gz HTTFGUADHHZTDL-SFHVURJKSA-N 1 1 321.424 3.862 20 10 DHCDMO Cn1ccnc1[C@@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000294746421 1032139752 /nfs/dbraw/zinc/13/97/52/1032139752.db2.gz HTTFGUADHHZTDL-SFHVURJKSA-N 1 1 321.424 3.862 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H]4CCC[C@@H]43)cc2)CC1 ZINC000934338764 1016469574 /nfs/dbraw/zinc/46/95/74/1016469574.db2.gz MPTPFCQRCYOGGJ-PXNSSMCTSA-N 1 1 314.473 3.676 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](c3cc(C)ccn3)C2)cc1 ZINC000846972957 1032150609 /nfs/dbraw/zinc/15/06/09/1032150609.db2.gz ZBTYIHRHPJUTSI-SFHVURJKSA-N 1 1 309.457 3.836 20 10 DHCDMO CCc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000108927901 1016909220 /nfs/dbraw/zinc/90/92/20/1016909220.db2.gz GMCWJILSJOGRHX-KBPBESRZSA-N 1 1 305.462 3.861 20 10 DHCDMO COc1ccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185578495 1017030142 /nfs/dbraw/zinc/03/01/42/1017030142.db2.gz CSLDRWDAXUESRZ-QWHCGFSZSA-N 1 1 319.376 3.658 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)C2CC(OC(C)(C)C)C2)cc1 ZINC001171275930 1032212724 /nfs/dbraw/zinc/21/27/24/1032212724.db2.gz FZTZVKOCGIXKFV-UHFFFAOYSA-N 1 1 304.478 3.921 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)cc1 ZINC000773135304 1032568192 /nfs/dbraw/zinc/56/81/92/1032568192.db2.gz COGVFAIKZFPSCP-KGLIPLIRSA-N 1 1 315.465 3.796 20 10 DHCDMO Oc1cc2ccccc2cc1CNc1cc[nH+]c(N2CCCC2)n1 ZINC001171400320 1032586380 /nfs/dbraw/zinc/58/63/80/1032586380.db2.gz SOBLXJOMAIUBQT-UHFFFAOYSA-N 1 1 320.396 3.548 20 10 DHCDMO Cc1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c(C)n1-c1ccccc1 ZINC000857871999 1032698103 /nfs/dbraw/zinc/69/81/03/1032698103.db2.gz ZXYYEWKBQMAXSK-LJQANCHMSA-N 1 1 320.440 3.984 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1O ZINC000363533862 1018012053 /nfs/dbraw/zinc/01/20/53/1018012053.db2.gz JWUKISVENJHYTK-XIRDDKMYSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533862 1018012064 /nfs/dbraw/zinc/01/20/64/1018012064.db2.gz JWUKISVENJHYTK-XIRDDKMYSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533862 1018012074 /nfs/dbraw/zinc/01/20/74/1018012074.db2.gz JWUKISVENJHYTK-XIRDDKMYSA-N 1 1 310.441 3.823 20 10 DHCDMO C[N@@H+](CCC1CCCC1)Cc1ccc(N2CCOCC2)cc1 ZINC000741774858 1018209492 /nfs/dbraw/zinc/20/94/92/1018209492.db2.gz IZBHCQCMJJHAPO-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(N2CCCCC2)cc1 ZINC000764433569 1018281486 /nfs/dbraw/zinc/28/14/86/1018281486.db2.gz SNDRJJFWOKYHFY-KRWDZBQOSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@H](NCC(C)(C)C[NH+](C)C)c1ccc(N2CCCCC2)cc1 ZINC000764433569 1018281495 /nfs/dbraw/zinc/28/14/95/1018281495.db2.gz SNDRJJFWOKYHFY-KRWDZBQOSA-N 1 1 317.521 3.915 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000178849759 1018311023 /nfs/dbraw/zinc/31/10/23/1018311023.db2.gz ZOENEGHHUVIKAS-SFHVURJKSA-N 1 1 315.388 3.722 20 10 DHCDMO C[C@@H](NC[C@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933636 1018431427 /nfs/dbraw/zinc/43/14/27/1018431427.db2.gz QFUYVOVXKOOBDT-IXDOHACOSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@@H](NC[C@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933636 1018431435 /nfs/dbraw/zinc/43/14/35/1018431435.db2.gz QFUYVOVXKOOBDT-IXDOHACOSA-N 1 1 303.494 3.524 20 10 DHCDMO CC[C@](C)([NH2+]Cc1ccc2c(c1)CCCO2)c1nccs1 ZINC000921769452 1018799415 /nfs/dbraw/zinc/79/94/15/1018799415.db2.gz PPTDKMRJVHZMPB-KRWDZBQOSA-N 1 1 302.443 3.883 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc3c(c2)CCCO3)o1 ZINC000921779097 1018818654 /nfs/dbraw/zinc/81/86/54/1018818654.db2.gz YXWBECDPYZWHII-KRWDZBQOSA-N 1 1 315.413 3.644 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1ccc(F)cc1O ZINC000170788882 1019434525 /nfs/dbraw/zinc/43/45/25/1019434525.db2.gz YMZGSZXGCSCMAD-CJNGLKHVSA-N 1 1 318.392 3.612 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)cc1C ZINC000727432101 1019711720 /nfs/dbraw/zinc/71/17/20/1019711720.db2.gz ZWGJIADZDHOLNW-OXJNMPFZSA-N 1 1 311.425 3.971 20 10 DHCDMO CCC[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccccc1O ZINC000727830693 1019819232 /nfs/dbraw/zinc/81/92/32/1019819232.db2.gz HIYSOVGVWIQPMH-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc1C ZINC000922519856 1020111664 /nfs/dbraw/zinc/11/16/64/1020111664.db2.gz HOECCEGLSRGQJF-QAPCUYQASA-N 1 1 301.361 3.570 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](c2ncccn2)C2CC2)cc1C ZINC000922576650 1020137494 /nfs/dbraw/zinc/13/74/94/1020137494.db2.gz CLEPFZBGLMPENQ-SFHVURJKSA-N 1 1 311.429 3.815 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C2CCCC2)oc1C ZINC000731845919 1020158309 /nfs/dbraw/zinc/15/83/09/1020158309.db2.gz NOKVXNKBNRZEFR-UHFFFAOYSA-N 1 1 300.402 3.942 20 10 DHCDMO Cc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000733198966 1020343589 /nfs/dbraw/zinc/34/35/89/1020343589.db2.gz NHDUORAKXJYCCT-UHFFFAOYSA-N 1 1 311.429 3.826 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1Cc2cccc(F)c2C1 ZINC001171810822 1032897636 /nfs/dbraw/zinc/89/76/36/1032897636.db2.gz VYALFXSQVRONDZ-SFHVURJKSA-N 1 1 312.432 3.881 20 10 DHCDMO COCC[N@H+](Cc1ccc(C)o1)Cc1c(O)cccc1Cl ZINC000131664682 1020453967 /nfs/dbraw/zinc/45/39/67/1020453967.db2.gz VTNHUXWEQPEIHL-UHFFFAOYSA-N 1 1 309.793 3.596 20 10 DHCDMO COCC[N@@H+](Cc1ccc(C)o1)Cc1c(O)cccc1Cl ZINC000131664682 1020453972 /nfs/dbraw/zinc/45/39/72/1020453972.db2.gz VTNHUXWEQPEIHL-UHFFFAOYSA-N 1 1 309.793 3.596 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c(O)cc1C ZINC000186848881 1020509318 /nfs/dbraw/zinc/50/93/18/1020509318.db2.gz NMMLKGDJBLVBSM-OAHLLOKOSA-N 1 1 318.442 3.811 20 10 DHCDMO CC[N@H+](Cc1cc(C)cc(C(C)(C)C)c1O)C[C@@H]1CCOC1 ZINC000738079879 1020857057 /nfs/dbraw/zinc/85/70/57/1020857057.db2.gz DPPBFFKPXCNYRK-HNNXBMFYSA-N 1 1 305.462 3.857 20 10 DHCDMO Cc1cc(C[NH2+][C@@H]2CCCn3ccnc32)c(C)n1-c1ccccc1 ZINC000858543647 1032939956 /nfs/dbraw/zinc/93/99/56/1032939956.db2.gz VBLHQOCQOVEVTE-LJQANCHMSA-N 1 1 320.440 3.915 20 10 DHCDMO Cc1ncsc1CC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000738878565 1020976935 /nfs/dbraw/zinc/97/69/35/1020976935.db2.gz VTVJEQAUJLYRFA-UHFFFAOYSA-N 1 1 317.502 3.971 20 10 DHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000742160242 1021096131 /nfs/dbraw/zinc/09/61/31/1021096131.db2.gz VVZCEHHJBDXBEN-CQSZACIVSA-N 1 1 304.393 3.887 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000125775342 1032969903 /nfs/dbraw/zinc/96/99/03/1032969903.db2.gz NUKDMQHPCQVNDV-MSOLQXFVSA-N 1 1 317.521 3.914 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125775342 1032969907 /nfs/dbraw/zinc/96/99/07/1032969907.db2.gz NUKDMQHPCQVNDV-MSOLQXFVSA-N 1 1 317.521 3.914 20 10 DHCDMO CCC(C)(C)CC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000743839475 1021374114 /nfs/dbraw/zinc/37/41/14/1021374114.db2.gz ZQOFBJXCMHQWDD-UHFFFAOYSA-N 1 1 304.478 3.781 20 10 DHCDMO CC[N@@H+](CCCSC)Cc1cc(Br)ccc1O ZINC000743871024 1021398482 /nfs/dbraw/zinc/39/84/82/1021398482.db2.gz MQFAOHHIFXEXFX-UHFFFAOYSA-N 1 1 318.280 3.730 20 10 DHCDMO c1c(C[NH2+]Cc2ccc3c(c2)CCO3)noc1-c1ccccc1 ZINC000236600116 1021407044 /nfs/dbraw/zinc/40/70/44/1021407044.db2.gz NUJSIWPAAUGSNM-UHFFFAOYSA-N 1 1 306.365 3.566 20 10 DHCDMO CC(C)(C)[N@@H+]1CC[C@H](NCc2ccc(N3CCCCC3)cc2)C1 ZINC000850351722 1021483853 /nfs/dbraw/zinc/48/38/53/1021483853.db2.gz RUPFYQZOCNBFGM-SFHVURJKSA-N 1 1 315.505 3.639 20 10 DHCDMO CC(C)(C)[N@H+]1CC[C@H](NCc2ccc(N3CCCCC3)cc2)C1 ZINC000850351722 1021483861 /nfs/dbraw/zinc/48/38/61/1021483861.db2.gz RUPFYQZOCNBFGM-SFHVURJKSA-N 1 1 315.505 3.639 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)N3C)c(O)c(C(C)(C)C)c1 ZINC000744438031 1021547249 /nfs/dbraw/zinc/54/72/49/1021547249.db2.gz OUTDAEVSJAQGCZ-SJORKVTESA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c(O)c(C(C)(C)C)c1 ZINC000744438031 1021547260 /nfs/dbraw/zinc/54/72/60/1021547260.db2.gz OUTDAEVSJAQGCZ-SJORKVTESA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c(O)c(C(C)(C)C)c1 ZINC000744438031 1021547267 /nfs/dbraw/zinc/54/72/67/1021547267.db2.gz OUTDAEVSJAQGCZ-SJORKVTESA-N 1 1 316.489 3.667 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(Cl)c(Cl)cc1O ZINC000850482612 1021557329 /nfs/dbraw/zinc/55/73/29/1021557329.db2.gz QCXPYNRKCOJFSP-BDAKNGLRSA-N 1 1 304.217 3.917 20 10 DHCDMO CC[C@@H]([NH2+]CCC1SCCS1)c1ccc(F)cc1O ZINC000850568717 1021610761 /nfs/dbraw/zinc/61/07/61/1021610761.db2.gz GVGIWXSTOISBLV-GFCCVEGCSA-N 1 1 301.452 3.768 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1cccc(C(F)(F)F)c1O ZINC000850571292 1021614051 /nfs/dbraw/zinc/61/40/51/1021614051.db2.gz PCQWQTZGVXQWSV-GHMZBOCLSA-N 1 1 317.351 3.877 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[NH+](CC2CC2)CC2CC2)c1O ZINC000070505932 1021718517 /nfs/dbraw/zinc/71/85/17/1021718517.db2.gz JHCJWDVQBOVYFX-UHFFFAOYSA-N 1 1 307.821 3.870 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1nccn1C ZINC000182909992 1021858312 /nfs/dbraw/zinc/85/83/12/1021858312.db2.gz RKYKOYZLXWPPPM-INIZCTEOSA-N 1 1 312.461 3.507 20 10 DHCDMO CCC[N@@H+](CCOc1ccccc1F)Cc1ccccc1O ZINC000750875785 1022131183 /nfs/dbraw/zinc/13/11/83/1022131183.db2.gz XZVWENNTONXKOT-UHFFFAOYSA-N 1 1 303.377 3.822 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1 ZINC000852598560 1022148435 /nfs/dbraw/zinc/14/84/35/1022148435.db2.gz XCEMFYYLCQKUHP-PKOBYXMFSA-N 1 1 302.462 3.534 20 10 DHCDMO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccc(F)cc1O ZINC000853242966 1022242926 /nfs/dbraw/zinc/24/29/26/1022242926.db2.gz URXUPNOFNZIQEC-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO CC[C@@H]1C[C@H](C[N@@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC000780754121 1022246104 /nfs/dbraw/zinc/24/61/04/1022246104.db2.gz MUCHSJNWVBJDKO-IEBWSBKVSA-N 1 1 304.478 3.780 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2cc(C)ccc2F)c1O ZINC000766633453 1022321407 /nfs/dbraw/zinc/32/14/07/1022321407.db2.gz UCCSFPKRWCDYEZ-UHFFFAOYSA-N 1 1 303.377 3.789 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](CC(=O)OC(C)C)C2)c1 ZINC000183804528 1022411546 /nfs/dbraw/zinc/41/15/46/1022411546.db2.gz XYJGKOQWNYUZEC-INIZCTEOSA-N 1 1 319.445 3.563 20 10 DHCDMO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c(O)c1C ZINC000854221915 1022433653 /nfs/dbraw/zinc/43/36/53/1022433653.db2.gz BXHWEVMEOOKUPK-PWIZWCRZSA-N 1 1 324.468 3.805 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)cc1OC ZINC000179682240 1022507279 /nfs/dbraw/zinc/50/72/79/1022507279.db2.gz GYIRHIXMMOMECL-AWEZNQCLSA-N 1 1 315.413 3.911 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000179788416 1022538589 /nfs/dbraw/zinc/53/85/89/1022538589.db2.gz LKDVUVQYBXNIQG-UHFFFAOYSA-N 1 1 320.776 3.894 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000179788416 1022538595 /nfs/dbraw/zinc/53/85/95/1022538595.db2.gz LKDVUVQYBXNIQG-UHFFFAOYSA-N 1 1 320.776 3.894 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000776770420 1022559448 /nfs/dbraw/zinc/55/94/48/1022559448.db2.gz APVRDSCIQRISSH-QGZVFWFLSA-N 1 1 303.446 3.609 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103479482 1022594155 /nfs/dbraw/zinc/59/41/55/1022594155.db2.gz VOVDSTBCMYBVOE-UHFFFAOYSA-N 1 1 318.348 3.852 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103479482 1022594163 /nfs/dbraw/zinc/59/41/63/1022594163.db2.gz VOVDSTBCMYBVOE-UHFFFAOYSA-N 1 1 318.348 3.852 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccccc2OC)c1 ZINC000180026714 1022610751 /nfs/dbraw/zinc/61/07/51/1022610751.db2.gz KONWCAXIVSAZAU-KRWDZBQOSA-N 1 1 313.397 3.747 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@H](c2ccc(F)cc2)O1 ZINC000180188849 1022657177 /nfs/dbraw/zinc/65/71/77/1022657177.db2.gz YSKHAFQZOZAHEK-KZULUSFZSA-N 1 1 319.351 3.632 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@H](c2ccc(F)cc2)O1 ZINC000180188849 1022657181 /nfs/dbraw/zinc/65/71/81/1022657181.db2.gz YSKHAFQZOZAHEK-KZULUSFZSA-N 1 1 319.351 3.632 20 10 DHCDMO O=C(C[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1O)c1ccccc1 ZINC000180201208 1022661448 /nfs/dbraw/zinc/66/14/48/1022661448.db2.gz KKKJOLLKUUDUIX-QGZVFWFLSA-N 1 1 313.372 3.769 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CCCCC1 ZINC000876523488 1033083058 /nfs/dbraw/zinc/08/30/58/1033083058.db2.gz YAOPQCZFFDZXGN-UHFFFAOYSA-N 1 1 316.489 3.802 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cscn1 ZINC000768091836 1022877699 /nfs/dbraw/zinc/87/76/99/1022877699.db2.gz AZXYBTRVKAZIOI-ZDUSSCGKSA-N 1 1 319.499 3.547 20 10 DHCDMO CC[N@@H+](Cc1cnc2cccc(C)n12)Cc1ccc(N(C)C)cc1 ZINC000768134928 1022901283 /nfs/dbraw/zinc/90/12/83/1022901283.db2.gz YABLQKKEOVXXMZ-UHFFFAOYSA-N 1 1 322.456 3.731 20 10 DHCDMO CC(C)N1CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768138158 1022904302 /nfs/dbraw/zinc/90/43/02/1022904302.db2.gz PJFXHQSHAGNNMU-UHFFFAOYSA-N 1 1 324.468 3.975 20 10 DHCDMO CC(C)[N@@H+]1CCCN(Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768138158 1022904313 /nfs/dbraw/zinc/90/43/13/1022904313.db2.gz PJFXHQSHAGNNMU-UHFFFAOYSA-N 1 1 324.468 3.975 20 10 DHCDMO CC(C)[N@H+]1CCCN(Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768138158 1022904324 /nfs/dbraw/zinc/90/43/24/1022904324.db2.gz PJFXHQSHAGNNMU-UHFFFAOYSA-N 1 1 324.468 3.975 20 10 DHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1cc(Br)ccc1O ZINC000768159931 1022906234 /nfs/dbraw/zinc/90/62/34/1022906234.db2.gz IUGJNRLZTSKKFY-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)Cc2ccc(OC)c(F)c2)c1 ZINC000768200399 1022912627 /nfs/dbraw/zinc/91/26/27/1022912627.db2.gz NLFICSXPHSGLGT-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCOc2ccc(C)cc2)c(O)c1 ZINC000768211861 1022916760 /nfs/dbraw/zinc/91/67/60/1022916760.db2.gz GGQGVIWSKLYCSO-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000768237303 1022924206 /nfs/dbraw/zinc/92/42/06/1022924206.db2.gz NUODUUJQAIIUNR-UHFFFAOYSA-N 1 1 305.422 3.815 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCOc2ccc(C)cc2)c1 ZINC000768213213 1022928185 /nfs/dbraw/zinc/92/81/85/1022928185.db2.gz ONRDZBHNQCNZOB-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cnn3ccccc23)C2CC2)cc1 ZINC000768257749 1022932042 /nfs/dbraw/zinc/93/20/42/1022932042.db2.gz PBPVLWIVIWQJNX-UHFFFAOYSA-N 1 1 320.440 3.565 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)CC1CCCCC1 ZINC000768237395 1022933608 /nfs/dbraw/zinc/93/36/08/1022933608.db2.gz 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DHCDMO C[C@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1c(O)cccc1F ZINC000886612150 1025735895 /nfs/dbraw/zinc/73/58/95/1025735895.db2.gz DGINZQIOTIMMMS-GTNSWQLSSA-N 1 1 321.417 3.732 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H]1OCCc2sccc21 ZINC000886613938 1025739773 /nfs/dbraw/zinc/73/97/73/1025739773.db2.gz ISZRCJNGUAALGW-RVPKQNPDSA-N 1 1 321.417 3.946 20 10 DHCDMO C[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1c(O)cccc1F ZINC000886621955 1025747372 /nfs/dbraw/zinc/74/73/72/1025747372.db2.gz HAILFLBBQIGUDV-WHXUTIOJSA-N 1 1 303.324 3.732 20 10 DHCDMO COc1ccc([C@H]([NH2+][C@H](C)c2c(O)cccc2F)C2CC2)cn1 ZINC000886644968 1025758517 /nfs/dbraw/zinc/75/85/17/1025758517.db2.gz OYLSYFJXMPBVOQ-ADLMAVQZSA-N 1 1 316.376 3.737 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000886774911 1025892289 /nfs/dbraw/zinc/89/22/89/1025892289.db2.gz XYWUYOVLNZDXSY-SUMWQHHRSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886776841 1025898147 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318.244 3.901 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)c1 ZINC000810258342 1026721156 /nfs/dbraw/zinc/72/11/56/1026721156.db2.gz MNSYCZIKOGMTBC-LLVKDONJSA-N 1 1 312.369 3.624 20 10 DHCDMO Oc1ccc(F)cc1CN1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000811508467 1027025708 /nfs/dbraw/zinc/02/57/08/1027025708.db2.gz RJIPWYDVCHNLPU-QGZVFWFLSA-N 1 1 312.388 3.516 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)[C@@H]1[C@@H]1CCCO1 ZINC000811510692 1027027222 /nfs/dbraw/zinc/02/72/22/1027027222.db2.gz MZJJXZZXTYKHIM-RBUKOAKNSA-N 1 1 311.425 3.935 20 10 DHCDMO CC[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C[C@@H](C)OC ZINC000812302901 1027249360 /nfs/dbraw/zinc/24/93/60/1027249360.db2.gz HQLCTBBZBHGJAZ-CYBMUJFWSA-N 1 1 317.429 3.874 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812854101 1027452081 /nfs/dbraw/zinc/45/20/81/1027452081.db2.gz VJUWEMPMEWVSBV-UZLBHIALSA-N 1 1 312.457 3.697 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCO[C@@H](C)C2)cc1 ZINC000778995556 1027735357 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CC[C@H](c1ccccc1O)[N@H+]1CCCN(c2nccs2)CC1 ZINC000368028634 1028284068 /nfs/dbraw/zinc/28/40/68/1028284068.db2.gz FEDOFBLEAYHTFX-OAHLLOKOSA-N 1 1 317.458 3.512 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1ccc(N(C)C)c(C)c1 ZINC000815010992 1028326097 /nfs/dbraw/zinc/32/60/97/1028326097.db2.gz WCPSRODVQBAEGP-UHFFFAOYSA-N 1 1 318.486 3.771 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)cc1 ZINC000815117453 1028366701 /nfs/dbraw/zinc/36/67/01/1028366701.db2.gz NITSSIQXFSECEP-APWZRJJASA-N 1 1 304.478 3.658 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)ccc1N(C)C ZINC000815102455 1028378643 /nfs/dbraw/zinc/37/86/43/1028378643.db2.gz IXWCLXVAUGWIET-UHFFFAOYSA-N 1 1 314.477 3.714 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)ccc1N(C)C ZINC000815102455 1028378661 /nfs/dbraw/zinc/37/86/61/1028378661.db2.gz IXWCLXVAUGWIET-UHFFFAOYSA-N 1 1 314.477 3.714 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)Cc1cc(CO)ccc1F ZINC000528488639 1028490563 /nfs/dbraw/zinc/49/05/63/1028490563.db2.gz 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FVOBYXBGMOSWBY-UHFFFAOYSA-N 1 1 307.393 3.540 20 10 DHCDMO Oc1c(CN2CCC([NH+]3CCCCC3)CC2)ccc2ccccc21 ZINC000816483758 1028893879 /nfs/dbraw/zinc/89/38/79/1028893879.db2.gz CYFOIDOLVWZCMK-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO COCC[N@@H+](Cc1ccco1)Cc1ccc2ccccc2c1O ZINC000816490464 1028894947 /nfs/dbraw/zinc/89/49/47/1028894947.db2.gz VIBJXVRMEFMRCA-UHFFFAOYSA-N 1 1 311.381 3.787 20 10 DHCDMO CC[C@]1(C)C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCO1 ZINC000190343878 1028904535 /nfs/dbraw/zinc/90/45/35/1028904535.db2.gz QFURPWHYBWGSLA-LJQANCHMSA-N 1 1 315.413 3.555 20 10 DHCDMO CN(C)c1cccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)c1 ZINC000816519777 1028905981 /nfs/dbraw/zinc/90/59/81/1028905981.db2.gz UZOFQEYXQASFAV-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)c1 ZINC000816519777 1028905994 /nfs/dbraw/zinc/90/59/94/1028905994.db2.gz UZOFQEYXQASFAV-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1ccc(F)cc1F ZINC000816549782 1028928676 /nfs/dbraw/zinc/92/86/76/1028928676.db2.gz YAVURHWJPXEUHK-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO COc1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816556728 1028941853 /nfs/dbraw/zinc/94/18/53/1028941853.db2.gz SMYQKVXYUKUYIC-HNNXBMFYSA-N 1 1 321.779 3.970 20 10 DHCDMO CCc1cnc(CC[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000816554554 1028942352 /nfs/dbraw/zinc/94/23/52/1028942352.db2.gz BOWIRZBIPYPKQY-UHFFFAOYSA-N 1 1 314.813 3.536 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCc2ccccc2OC1 ZINC000816601087 1028955331 /nfs/dbraw/zinc/95/53/31/1028955331.db2.gz QQAFHRNIKOVAHE-ZDUSSCGKSA-N 1 1 321.779 3.668 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@H](c3ccccn3)C2)ccc2ccccc21 ZINC000816599410 1028957665 /nfs/dbraw/zinc/95/76/65/1028957665.db2.gz LUZMWBZRPCFGJO-INIZCTEOSA-N 1 1 304.393 3.930 20 10 DHCDMO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609282 1028959321 /nfs/dbraw/zinc/95/93/21/1028959321.db2.gz WOYHXTDNBSGJMR-WCQYABFASA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609282 1028959330 /nfs/dbraw/zinc/95/93/30/1028959330.db2.gz WOYHXTDNBSGJMR-WCQYABFASA-N 1 1 315.816 3.700 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000817412195 1029152644 /nfs/dbraw/zinc/15/26/44/1029152644.db2.gz GFZFGCPLQNAVOM-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO C[C@@H]1CC[C@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000190859602 1029184892 /nfs/dbraw/zinc/18/48/92/1029184892.db2.gz LURLKFMQEXLPTQ-RHSMWYFYSA-N 1 1 301.386 3.555 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000817585553 1029213091 /nfs/dbraw/zinc/21/30/91/1029213091.db2.gz GOLUKRXWOSTPBU-XZNOPERXSA-N 1 1 306.425 3.542 20 10 DHCDMO CCc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938620 1029281276 /nfs/dbraw/zinc/28/12/76/1029281276.db2.gz OMGHHVTXLJIEOJ-GUYCJALGSA-N 1 1 317.502 3.727 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1Cl ZINC000817939018 1029283171 /nfs/dbraw/zinc/28/31/71/1029283171.db2.gz XPOYKPQSCXNHRE-SCLBCKFNSA-N 1 1 317.864 3.757 20 10 DHCDMO CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817947132 1029290074 /nfs/dbraw/zinc/29/00/74/1029290074.db2.gz KYGKUQJTCGXUNS-ORHYLEIMSA-N 1 1 316.367 3.722 20 10 DHCDMO CCCC[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963931 1029300030 /nfs/dbraw/zinc/30/00/30/1029300030.db2.gz YRMBQDGTGRKKHN-NXEZZACHSA-N 1 1 305.249 3.867 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)CC2CC(O)C2)cc1 ZINC000191155562 1029304364 /nfs/dbraw/zinc/30/43/64/1029304364.db2.gz MZMXWCOXWIIGDP-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1[O-] ZINC000817969223 1029308964 /nfs/dbraw/zinc/30/89/64/1029308964.db2.gz SEHKJIKAFNGZIO-QGZVFWFLSA-N 1 1 316.832 3.890 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[NH2+]CC[C@H]1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969041 1029309777 /nfs/dbraw/zinc/30/97/77/1029309777.db2.gz QHHWXTFLGUGIIW-ICCXJUOJSA-N 1 1 317.260 3.738 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977035 1029317910 /nfs/dbraw/zinc/31/79/10/1029317910.db2.gz ZQLMTHKNYCCYDW-BXUZGUMPSA-N 1 1 318.383 3.969 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(F)cc1O ZINC000817977125 1029318176 /nfs/dbraw/zinc/31/81/76/1029318176.db2.gz CAEVJYAQJZNVSP-LBPRGKRZSA-N 1 1 300.377 3.740 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc2ccccc2c1[O-] ZINC000817985267 1029323386 /nfs/dbraw/zinc/32/33/86/1029323386.db2.gz ITHFUHNJQNGXLY-GOEBONIOSA-N 1 1 310.441 3.871 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc2ccccc2c1[O-] ZINC000817985266 1029324253 /nfs/dbraw/zinc/32/42/53/1029324253.db2.gz ITHFUHNJQNGXLY-GDBMZVCRSA-N 1 1 310.441 3.871 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c1 ZINC000819902606 1029622310 /nfs/dbraw/zinc/62/23/10/1029622310.db2.gz GIHBSJOVZLABQB-IBGZPJMESA-N 1 1 315.457 3.790 20 10 DHCDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc(F)c(N(C)C)cc2F)s1 ZINC000865702786 1029981548 /nfs/dbraw/zinc/98/15/48/1029981548.db2.gz RCHDZJQTHHPYIO-SECBINFHSA-N 1 1 311.401 3.647 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)c1 ZINC000865755386 1030003129 /nfs/dbraw/zinc/00/31/29/1030003129.db2.gz XMPGQJBPCFXHSE-PSASIEDQSA-N 1 1 324.140 3.504 20 10 DHCDMO CO[C@@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000822570102 1030063396 /nfs/dbraw/zinc/06/33/96/1030063396.db2.gz GOXBKGXTAWPFJN-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccncc1F ZINC000823404662 1030280396 /nfs/dbraw/zinc/28/03/96/1030280396.db2.gz UBQZKNVAZOXJHY-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2csc(C)c2C)c1 ZINC000866428795 1030294296 /nfs/dbraw/zinc/29/42/96/1030294296.db2.gz GLKPGHZMLADHHX-LLVKDONJSA-N 1 1 319.426 3.708 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccc(F)cc1O ZINC000866529468 1030347589 /nfs/dbraw/zinc/34/75/89/1030347589.db2.gz GMJDJXSZNPRPKX-CZUORRHYSA-N 1 1 307.409 3.779 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000866596480 1030391309 /nfs/dbraw/zinc/39/13/09/1030391309.db2.gz MQIHVEBRYFAMDY-MEDUHNTESA-N 1 1 307.340 3.901 20 10 DHCDMO CC[C@H](C[C@@H](C)O)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000866632629 1030413846 /nfs/dbraw/zinc/41/38/46/1030413846.db2.gz AHRFTXSMBWTPNB-GMTAPVOTSA-N 1 1 305.340 3.611 20 10 DHCDMO COC[C@@H]1CC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000824433766 1030551871 /nfs/dbraw/zinc/55/18/71/1030551871.db2.gz NPGOYZZFSHGZRC-KRWDZBQOSA-N 1 1 316.470 3.605 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2c(C3CC3)cnn2C)C2CC2)cc1 ZINC000824556335 1030582324 /nfs/dbraw/zinc/58/23/24/1030582324.db2.gz PRSCRUSQZCCLLD-UHFFFAOYSA-N 1 1 324.472 3.528 20 10 DHCDMO CCCn1nccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000824567730 1030582638 /nfs/dbraw/zinc/58/26/38/1030582638.db2.gz VDTNFIYRIODDHI-UHFFFAOYSA-N 1 1 314.477 3.770 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1(C)C ZINC000824820214 1030647193 /nfs/dbraw/zinc/64/71/93/1030647193.db2.gz BOAQQXITCNQUDV-IBGZPJMESA-N 1 1 316.489 3.924 20 10 DHCDMO [O-]c1c(Br)cccc1C[N@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000824941755 1030676896 /nfs/dbraw/zinc/67/68/96/1030676896.db2.gz QLTDLKKPQKNMQP-DZGCQCFKSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000824941755 1030676900 /nfs/dbraw/zinc/67/69/00/1030676900.db2.gz QLTDLKKPQKNMQP-DZGCQCFKSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000824941755 1030676908 /nfs/dbraw/zinc/67/69/08/1030676908.db2.gz QLTDLKKPQKNMQP-DZGCQCFKSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1CCC(OC(F)F)CC1 ZINC000825144785 1030734397 /nfs/dbraw/zinc/73/43/97/1030734397.db2.gz QYOIZWCPBVGDNR-UHFFFAOYSA-N 1 1 323.742 3.825 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000248533480 1030736893 /nfs/dbraw/zinc/73/68/93/1030736893.db2.gz ZEQJXJZMLBHJRW-MQIPJXDCSA-N 1 1 301.361 3.747 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)cc1OC ZINC000825299390 1030766415 /nfs/dbraw/zinc/76/64/15/1030766415.db2.gz JSHMVMOJOQFRFP-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C(C)C)C2CC(C)(C)C2)cc1OC ZINC000825332339 1030778535 /nfs/dbraw/zinc/77/85/35/1030778535.db2.gz VWSXGGMLAFIZMA-UHFFFAOYSA-N 1 1 307.434 3.808 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000825421549 1030806465 /nfs/dbraw/zinc/80/64/65/1030806465.db2.gz CNSPXMZKCMKBIE-UHFFFAOYSA-N 1 1 318.848 3.705 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926915208 1030987071 /nfs/dbraw/zinc/98/70/71/1030987071.db2.gz KGWYDGSZBDONMW-CHIMOYNISA-N 1 1 321.314 3.682 20 10 DHCDMO C[C@@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1cc(F)ccc1[O-] ZINC000927035663 1031042896 /nfs/dbraw/zinc/04/28/96/1031042896.db2.gz BZQPNAXDILMUBV-MJJDPTRDSA-N 1 1 306.425 3.589 20 10 DHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1cccc(F)c1 ZINC000123524828 1031167713 /nfs/dbraw/zinc/16/77/13/1031167713.db2.gz QATKTEILLGZRMT-UHFFFAOYSA-N 1 1 311.360 3.621 20 10 DHCDMO CCc1cc(C[N@H+]2CCc3cccc(O)c3C2)cc(CC)c1O ZINC001144150327 1031286326 /nfs/dbraw/zinc/28/63/26/1031286326.db2.gz HBWFRSKJSRPBAU-UHFFFAOYSA-N 1 1 311.425 3.781 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000844761057 1031317631 /nfs/dbraw/zinc/31/76/31/1031317631.db2.gz VFRONRGSDLYNII-INIZCTEOSA-N 1 1 311.372 3.626 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)[C@@H](C)CO1 ZINC000844732728 1031323171 /nfs/dbraw/zinc/32/31/71/1031323171.db2.gz RILFYYCZEFEQPC-DZGCQCFKSA-N 1 1 315.413 3.553 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)[C@@H](C)CO1 ZINC000844732731 1031323284 /nfs/dbraw/zinc/32/32/84/1031323284.db2.gz RILFYYCZEFEQPC-ZFWWWQNUSA-N 1 1 315.413 3.553 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NCc2ccc(C[NH3+])cc2F)cc1 ZINC000844924826 1031402077 /nfs/dbraw/zinc/40/20/77/1031402077.db2.gz RBXPMZWHMLQLRS-AWEZNQCLSA-N 1 1 315.436 3.591 20 10 DHCDMO CC[C@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306505 1031456713 /nfs/dbraw/zinc/45/67/13/1031456713.db2.gz DVWDAXPDJDRJMV-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO CC[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306505 1031456721 /nfs/dbraw/zinc/45/67/21/1031456721.db2.gz DVWDAXPDJDRJMV-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306868 1031454905 /nfs/dbraw/zinc/45/49/05/1031454905.db2.gz UYMWXVJTCHNBLY-NXEZZACHSA-N 1 1 316.214 3.772 20 10 DHCDMO Cc1nc(C)c(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)[nH]1 ZINC000929185475 1031460072 /nfs/dbraw/zinc/46/00/72/1031460072.db2.gz SKHIYSKTBUMCKM-UHFFFAOYSA-N 1 1 312.461 3.649 20 10 DHCDMO C[N@@H+](Cc1c[nH]c2nc(Cl)ccc12)Cc1ccccc1O ZINC001144416845 1031557759 /nfs/dbraw/zinc/55/77/59/1031557759.db2.gz UKDYUKONAKWRER-UHFFFAOYSA-N 1 1 301.777 3.554 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1O ZINC000124080991 1031608560 /nfs/dbraw/zinc/60/85/60/1031608560.db2.gz CGZLZAVEQWCSIO-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144514557 1031673214 /nfs/dbraw/zinc/67/32/14/1031673214.db2.gz KLHLRUPQXBPLTO-SNVBAGLBSA-N 1 1 307.777 3.650 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccnc2C(F)(F)F)cc1 ZINC001144538905 1031685736 /nfs/dbraw/zinc/68/57/36/1031685736.db2.gz VNECYZIRHXOBAG-UHFFFAOYSA-N 1 1 323.362 3.798 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2nnc3ccccn32)cc1C ZINC000873009609 1031691182 /nfs/dbraw/zinc/69/11/82/1031691182.db2.gz PHQIBJDQFQBQEA-OAHLLOKOSA-N 1 1 324.428 3.677 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293957528 1031720719 /nfs/dbraw/zinc/72/07/19/1031720719.db2.gz PPRANMTYQSCCQQ-CQSZACIVSA-N 1 1 323.799 3.862 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293957528 1031720730 /nfs/dbraw/zinc/72/07/30/1031720730.db2.gz PPRANMTYQSCCQQ-CQSZACIVSA-N 1 1 323.799 3.862 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2nccc(OC)c2F)cc1C ZINC000873137410 1031722808 /nfs/dbraw/zinc/72/28/08/1031722808.db2.gz APSCSWWOSVNCNZ-UHFFFAOYSA-N 1 1 318.392 3.616 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc2ccccc2c1[O-] ZINC000873264408 1031779906 /nfs/dbraw/zinc/77/99/06/1031779906.db2.gz OXRUTAZXDTXNHW-TXCZRRACSA-N 1 1 310.441 3.727 20 10 DHCDMO C[N@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000561314791 1031819799 /nfs/dbraw/zinc/81/97/99/1031819799.db2.gz KHOXMEGGSRKDTC-TWGQIWQCSA-N 1 1 323.396 3.560 20 10 DHCDMO C[C@@H](C[NH+]1CCCCC1)NCc1ccc(N2CCCCC2)cc1 ZINC000237498262 1033367820 /nfs/dbraw/zinc/36/78/20/1033367820.db2.gz YMBDBJWLORLMNQ-SFHVURJKSA-N 1 1 315.505 3.641 20 10 DHCDMO C[C@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccc1O ZINC000877758188 1033434445 /nfs/dbraw/zinc/43/44/45/1033434445.db2.gz LXOOJQRGYWMSTJ-QMMMGPOBSA-N 1 1 302.321 3.718 20 10 DHCDMO CO[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001172921097 1033470200 /nfs/dbraw/zinc/47/02/00/1033470200.db2.gz XXAQKEGRYXMFMY-QWHCGFSZSA-N 1 1 320.820 3.641 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@H](C(F)(F)F)O1 ZINC000877824113 1033472236 /nfs/dbraw/zinc/47/22/36/1033472236.db2.gz OVVLNYMMSORTJT-NOZJJQNGSA-N 1 1 323.742 3.587 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCc2ncsc2C1 ZINC001173140558 1033567384 /nfs/dbraw/zinc/56/73/84/1033567384.db2.gz HWYGNTCNPWKPGB-MRXNPFEDSA-N 1 1 315.486 3.589 20 10 DHCDMO C[C@]1(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCCS1 ZINC000862212090 1033778896 /nfs/dbraw/zinc/77/88/96/1033778896.db2.gz GMNYWQMXVDUDSV-FUHWJXTLSA-N 1 1 321.486 3.659 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1 ZINC000862473094 1033863245 /nfs/dbraw/zinc/86/32/45/1033863245.db2.gz DWDFROBROKQPFC-ZGQVYYGYSA-N 1 1 302.487 3.736 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000862485203 1033864868 /nfs/dbraw/zinc/86/48/68/1033864868.db2.gz JUKQXAILHZGHDD-GDBMZVCRSA-N 1 1 319.445 3.500 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCO[C@H](CCF)C1 ZINC000862530493 1033876270 /nfs/dbraw/zinc/87/62/70/1033876270.db2.gz NPXSJGBZQZROMA-GOSISDBHSA-N 1 1 315.388 3.620 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)cc1F ZINC000862541691 1033883516 /nfs/dbraw/zinc/88/35/16/1033883516.db2.gz TVFYJLSGEBNGFF-OAHLLOKOSA-N 1 1 315.388 3.838 20 10 DHCDMO C/C=C/C[C@@H]1CCC[N@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000862550475 1033886182 /nfs/dbraw/zinc/88/61/82/1033886182.db2.gz LVNMLDIQNDMNSQ-ISZGNANSSA-N 1 1 305.418 3.588 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1nccn1C)Cc1ccccc1O ZINC000176686248 1034101469 /nfs/dbraw/zinc/10/14/69/1034101469.db2.gz QTJOJSSYPBCAHV-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1nccn1C)Cc1ccccc1O ZINC000176686248 1034101480 /nfs/dbraw/zinc/10/14/80/1034101480.db2.gz QTJOJSSYPBCAHV-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1nccn1C)Cc1ccccc1O ZINC000176686265 1034103025 /nfs/dbraw/zinc/10/30/25/1034103025.db2.gz QTJOJSSYPBCAHV-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1nccn1C)Cc1ccccc1O ZINC000176686265 1034103034 /nfs/dbraw/zinc/10/30/34/1034103034.db2.gz QTJOJSSYPBCAHV-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000177280772 1034148921 /nfs/dbraw/zinc/14/89/21/1034148921.db2.gz NAEDIYGXLWOECV-NSHDSACASA-N 1 1 317.360 3.633 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000177280772 1034148931 /nfs/dbraw/zinc/14/89/31/1034148931.db2.gz NAEDIYGXLWOECV-NSHDSACASA-N 1 1 317.360 3.633 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccccc2)cc1OC ZINC000179433689 1034309849 /nfs/dbraw/zinc/30/98/49/1034309849.db2.gz SINLIJZXPYDZMX-CYBMUJFWSA-N 1 1 301.386 3.602 20 10 DHCDMO COc1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC000128380561 1034310025 /nfs/dbraw/zinc/31/00/25/1034310025.db2.gz XOCNEBJQJZVTDJ-MRXNPFEDSA-N 1 1 315.438 3.691 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3cccs3)C1)CCC2 ZINC000128443961 1034343342 /nfs/dbraw/zinc/34/33/42/1034343342.db2.gz OFSWPVOAXVPUBI-KRWDZBQOSA-N 1 1 315.438 3.516 20 10 DHCDMO CC[C@@H]([NH2+]CCCN1CCC(C)CC1)c1ccc(C)cc1O ZINC000794794108 1034475567 /nfs/dbraw/zinc/47/55/67/1034475567.db2.gz PTNLFJJNLAMOAQ-GOSISDBHSA-N 1 1 304.478 3.863 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cn1 ZINC000185085195 1034528493 /nfs/dbraw/zinc/52/84/93/1034528493.db2.gz ZRPJBRUOTDOCSW-ZDUSSCGKSA-N 1 1 317.408 3.623 20 10 DHCDMO C[C@@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185838307 1034576811 /nfs/dbraw/zinc/57/68/11/1034576811.db2.gz DQDTVXJGAMOLOS-PRXAMGSTSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@@H](C[C@@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185833591 1034578065 /nfs/dbraw/zinc/57/80/65/1034578065.db2.gz OWDWDEHYZVCBIE-GDZNZVCISA-N 1 1 303.377 3.694 20 10 DHCDMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)n[nH]1 ZINC000186131094 1034602197 /nfs/dbraw/zinc/60/21/97/1034602197.db2.gz WNNJUJFPCCLOJP-TZMCWYRMSA-N 1 1 309.413 3.859 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518955 1034639505 /nfs/dbraw/zinc/63/95/05/1034639505.db2.gz FPQLFRJDJAAAKD-QLFBSQMISA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186518955 1034639508 /nfs/dbraw/zinc/63/95/08/1034639508.db2.gz FPQLFRJDJAAAKD-QLFBSQMISA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccccc1O ZINC000186829403 1034664552 /nfs/dbraw/zinc/66/45/52/1034664552.db2.gz UIDYQAFHMKGMMS-LBPRGKRZSA-N 1 1 304.390 3.546 20 10 DHCDMO C[C@@H]([NH2+]CCCn1cccn1)c1cc(Cl)c(Cl)cc1O ZINC000192640399 1034813017 /nfs/dbraw/zinc/81/30/17/1034813017.db2.gz DVVNHQOHAANHGL-SNVBAGLBSA-N 1 1 314.216 3.636 20 10 DHCDMO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C[C@H](C)O ZINC000192888608 1034820712 /nfs/dbraw/zinc/82/07/12/1034820712.db2.gz KGUOGFBVTCROHF-UTLUCORTSA-N 1 1 306.233 3.757 20 10 DHCDMO Cc1c(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)cnn1C ZINC000193053212 1034828448 /nfs/dbraw/zinc/82/84/48/1034828448.db2.gz QLNGYGOWGXXIGE-MRVPVSSYSA-N 1 1 314.216 3.592 20 10 DHCDMO COc1ccc(N(c2ccc(N)cc2)C2=CCC[N@@H+](C)C2)cc1 ZINC001175580218 1035050276 /nfs/dbraw/zinc/05/02/76/1035050276.db2.gz LBNBZRFBIURIQD-UHFFFAOYSA-N 1 1 309.413 3.635 20 10 DHCDMO Cc1cc(C[N@H+]2CCCSC[C@@H]2C2CC2)ccc1N(C)C ZINC001176650829 1035315164 /nfs/dbraw/zinc/31/51/64/1035315164.db2.gz WVNATIXHUMGFGD-GOSISDBHSA-N 1 1 304.503 3.779 20 10 DHCDMO Cc1cc(O)c(CNC[C@@]2([NH+](C)C)CCC[C@H](C)C2)c(Cl)c1 ZINC001177441436 1035372176 /nfs/dbraw/zinc/37/21/76/1035372176.db2.gz ATUXQOSQDJXROU-SCLBCKFNSA-N 1 1 324.896 3.954 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc(OCC(F)F)cc3)ccc21 ZINC001178037716 1035407695 /nfs/dbraw/zinc/40/76/95/1035407695.db2.gz YACCWOKWPHRRNR-UHFFFAOYSA-N 1 1 317.339 3.829 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CCOC)Cc2ccc(C)o2)cc1 ZINC000773767118 1035443993 /nfs/dbraw/zinc/44/39/93/1035443993.db2.gz WXYMMWBGTQVFMJ-UHFFFAOYSA-N 1 1 316.445 3.693 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCc3ccccc3[C@@H]2CO)c1 ZINC001179958012 1035557439 /nfs/dbraw/zinc/55/74/39/1035557439.db2.gz VIFAOEJRSHHGNX-IBGZPJMESA-N 1 1 311.425 3.607 20 10 DHCDMO CO[C@]1(C)C[C@H]([N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)C1(C)C ZINC001179958187 1035559415 /nfs/dbraw/zinc/55/94/15/1035559415.db2.gz WRPUVZPIROPCEN-LAYSSIRVSA-N 1 1 316.489 3.901 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cc1C ZINC000905678869 1035612354 /nfs/dbraw/zinc/61/23/54/1035612354.db2.gz SMPBHVHMLVGTFO-AWEZNQCLSA-N 1 1 317.326 3.875 20 10 DHCDMO COc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)s1 ZINC001180292478 1035646395 /nfs/dbraw/zinc/64/63/95/1035646395.db2.gz LYTWGEZHERPUAT-UHFFFAOYSA-N 1 1 318.442 3.802 20 10 DHCDMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001180359946 1035653235 /nfs/dbraw/zinc/65/32/35/1035653235.db2.gz ZFCFBQARCLSLGW-MJGOQNOKSA-N 1 1 316.489 3.781 20 10 DHCDMO Cc1ccc([C@H]2CC[N@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001180820877 1035765751 /nfs/dbraw/zinc/76/57/51/1035765751.db2.gz SVMKDGMCLRXUDM-AWEZNQCLSA-N 1 1 303.352 3.968 20 10 DHCDMO Cc1ccc([C@H]2CC[N@@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001180820877 1035765761 /nfs/dbraw/zinc/76/57/61/1035765761.db2.gz SVMKDGMCLRXUDM-AWEZNQCLSA-N 1 1 303.352 3.968 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCc3c(C)cc(C)cc3C2)c(O)c1 ZINC001180977359 1035804420 /nfs/dbraw/zinc/80/44/20/1035804420.db2.gz NRWKPKLSZWLBIG-UHFFFAOYSA-N 1 1 311.425 3.884 20 10 DHCDMO C[N@H+]1CCN(Cc2c(O)ccc(Cl)c2F)c2ccccc2C1 ZINC000816617991 1035825233 /nfs/dbraw/zinc/82/52/33/1035825233.db2.gz MZTWNHUVQRORAM-UHFFFAOYSA-N 1 1 320.795 3.637 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C[C@H](C)OC ZINC001194551388 1035959145 /nfs/dbraw/zinc/95/91/45/1035959145.db2.gz GSXLIYNYZGGMOU-KRWDZBQOSA-N 1 1 304.478 3.842 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH+]1CC(c2ccc(Cl)cc2)C1 ZINC001181826935 1036006976 /nfs/dbraw/zinc/00/69/76/1036006976.db2.gz IFWJAVVQNYZQJK-UHFFFAOYSA-N 1 1 309.743 3.923 20 10 DHCDMO C[C@@H]([NH2+]CCN1CCCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774113030 1036171286 /nfs/dbraw/zinc/17/12/86/1036171286.db2.gz ADTNISZIHZDMMW-LLVKDONJSA-N 1 1 317.260 3.836 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](CCO)c2ccccc2)cc1Cl ZINC001204335062 1036217520 /nfs/dbraw/zinc/21/75/20/1036217520.db2.gz OLACSFNRJAWYOB-QGZVFWFLSA-N 1 1 319.832 3.910 20 10 DHCDMO CC(C)[C@H](CCO)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774210899 1036229793 /nfs/dbraw/zinc/22/97/93/1036229793.db2.gz HRZSLRCFDBPGRF-RNCFNFMXSA-N 1 1 306.233 3.757 20 10 DHCDMO COc1ccc(O)c(C[N@@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1 ZINC000775654171 1036243952 /nfs/dbraw/zinc/24/39/52/1036243952.db2.gz HVZAUUIIEAPALP-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1 ZINC000775654171 1036243967 /nfs/dbraw/zinc/24/39/67/1036243967.db2.gz HVZAUUIIEAPALP-UHFFFAOYSA-N 1 1 322.408 3.749 20 10 DHCDMO COCC[N@@H+](Cc1cc(OC)ccc1O)[C@H](C)c1ccccc1 ZINC000775657213 1036255775 /nfs/dbraw/zinc/25/57/75/1036255775.db2.gz YKPVOGMOIKXXBH-OAHLLOKOSA-N 1 1 315.413 3.610 20 10 DHCDMO Cc1cc([C@H]2CCCN2Cc2cc(Cl)cc(F)c2[O-])on1 ZINC000775655516 1036257232 /nfs/dbraw/zinc/25/72/32/1036257232.db2.gz GELQLBYCZUHXRQ-CYBMUJFWSA-N 1 1 310.756 3.818 20 10 DHCDMO CC[C@@H](O)CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774252231 1036257922 /nfs/dbraw/zinc/25/79/22/1036257922.db2.gz KIECACFFUXDIBV-NXEZZACHSA-N 1 1 306.233 3.901 20 10 DHCDMO COCC[N@@H+](CCCc1ccccc1)Cc1cccc(C)c1O ZINC000775664950 1036283378 /nfs/dbraw/zinc/28/33/78/1036283378.db2.gz SRSAXORXCLEVFC-UHFFFAOYSA-N 1 1 313.441 3.782 20 10 DHCDMO C[C@H]([NH2+]CCC1CC(O)C1)c1cc(Cl)c(Cl)cc1O ZINC000774382859 1036310568 /nfs/dbraw/zinc/31/05/68/1036310568.db2.gz VNQDCJMTYOSGEP-IDKOKCKLSA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1O ZINC000775669104 1036318576 /nfs/dbraw/zinc/31/85/76/1036318576.db2.gz FIIGROWJQVICEZ-QUCCMNQESA-N 1 1 311.425 3.789 20 10 DHCDMO CCOC(=O)CC[N@@H+](Cc1cc(Cl)c(C)cc1O)C(C)C ZINC001182625269 1036403133 /nfs/dbraw/zinc/40/31/33/1036403133.db2.gz NJSPMRWKIASYIT-UHFFFAOYSA-N 1 1 313.825 3.518 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3c(Cl)cccc3C2)c1 ZINC000775690638 1036469813 /nfs/dbraw/zinc/46/98/13/1036469813.db2.gz WNFKHCVYLUPTHJ-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(Cl)c1[O-])C2 ZINC000775698212 1036472402 /nfs/dbraw/zinc/47/24/02/1036472402.db2.gz LYXAGAQNZWOQMM-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CCN(Cc1cccc(Cl)c1[O-])C2 ZINC000775698212 1036472412 /nfs/dbraw/zinc/47/24/12/1036472412.db2.gz LYXAGAQNZWOQMM-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c1 ZINC000775701493 1036473933 /nfs/dbraw/zinc/47/39/33/1036473933.db2.gz YYMFRDFBHNZQQQ-LBPRGKRZSA-N 1 1 301.361 3.659 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccccc2)[C@@H](CO)C(C)C)c1O ZINC000775707527 1036502128 /nfs/dbraw/zinc/50/21/28/1036502128.db2.gz VUAZHQVACHSQLG-IBGZPJMESA-N 1 1 313.441 3.720 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000775713738 1036524834 /nfs/dbraw/zinc/52/48/34/1036524834.db2.gz MBZLWCMWSHCZSV-VQIMIIECSA-N 1 1 311.425 3.971 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@H]2C)c1 ZINC000775724574 1036565143 /nfs/dbraw/zinc/56/51/43/1036565143.db2.gz MBWNZPSZVFSXEB-WBVHZDCISA-N 1 1 311.425 3.854 20 10 DHCDMO [O-]c1ccc2ccccc2c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000153457213 1036601994 /nfs/dbraw/zinc/60/19/94/1036601994.db2.gz GCUNUSFFCDOXTK-SFHVURJKSA-N 1 1 324.468 3.996 20 10 DHCDMO [O-]c1ccc2ccccc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000153457213 1036602015 /nfs/dbraw/zinc/60/20/15/1036602015.db2.gz GCUNUSFFCDOXTK-SFHVURJKSA-N 1 1 324.468 3.996 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@H](O)c1ccccc1 ZINC001183698731 1036649347 /nfs/dbraw/zinc/64/93/47/1036649347.db2.gz ZBZANWRIUTXYBP-WBVHZDCISA-N 1 1 323.795 3.787 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@H]3[C@H]4CC[C@H](C4)[C@@]3(C)C2)c1O ZINC001184054036 1036733312 /nfs/dbraw/zinc/73/33/12/1036733312.db2.gz DSWLAUVQSXFQKS-NQUFMGSDSA-N 1 1 301.430 3.577 20 10 DHCDMO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1ccc(N(C)C)cc1 ZINC000775832330 1036981425 /nfs/dbraw/zinc/98/14/25/1036981425.db2.gz YYMNYSVIOWSLAH-CQSZACIVSA-N 1 1 322.412 3.653 20 10 DHCDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000775834723 1036992979 /nfs/dbraw/zinc/99/29/79/1036992979.db2.gz PNYOWHQLEHEPKR-LBPRGKRZSA-N 1 1 317.364 3.651 20 10 DHCDMO C[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1O ZINC000841755326 1037033352 /nfs/dbraw/zinc/03/33/52/1037033352.db2.gz JGKXJGIQBJQHJJ-MRVPVSSYSA-N 1 1 309.822 3.625 20 10 DHCDMO CCCCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C ZINC000774834581 1037035181 /nfs/dbraw/zinc/03/51/81/1037035181.db2.gz XDURVZRCHWKRNI-UHFFFAOYSA-N 1 1 310.394 3.710 20 10 DHCDMO CCCCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C ZINC000774834581 1037035205 /nfs/dbraw/zinc/03/52/05/1037035205.db2.gz XDURVZRCHWKRNI-UHFFFAOYSA-N 1 1 310.394 3.710 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](Cc3nccs3)C2)cc1 ZINC001198572360 1037063818 /nfs/dbraw/zinc/06/38/18/1037063818.db2.gz FTPYVFALBHFELD-MRXNPFEDSA-N 1 1 315.486 3.664 20 10 DHCDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001168499725 1037199440 /nfs/dbraw/zinc/19/94/40/1037199440.db2.gz FATFEDRIKCOHTE-HNNXBMFYSA-N 1 1 300.421 3.955 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H]2CCC(C)C)ccc1[N+](=O)[O-] ZINC000774910648 1037203255 /nfs/dbraw/zinc/20/32/55/1037203255.db2.gz UCVAREZRPUXDCX-AWEZNQCLSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2CCC(C)C)ccc1[N+](=O)[O-] ZINC000774910648 1037203268 /nfs/dbraw/zinc/20/32/68/1037203268.db2.gz UCVAREZRPUXDCX-AWEZNQCLSA-N 1 1 322.405 3.710 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](Oc3ccc(F)cc3)C2)cc1 ZINC001203934146 1037250652 /nfs/dbraw/zinc/25/06/52/1037250652.db2.gz OEBCEEIEIXRRFR-LJQANCHMSA-N 1 1 314.404 3.545 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1ccn(C)n1)Cc1ccccc1O ZINC000776004378 1037298391 /nfs/dbraw/zinc/29/83/91/1037298391.db2.gz OJKOWMAFDPZRDP-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1ccn(C)n1)Cc1ccccc1O ZINC000776004378 1037298420 /nfs/dbraw/zinc/29/84/20/1037298420.db2.gz OJKOWMAFDPZRDP-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c1 ZINC000164275059 1038111708 /nfs/dbraw/zinc/11/17/08/1038111708.db2.gz OEQPGXFIFHVNNF-GOSISDBHSA-N 1 1 315.388 3.722 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cc1 ZINC001191130956 1038454626 /nfs/dbraw/zinc/45/46/26/1038454626.db2.gz BOZKINGHBXQQAI-UHFFFAOYSA-N 1 1 300.833 3.964 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccc2c1CCOC2 ZINC001191277245 1038478203 /nfs/dbraw/zinc/47/82/03/1038478203.db2.gz JONRFGREJIOSJO-UHFFFAOYSA-N 1 1 311.425 3.877 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2csc(N(C)C)n2)cc1 ZINC000157046007 1038489200 /nfs/dbraw/zinc/48/92/00/1038489200.db2.gz BQDGVSCSHJXZSM-ZDUSSCGKSA-N 1 1 318.490 3.516 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Cl)ccc1[O-] ZINC000775512595 1038604835 /nfs/dbraw/zinc/60/48/35/1038604835.db2.gz RMTDIIMXIVZWAM-FMKPAKJESA-N 1 1 310.869 3.959 20 10 DHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000157974887 1039746982 /nfs/dbraw/zinc/74/69/82/1039746982.db2.gz CGWMXYLPMZXBCG-ZDUSSCGKSA-N 1 1 315.866 3.822 20 10 DHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000157974887 1039746950 /nfs/dbraw/zinc/74/69/50/1039746950.db2.gz CGWMXYLPMZXBCG-ZDUSSCGKSA-N 1 1 315.866 3.822 20 10 DHCDMO CC[C@@H](CSC)[N@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000157974887 1039746963 /nfs/dbraw/zinc/74/69/63/1039746963.db2.gz CGWMXYLPMZXBCG-ZDUSSCGKSA-N 1 1 315.866 3.822 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cn1cc[nH]c1=S ZINC000173296491 1040208878 /nfs/dbraw/zinc/20/88/78/1040208878.db2.gz PHUQHHBLKSKAFG-UHFFFAOYSA-N 1 1 316.474 3.625 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cn1cc[nH]c1=S ZINC000173296491 1040208898 /nfs/dbraw/zinc/20/88/98/1040208898.db2.gz PHUQHHBLKSKAFG-UHFFFAOYSA-N 1 1 316.474 3.625 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C ZINC000761225744 1040808463 /nfs/dbraw/zinc/80/84/63/1040808463.db2.gz LJSDGWCQCSOKHP-HNNXBMFYSA-N 1 1 320.452 3.530 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCOCC3(CCC3)C2)cc1 ZINC000761226416 1040824660 /nfs/dbraw/zinc/82/46/60/1040824660.db2.gz PXXQOZUEEPACAC-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](COC)c2ccco2)cc1 ZINC000080239822 192016073 /nfs/dbraw/zinc/01/60/73/192016073.db2.gz SZARQNQGBVQVHV-KRWDZBQOSA-N 1 1 302.418 3.603 20 10 DHCDMO C[N@@H+](Cc1ccc(OC(F)F)c(F)c1)Cc1ccccc1O ZINC000091956523 193132595 /nfs/dbraw/zinc/13/25/95/193132595.db2.gz XQPNCCZVOLGTIL-UHFFFAOYSA-N 1 1 311.303 3.765 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccc(O)c1OC ZINC000272324627 130020581 /nfs/dbraw/zinc/02/05/81/130020581.db2.gz VCVYYCCCIJTRMH-UHFFFAOYSA-N 1 1 301.386 3.519 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1O ZINC000273723060 130159372 /nfs/dbraw/zinc/15/93/72/130159372.db2.gz ITCNHYNUPADBFP-CQSZACIVSA-N 1 1 306.793 3.719 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1O ZINC000273789799 130167412 /nfs/dbraw/zinc/16/74/12/130167412.db2.gz UYZFDNJEQADSMB-UHFFFAOYSA-N 1 1 321.726 3.749 20 10 DHCDMO CCC[C@H]([NH2+]Cc1cccc(F)c1O)[C@@H](O)c1ccccc1 ZINC000279698804 130758231 /nfs/dbraw/zinc/75/82/31/130758231.db2.gz QXHNPGPGJUMHTG-WMZOPIPTSA-N 1 1 303.377 3.523 20 10 DHCDMO CC[C@H]([NH2+][C@@H](COC)c1ccccc1)c1ccc(F)cc1O ZINC000286000727 131214359 /nfs/dbraw/zinc/21/43/59/131214359.db2.gz HNMDYOZIGJDLDO-IRXDYDNUSA-N 1 1 303.377 3.960 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(F)cc1O ZINC000286134852 131221408 /nfs/dbraw/zinc/22/14/08/131221408.db2.gz ODJCJOMHMGJOGX-QGZVFWFLSA-N 1 1 317.404 4.000 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cn2c(cccc2C)n1)c1ccc(F)cc1O ZINC000286273088 131227287 /nfs/dbraw/zinc/22/72/87/131227287.db2.gz VLUZVNAGRDUBEE-MRXNPFEDSA-N 1 1 313.376 3.728 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccc(F)cc1O ZINC000286335616 131231671 /nfs/dbraw/zinc/23/16/71/131231671.db2.gz YPMDGJNCCKMMSW-INIZCTEOSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287669189 131293589 /nfs/dbraw/zinc/29/35/89/131293589.db2.gz MBROUDQEGQEXOE-OAHLLOKOSA-N 1 1 307.825 3.682 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287728646 131297465 /nfs/dbraw/zinc/29/74/65/131297465.db2.gz PAWLVEYWRJGUKS-WBMJQRKESA-N 1 1 321.852 3.928 20 10 DHCDMO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000526987905 336278477 /nfs/dbraw/zinc/27/84/77/336278477.db2.gz AIBFAIAAZUOQRA-UHFFFAOYSA-N 1 1 304.397 3.653 20 10 DHCDMO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000371871235 336915366 /nfs/dbraw/zinc/91/53/66/336915366.db2.gz YLNVKQBFUFOLRA-MEDUHNTESA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(F)cc1O ZINC000375345061 337008481 /nfs/dbraw/zinc/00/84/81/337008481.db2.gz KTJUROZQUQEYSY-MEBBXXQBSA-N 1 1 305.324 3.845 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[C@@H](CO)c2ccccc21)c1ccc(F)cc1O ZINC000375897963 337022579 /nfs/dbraw/zinc/02/25/79/337022579.db2.gz NAEXNXCYDWZKKW-IGNZVWTISA-N 1 1 315.388 3.793 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H]2CCCc3cccnc32)c1 ZINC000377243126 337049264 /nfs/dbraw/zinc/04/92/64/337049264.db2.gz ILGPOUZXFGPIPO-QGZVFWFLSA-N 1 1 312.413 3.695 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@@H+](C)[C@@H]2CCCc3cccnc32)c1 ZINC000377690678 337058465 /nfs/dbraw/zinc/05/84/65/337058465.db2.gz DMOVQCHGKMYQQO-SUMWQHHRSA-N 1 1 312.413 3.866 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCCc3c2cnn3C)c1O ZINC000180641039 337176912 /nfs/dbraw/zinc/17/69/12/337176912.db2.gz YQRWOTWFMUHYOW-OAHLLOKOSA-N 1 1 319.836 3.597 20 10 DHCDMO C[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccccc1O ZINC000186061725 337253249 /nfs/dbraw/zinc/25/32/49/337253249.db2.gz MIIUNIFUBPZXSW-AWEZNQCLSA-N 1 1 305.381 3.700 20 10 DHCDMO COC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000156409071 522377899 /nfs/dbraw/zinc/37/78/99/522377899.db2.gz JANBNDDGMSFOQW-RHSMWYFYSA-N 1 1 302.418 3.692 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccs2)cc1OC ZINC000159492300 522773151 /nfs/dbraw/zinc/77/31/51/522773151.db2.gz QCTILEHSDBGEDQ-ZDUSSCGKSA-N 1 1 319.426 3.808 20 10 DHCDMO COc1cc(O)c(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cc1OC ZINC000179849980 522775050 /nfs/dbraw/zinc/77/50/50/522775050.db2.gz LJGLAHKQHPSEBQ-LBPRGKRZSA-N 1 1 317.385 3.728 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1ccccc1O ZINC000155852902 522873635 /nfs/dbraw/zinc/87/36/35/522873635.db2.gz DNMWHZFDGHAVTR-GOSISDBHSA-N 1 1 316.420 3.834 20 10 DHCDMO COc1ccc(O)c(C[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000179917635 524737877 /nfs/dbraw/zinc/73/78/77/524737877.db2.gz XNTIMSPTFSVRSF-UHFFFAOYSA-N 1 1 313.397 3.519 20 10 DHCDMO C[C@H]([NH2+]Cc1nccs1)c1ccc(N2CCCCC2)cc1 ZINC000128113725 525491331 /nfs/dbraw/zinc/49/13/31/525491331.db2.gz QIJBWBYZWVNCQK-AWEZNQCLSA-N 1 1 301.459 3.984 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000184918088 525496825 /nfs/dbraw/zinc/49/68/25/525496825.db2.gz SZPNSGVHHUMOCJ-HWPZZCPQSA-N 1 1 309.768 3.569 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c1O ZINC000189919127 525939205 /nfs/dbraw/zinc/93/92/05/525939205.db2.gz JNXSQALZPNZRJK-CQSZACIVSA-N 1 1 304.415 3.503 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(F)cc1O ZINC000286134849 535915785 /nfs/dbraw/zinc/91/57/85/535915785.db2.gz ODJCJOMHMGJOGX-KRWDZBQOSA-N 1 1 317.404 4.000 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(COC)cc1)c1ccc(F)cc1O ZINC000285640594 535916493 /nfs/dbraw/zinc/91/64/93/535916493.db2.gz LUBKRMVBWNRIMD-KRWDZBQOSA-N 1 1 303.377 3.919 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccccc1COC)c1ccc(F)cc1O ZINC000285811545 535920295 /nfs/dbraw/zinc/92/02/95/535920295.db2.gz VVOLXQPSEQYSJE-KRWDZBQOSA-N 1 1 303.377 3.919 20 10 DHCDMO CO[C@H](C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)C1CCC1 ZINC001167107926 1013149448 /nfs/dbraw/zinc/14/94/48/1013149448.db2.gz LFFFUBRBUHCPNY-LJQANCHMSA-N 1 1 304.478 3.778 20 10 DHCDMO Cc1ccccc1C[NH2+]Cc1cccc(Br)c1O ZINC000042412412 1013204348 /nfs/dbraw/zinc/20/43/48/1013204348.db2.gz QVGMFQSZTATMGK-UHFFFAOYSA-N 1 1 306.203 3.753 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCc1ccns1)C1CCCC1 ZINC001307462307 1013719292 /nfs/dbraw/zinc/71/92/92/1013719292.db2.gz PIONDYZFKYQEHI-UHFFFAOYSA-N 1 1 302.443 3.836 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)c2cccs2)c1O ZINC000050143599 1014088705 /nfs/dbraw/zinc/08/87/05/1014088705.db2.gz MLRHAYSFJKVDDK-SNVBAGLBSA-N 1 1 307.390 3.988 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000707129730 1015086052 /nfs/dbraw/zinc/08/60/52/1015086052.db2.gz RIYPILTVMMDWQI-RISCZKNCSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1cccc2c1C[N@H+](Cc1ccccc1OCC(F)F)C2 ZINC000895450028 1015159946 /nfs/dbraw/zinc/15/99/46/1015159946.db2.gz RZGARDCMJNDTLL-UHFFFAOYSA-N 1 1 305.324 3.552 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccccc1OCC(F)F)C2 ZINC000895450028 1015159955 /nfs/dbraw/zinc/15/99/55/1015159955.db2.gz RZGARDCMJNDTLL-UHFFFAOYSA-N 1 1 305.324 3.552 20 10 DHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000895455313 1015168764 /nfs/dbraw/zinc/16/87/64/1015168764.db2.gz VIMKMSALVJMLKJ-HNNXBMFYSA-N 1 1 311.372 3.594 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000895455313 1015168770 /nfs/dbraw/zinc/16/87/70/1015168770.db2.gz VIMKMSALVJMLKJ-HNNXBMFYSA-N 1 1 311.372 3.594 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000895455313 1015168777 /nfs/dbraw/zinc/16/87/77/1015168777.db2.gz VIMKMSALVJMLKJ-HNNXBMFYSA-N 1 1 311.372 3.594 20 10 DHCDMO CCC[N@@H+](CC)Cc1c(O)c(C(=O)OC)cc2ccccc21 ZINC000727820603 1015482674 /nfs/dbraw/zinc/48/26/74/1015482674.db2.gz LBHLNGQDZJPWEQ-UHFFFAOYSA-N 1 1 301.386 3.564 20 10 DHCDMO CCc1cc(C[N@@H+](C)C[C@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000176088695 1015665313 /nfs/dbraw/zinc/66/53/13/1015665313.db2.gz ADTGVHZHYJBUKL-OAHLLOKOSA-N 1 1 305.462 3.720 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000896608661 1015677544 /nfs/dbraw/zinc/67/75/44/1015677544.db2.gz HRNBZRZOBPWEJQ-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO CC1(C)Cc2cccc(C[NH2+]Cc3c(O)cccc3F)c2O1 ZINC000896642488 1015689643 /nfs/dbraw/zinc/68/96/43/1015689643.db2.gz YADDUFDTYVLRCL-UHFFFAOYSA-N 1 1 301.361 3.535 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccccc1N1CCCCC1 ZINC000896639577 1015693868 /nfs/dbraw/zinc/69/38/68/1015693868.db2.gz MBSDIFVFWAWDGN-UHFFFAOYSA-N 1 1 314.404 3.811 20 10 DHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)[nH]1 ZINC000276847999 1015710335 /nfs/dbraw/zinc/71/03/35/1015710335.db2.gz CUVUMDKSJRKLQV-MELADBBJSA-N 1 1 315.465 3.796 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@@H]2C2CC2)c1O ZINC000775678263 1036409981 /nfs/dbraw/zinc/40/99/81/1036409981.db2.gz YPYGGUYWSYNCIQ-CQSZACIVSA-N 1 1 310.235 3.838 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1ccc(F)cc1O ZINC000185079875 1016544333 /nfs/dbraw/zinc/54/43/33/1016544333.db2.gz NOOYOSDGMFYIIX-SJKOYZFVSA-N 1 1 320.383 3.624 20 10 DHCDMO COc1ccc(CCC[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185095020 1016547314 /nfs/dbraw/zinc/54/73/14/1016547314.db2.gz JDQOYUNZAGPFRE-CYBMUJFWSA-N 1 1 303.377 3.823 20 10 DHCDMO CCC[N@@H+](Cc1cn(C(C)C)nc1C)Cc1ccccc1O ZINC000281563260 1016601949 /nfs/dbraw/zinc/60/19/49/1016601949.db2.gz JXGPDHUXUPHDOU-UHFFFAOYSA-N 1 1 301.434 3.890 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C)[C@@H]3C)cc2)CC1 ZINC000294960554 1032223540 /nfs/dbraw/zinc/22/35/40/1032223540.db2.gz KXTYABFLRMSRRS-HOTGVXAUSA-N 1 1 302.462 3.532 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000295119608 1032282441 /nfs/dbraw/zinc/28/24/41/1032282441.db2.gz XELXIXLXSWVJBM-CMPLNLGQSA-N 1 1 303.324 3.564 20 10 DHCDMO C[C@@H](c1ncccn1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929183836 1032434124 /nfs/dbraw/zinc/43/41/24/1032434124.db2.gz FTZOVKKZYPVXEL-INIZCTEOSA-N 1 1 310.445 3.660 20 10 DHCDMO C[C@@H](c1ncccn1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929183836 1032434129 /nfs/dbraw/zinc/43/41/29/1032434129.db2.gz FTZOVKKZYPVXEL-INIZCTEOSA-N 1 1 310.445 3.660 20 10 DHCDMO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2OC)c1O ZINC000093008316 1032520438 /nfs/dbraw/zinc/52/04/38/1032520438.db2.gz FBGUUWYKVCJETM-INIZCTEOSA-N 1 1 313.397 3.747 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)cc1F ZINC000799736360 1012496413 /nfs/dbraw/zinc/49/64/13/1012496413.db2.gz OZELKHKMNBIDPZ-GOEBONIOSA-N 1 1 308.441 3.671 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCCC2)cc1)C(F)(F)F ZINC001208895172 1012768478 /nfs/dbraw/zinc/76/84/78/1012768478.db2.gz ZQMZTPHPWKEOEI-CYBMUJFWSA-N 1 1 300.368 3.917 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000305740978 1017528609 /nfs/dbraw/zinc/52/86/09/1017528609.db2.gz DUGOCHXGGNAHPE-IBGZPJMESA-N 1 1 323.392 3.721 20 10 DHCDMO CCC[N@@H+](CCCCn1ccnc1C)Cc1ccccc1O ZINC000161530963 1018043084 /nfs/dbraw/zinc/04/30/84/1018043084.db2.gz QSSDTNKPCGKXON-UHFFFAOYSA-N 1 1 301.434 3.590 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000796682019 1018437632 /nfs/dbraw/zinc/43/76/32/1018437632.db2.gz GOEKBNZFLFOOIL-JKSUJKDBSA-N 1 1 322.449 3.936 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCCC(F)(F)CC2)c1O ZINC000705777583 1018679773 /nfs/dbraw/zinc/67/97/73/1018679773.db2.gz GNLGZBDZVGAKBY-UHFFFAOYSA-N 1 1 305.752 3.675 20 10 DHCDMO CSCC1CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000708516018 1018841847 /nfs/dbraw/zinc/84/18/47/1018841847.db2.gz CJYWNGAMNDBAFC-UHFFFAOYSA-N 1 1 301.402 3.682 20 10 DHCDMO COc1ccc(CNC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1C ZINC001171626304 1032806755 /nfs/dbraw/zinc/80/67/55/1032806755.db2.gz XKHXMCXTVZASMD-UHFFFAOYSA-N 1 1 304.478 3.745 20 10 DHCDMO C/C=C\C[C@H](CO)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000588599821 1019286537 /nfs/dbraw/zinc/28/65/37/1019286537.db2.gz UQHNPDUNVOCJLO-HWKXXFMVSA-N 1 1 304.217 3.677 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@@]1(C)O ZINC001143103334 1019359765 /nfs/dbraw/zinc/35/97/65/1019359765.db2.gz AMGNUBVMWZKRNJ-IFXJQAMLSA-N 1 1 305.462 3.673 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc(C)c(F)c2)cc1 ZINC001171729885 1032847474 /nfs/dbraw/zinc/84/74/74/1032847474.db2.gz ODXAMKAOQQENJO-UHFFFAOYSA-N 1 1 316.420 3.711 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](Nc2nccs2)C1 ZINC000732049480 1020197376 /nfs/dbraw/zinc/19/73/76/1020197376.db2.gz ZDFOJHXZCUJFAN-ZDUSSCGKSA-N 1 1 323.849 3.579 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H](c1ccccc1)N(C)C ZINC000186332277 1020242365 /nfs/dbraw/zinc/24/23/65/1020242365.db2.gz SRUHQWDJMTUSRB-KSMMKXTCSA-N 1 1 316.420 3.873 20 10 DHCDMO C[C@H](NCC[NH+]1[C@@H](C)CCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000765855164 1020520836 /nfs/dbraw/zinc/52/08/36/1020520836.db2.gz UWONQNWBCMMYRX-ULQDDVLXSA-N 1 1 303.494 3.666 20 10 DHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(O)c(C)c2O)cc1 ZINC001140748525 1020600828 /nfs/dbraw/zinc/60/08/28/1020600828.db2.gz HREQGBGJMADQPB-ZDUSSCGKSA-N 1 1 301.386 3.608 20 10 DHCDMO CCC(F)(F)C[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000858508190 1032926288 /nfs/dbraw/zinc/92/62/88/1032926288.db2.gz UDGWLEYCSQDBTH-MRVPVSSYSA-N 1 1 308.166 3.851 20 10 DHCDMO CCc1cc(C[N@H+]2CC[C@@H](COC)C2)c(O)c(C(C)(C)C)c1 ZINC000739867401 1020919134 /nfs/dbraw/zinc/91/91/34/1020919134.db2.gz BUYHJEPQZDRZHS-OAHLLOKOSA-N 1 1 305.462 3.720 20 10 DHCDMO CC(C)OCCC[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000740857680 1020955256 /nfs/dbraw/zinc/95/52/56/1020955256.db2.gz FTPRBGUUZSIIQL-UHFFFAOYSA-N 1 1 309.450 3.642 20 10 DHCDMO CO[C@H]1C[C@@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000858592461 1032958226 /nfs/dbraw/zinc/95/82/26/1032958226.db2.gz CGTHWECXWOSQOW-LPEHRKFASA-N 1 1 304.217 3.775 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000154317801 1021211752 /nfs/dbraw/zinc/21/17/52/1021211752.db2.gz RHENNDJCOLBJMO-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO CCC(CC)[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCC1 ZINC000917394719 1021248940 /nfs/dbraw/zinc/24/89/40/1021248940.db2.gz PVTZHGKSMGKSBK-IBGZPJMESA-N 1 1 316.489 3.612 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cccn2C)c(O)c(C(C)(C)C)c1 ZINC000164503933 1021263649 /nfs/dbraw/zinc/26/36/49/1021263649.db2.gz HUEQFGTVRNILKZ-UHFFFAOYSA-N 1 1 316.445 3.669 20 10 DHCDMO COCC1CC[NH+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001236793103 1021271157 /nfs/dbraw/zinc/27/11/57/1021271157.db2.gz HMUREEYUIPWMAF-UHFFFAOYSA-N 1 1 304.217 3.557 20 10 DHCDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000743398413 1021284363 /nfs/dbraw/zinc/28/43/63/1021284363.db2.gz HQSIXNKDUFTFNN-SJORKVTESA-N 1 1 305.487 3.987 20 10 DHCDMO Cc1cc(C[N@H+]2CCC(=O)[C@H](F)CC2)c(C)n1-c1ccccc1 ZINC001137854122 1021285031 /nfs/dbraw/zinc/28/50/31/1021285031.db2.gz JHZOVRFQFKJYLD-GOSISDBHSA-N 1 1 314.404 3.597 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC(=O)[C@H](F)CC2)c(C)n1-c1ccccc1 ZINC001137854122 1021285043 /nfs/dbraw/zinc/28/50/43/1021285043.db2.gz JHZOVRFQFKJYLD-GOSISDBHSA-N 1 1 314.404 3.597 20 10 DHCDMO COc1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)cc1C ZINC000776344237 1021299525 /nfs/dbraw/zinc/29/95/25/1021299525.db2.gz ARSXJYDTTHXFCD-UHFFFAOYSA-N 1 1 302.443 3.629 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)C1(CO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000850516541 1021573861 /nfs/dbraw/zinc/57/38/61/1021573861.db2.gz WYHMJPQTLFGPBB-RKDXNWHRSA-N 1 1 304.217 3.511 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(COC)cs1)c1ccc(F)cc1O ZINC000850533261 1021588094 /nfs/dbraw/zinc/58/80/94/1021588094.db2.gz UGNCUOCQBMVDNF-OAHLLOKOSA-N 1 1 309.406 3.980 20 10 DHCDMO Cc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539324 1021593759 /nfs/dbraw/zinc/59/37/59/1021593759.db2.gz RXNCXVVEDRFPLQ-CVEARBPZSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc([C@@H](C)N[C@H]2CC[N@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539324 1021593761 /nfs/dbraw/zinc/59/37/61/1021593761.db2.gz RXNCXVVEDRFPLQ-CVEARBPZSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000850546378 1021597546 /nfs/dbraw/zinc/59/75/46/1021597546.db2.gz YPUWDCNKSDMEPG-ONGXEEELSA-N 1 1 318.244 3.758 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cccc(C(F)(F)F)c1O ZINC000850571294 1021614814 /nfs/dbraw/zinc/61/48/14/1021614814.db2.gz PCQWQTZGVXQWSV-QWRGUYRKSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1nccn1C ZINC000850573180 1021617174 /nfs/dbraw/zinc/61/71/74/1021617174.db2.gz VUOCUMPIGZBKTC-DTWKUNHWSA-N 1 1 314.216 3.844 20 10 DHCDMO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccccc1O ZINC000109770636 1021745532 /nfs/dbraw/zinc/74/55/32/1021745532.db2.gz PTTDODDDFSTEQZ-LLVKDONJSA-N 1 1 315.398 3.697 20 10 DHCDMO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccccc1O ZINC000109770636 1021745550 /nfs/dbraw/zinc/74/55/50/1021745550.db2.gz PTTDODDDFSTEQZ-LLVKDONJSA-N 1 1 315.398 3.697 20 10 DHCDMO C[N@H+](Cc1ncc(-c2cccs2)o1)Cc1ccccc1O ZINC000109773798 1021747797 /nfs/dbraw/zinc/74/77/97/1021747797.db2.gz IZSGEFNLQZATRJ-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO C[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1ccccc1O ZINC000109773798 1021747812 /nfs/dbraw/zinc/74/78/12/1021747812.db2.gz IZSGEFNLQZATRJ-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO CCOc1ccc(F)c(F)c1C[N@H+](C)Cc1ccccc1O ZINC001143496987 1021784466 /nfs/dbraw/zinc/78/44/66/1021784466.db2.gz HAKLOJRNCDCTCM-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCOc1ccc(F)c(F)c1C[N@@H+](C)Cc1ccccc1O ZINC001143496987 1021784475 /nfs/dbraw/zinc/78/44/75/1021784475.db2.gz HAKLOJRNCDCTCM-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCO[C@@H]1CC1(F)F)C1CCCC1 ZINC000851770676 1021994648 /nfs/dbraw/zinc/99/46/48/1021994648.db2.gz TYGSLFMCDJJOPE-MRXNPFEDSA-N 1 1 311.372 3.561 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000851791500 1021999310 /nfs/dbraw/zinc/99/93/10/1021999310.db2.gz CJFLMNXORXNBLO-UHFFFAOYSA-N 1 1 318.348 3.852 20 10 DHCDMO COc1ccc(CNCC(C)(C)[N@@H+]2CCC[C@H](C)C2)cc1C ZINC000920181185 1022071876 /nfs/dbraw/zinc/07/18/76/1022071876.db2.gz GHGWRADTMOQIIN-HNNXBMFYSA-N 1 1 304.478 3.604 20 10 DHCDMO COc1ccc(CNCC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1C ZINC000920181185 1022071891 /nfs/dbraw/zinc/07/18/91/1022071891.db2.gz GHGWRADTMOQIIN-HNNXBMFYSA-N 1 1 304.478 3.604 20 10 DHCDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc(F)ccc2O)C2CC2)c1 ZINC000179933533 1022093840 /nfs/dbraw/zinc/09/38/40/1022093840.db2.gz RTMSRJZNNBHOFF-UHFFFAOYSA-N 1 1 316.332 3.604 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2cccs2)c1 ZINC000756378934 1022164781 /nfs/dbraw/zinc/16/47/81/1022164781.db2.gz KMVIHPGVXVIBFZ-NEPJUHHUSA-N 1 1 319.426 3.522 20 10 DHCDMO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000766548734 1022188720 /nfs/dbraw/zinc/18/87/20/1022188720.db2.gz DVCWKRRSERYJNE-LBPRGKRZSA-N 1 1 304.463 3.578 20 10 DHCDMO CCC[N@@H+](Cc1ccc(-n2cccn2)cc1)Cc1ccccc1O ZINC000110990430 1022190886 /nfs/dbraw/zinc/19/08/86/1022190886.db2.gz RMSMRIBERLSCNE-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cn2ncc(Cl)c2C2CC2)cc1 ZINC000853488435 1022280652 /nfs/dbraw/zinc/28/06/52/1022280652.db2.gz GUGHTGIKSDLASE-UHFFFAOYSA-N 1 1 318.852 3.569 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cn2ncc(Cl)c2C2CC2)cc1 ZINC000853488435 1022280661 /nfs/dbraw/zinc/28/06/61/1022280661.db2.gz GUGHTGIKSDLASE-UHFFFAOYSA-N 1 1 318.852 3.569 20 10 DHCDMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1cc3oc4ccccc4c3cc1O)C2 ZINC000853565734 1022293341 /nfs/dbraw/zinc/29/33/41/1022293341.db2.gz JKCUOXVKCTUULR-VBKZILBWSA-N 1 1 323.392 3.760 20 10 DHCDMO C[C@]12COC[C@H]1C[N@@H+](Cc1cc3oc4ccccc4c3cc1O)C2 ZINC000853565735 1022294462 /nfs/dbraw/zinc/29/44/62/1022294462.db2.gz JKCUOXVKCTUULR-VLIAUNLRSA-N 1 1 323.392 3.760 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@@H](C)c1cccc(O)c1 ZINC000179770827 1022531634 /nfs/dbraw/zinc/53/16/34/1022531634.db2.gz MUCQKRZNKWCYQV-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2scnc2C)cc1 ZINC000179766488 1022533004 /nfs/dbraw/zinc/53/30/04/1022533004.db2.gz VNXWTQUVOBWTGM-UHFFFAOYSA-N 1 1 303.475 3.930 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1O ZINC001237680637 1022539778 /nfs/dbraw/zinc/53/97/78/1022539778.db2.gz FCUAEELFQKPGPR-LBPRGKRZSA-N 1 1 307.743 3.923 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)c1O ZINC001237680637 1022539786 /nfs/dbraw/zinc/53/97/86/1022539786.db2.gz FCUAEELFQKPGPR-LBPRGKRZSA-N 1 1 307.743 3.923 20 10 DHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc(Br)ccc1O ZINC000763645457 1022655575 /nfs/dbraw/zinc/65/55/75/1022655575.db2.gz GQFIDQSCGQVUSQ-NSHDSACASA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1ccc2c(c1)CC[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000767726416 1022789182 /nfs/dbraw/zinc/78/91/82/1022789182.db2.gz ATCPTGLJLQHTLT-LBPRGKRZSA-N 1 1 321.779 3.537 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)CCOC(C)(C)C)c2c1 ZINC000767776429 1022804262 /nfs/dbraw/zinc/80/42/62/1022804262.db2.gz VEWYSCPJACGUKE-UHFFFAOYSA-N 1 1 317.429 3.801 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccc(F)nc1 ZINC000189277828 1022844521 /nfs/dbraw/zinc/84/45/21/1022844521.db2.gz PGFQVFAXPKJRQX-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO CC[N@@H+](Cc1[nH]nc2ccccc21)Cc1ccc(N(C)C)cc1 ZINC000768133727 1022901480 /nfs/dbraw/zinc/90/14/80/1022901480.db2.gz LQIOSFPHLXQYCA-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CC[N@H+](Cc1n[nH]c2ccccc21)Cc1ccc(N(C)C)cc1 ZINC000768133727 1022901492 /nfs/dbraw/zinc/90/14/92/1022901492.db2.gz LQIOSFPHLXQYCA-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO CC[N@@H+](Cc1n[nH]c2ccccc21)Cc1ccc(N(C)C)cc1 ZINC000768133727 1022901500 /nfs/dbraw/zinc/90/15/00/1022901500.db2.gz LQIOSFPHLXQYCA-UHFFFAOYSA-N 1 1 308.429 3.651 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000768159392 1022908608 /nfs/dbraw/zinc/90/86/08/1022908608.db2.gz DQBZQCDQSAXCEK-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO CCOc1cccc(C[N@@H+](CCOC)Cc2cccs2)c1O ZINC000768199101 1022913932 /nfs/dbraw/zinc/91/39/32/1022913932.db2.gz ZHCANTKDVPTYPP-UHFFFAOYSA-N 1 1 321.442 3.501 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)Cc2ccccc21 ZINC000768196353 1022926083 /nfs/dbraw/zinc/92/60/83/1022926083.db2.gz PTSWRSXXPKUQIK-KRWDZBQOSA-N 1 1 322.452 3.643 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(F)cc2F)c1O ZINC000768233746 1022929779 /nfs/dbraw/zinc/92/97/79/1022929779.db2.gz RAIHSQXUGQFKPI-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H](CC(C)C)C2)cc1OC ZINC000768464438 1022972981 /nfs/dbraw/zinc/97/29/81/1022972981.db2.gz RDYSTIKPFFMMIT-CQSZACIVSA-N 1 1 307.434 3.668 20 10 DHCDMO CC[N@@H+](Cc1cc(C)ccc1O)Cc1ccc(OC)cc1OC ZINC000768497103 1022976864 /nfs/dbraw/zinc/97/68/64/1022976864.db2.gz VELHRNXNLKCJDV-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOC[C@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000278831205 1022992597 /nfs/dbraw/zinc/99/25/97/1022992597.db2.gz UARREXZZHFUZLW-ZDMBXUJBSA-N 1 1 304.217 3.775 20 10 DHCDMO COC[C@H]1CCCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000768539884 1022986118 /nfs/dbraw/zinc/98/61/18/1022986118.db2.gz DDLZNLDRWNHKAZ-IBGZPJMESA-N 1 1 316.489 3.925 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)CCCOc2ccc(F)cc2)c1 ZINC000768868584 1023043593 /nfs/dbraw/zinc/04/35/93/1023043593.db2.gz MGIDEQDRLBIRLC-UHFFFAOYSA-N 1 1 303.377 3.741 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)C2CCOCC2)cc1 ZINC000768902373 1023052406 /nfs/dbraw/zinc/05/24/06/1023052406.db2.gz DUMHVIRLFBQTRA-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000768999849 1023075576 /nfs/dbraw/zinc/07/55/76/1023075576.db2.gz QBMVBTWGNAMQST-UHFFFAOYSA-N 1 1 316.832 3.758 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c(O)c1 ZINC000769106455 1023084791 /nfs/dbraw/zinc/08/47/91/1023084791.db2.gz TXUMWXJCZXAGMQ-SFHVURJKSA-N 1 1 313.397 3.834 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1O ZINC000769105163 1023085893 /nfs/dbraw/zinc/08/58/93/1023085893.db2.gz NBRUKCKNEJDYID-QGZVFWFLSA-N 1 1 313.397 3.834 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1O ZINC000769339628 1023128592 /nfs/dbraw/zinc/12/85/92/1023128592.db2.gz UHXRAGIVMJFWSC-OAHLLOKOSA-N 1 1 315.388 3.920 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000769337503 1023129227 /nfs/dbraw/zinc/12/92/27/1023129227.db2.gz JNRVWWZMBAUOEI-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO CCC[N@H+](Cc1ccc(OCC)cc1O)C[C@H]1CCCCO1 ZINC000769339472 1023129313 /nfs/dbraw/zinc/12/93/13/1023129313.db2.gz PYJWEKFRVSUBMT-QGZVFWFLSA-N 1 1 307.434 3.572 20 10 DHCDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769405384 1023143316 /nfs/dbraw/zinc/14/33/16/1023143316.db2.gz UXWZFDKRMFYNNR-IMFGXOCKSA-N 1 1 314.473 3.676 20 10 DHCDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769422615 1023145379 /nfs/dbraw/zinc/14/53/79/1023145379.db2.gz KQXLFZXMNIINJD-SFHVURJKSA-N 1 1 304.478 3.781 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1 ZINC000769427339 1023146263 /nfs/dbraw/zinc/14/62/63/1023146263.db2.gz VVPAIQZFEZJRRS-OAQYLSRUSA-N 1 1 324.468 3.625 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769444636 1023154347 /nfs/dbraw/zinc/15/43/47/1023154347.db2.gz AJTWUTKEBLYUJN-GOSISDBHSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769444636 1023154352 /nfs/dbraw/zinc/15/43/52/1023154352.db2.gz AJTWUTKEBLYUJN-GOSISDBHSA-N 1 1 317.816 3.928 20 10 DHCDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769452266 1023158017 /nfs/dbraw/zinc/15/80/17/1023158017.db2.gz UVDQUBFFVYESRR-IRXDYDNUSA-N 1 1 302.462 3.534 20 10 DHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000769497391 1023166317 /nfs/dbraw/zinc/16/63/17/1023166317.db2.gz CRYFZDVAPLKEIU-KRWDZBQOSA-N 1 1 319.832 3.819 20 10 DHCDMO CCC[C@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769503400 1023169096 /nfs/dbraw/zinc/16/90/96/1023169096.db2.gz JYGSESKJBYRNMF-KRWDZBQOSA-N 1 1 302.462 3.535 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H](CO)C(C)(C)C ZINC000769533853 1023173230 /nfs/dbraw/zinc/17/32/30/1023173230.db2.gz QHFVTBYSVSNQSX-IBGZPJMESA-N 1 1 313.441 3.898 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)cc1 ZINC000769533214 1023174403 /nfs/dbraw/zinc/17/44/03/1023174403.db2.gz PLKKOIUDDFWSNU-HXUWFJFHSA-N 1 1 316.489 3.925 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H]2CC[C@@H](SCC)C2)c(O)c1 ZINC000769551075 1023176965 /nfs/dbraw/zinc/17/69/65/1023176965.db2.gz UZESNOCXNZRITD-GDBMZVCRSA-N 1 1 309.475 3.897 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H]2CC[C@H](SCC)C2)c(O)c1 ZINC000769551081 1023177427 /nfs/dbraw/zinc/17/74/27/1023177427.db2.gz UZESNOCXNZRITD-HOCLYGCPSA-N 1 1 309.475 3.897 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1O ZINC000769558586 1023181118 /nfs/dbraw/zinc/18/11/18/1023181118.db2.gz FVWKIMRJIZCAJO-ZDUSSCGKSA-N 1 1 303.352 3.968 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)c1 ZINC000769854811 1023218679 /nfs/dbraw/zinc/21/86/79/1023218679.db2.gz XUHPRNQBCFXKQO-UHFFFAOYSA-N 1 1 321.424 3.638 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000770286011 1023291158 /nfs/dbraw/zinc/29/11/58/1023291158.db2.gz NLTRIMPAFZFVSY-QUCCMNQESA-N 1 1 314.473 3.678 20 10 DHCDMO CC(C)[N@@H+](Cc1cnc2ccccn12)Cc1ccc(N(C)C)cc1 ZINC000771791607 1023471051 /nfs/dbraw/zinc/47/10/51/1023471051.db2.gz PKJKRQPKSPUOCM-UHFFFAOYSA-N 1 1 322.456 3.811 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] ZINC000771935358 1023489895 /nfs/dbraw/zinc/48/98/95/1023489895.db2.gz PIJSYDWJTXPOMC-UHFFFAOYSA-N 1 1 313.401 3.601 20 10 DHCDMO Cc1cc(C)c([C@@H](C)NCC[N@H+](C)C2CCCCC2)c(O)c1 ZINC000788562214 1023905240 /nfs/dbraw/zinc/90/52/40/1023905240.db2.gz GFYUWVPHERAZRC-MRXNPFEDSA-N 1 1 304.478 3.924 20 10 DHCDMO Cc1cc(C)c([C@@H](C)NCC[N@@H+](C)C2CCCCC2)c(O)c1 ZINC000788562214 1023905243 /nfs/dbraw/zinc/90/52/43/1023905243.db2.gz GFYUWVPHERAZRC-MRXNPFEDSA-N 1 1 304.478 3.924 20 10 DHCDMO CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788589853 1023910557 /nfs/dbraw/zinc/91/05/57/1023910557.db2.gz DFHSIDUTVSIUBB-FIXISWKDSA-N 1 1 319.367 3.859 20 10 DHCDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882881628 1024159759 /nfs/dbraw/zinc/15/97/59/1024159759.db2.gz WFEHGRWREPBPQK-LLVKDONJSA-N 1 1 307.340 3.920 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508382 1024162108 /nfs/dbraw/zinc/16/21/08/1024162108.db2.gz ZWZUKRKGZRJANU-CABCVRRESA-N 1 1 310.441 3.680 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508382 1024162114 /nfs/dbraw/zinc/16/21/14/1024162114.db2.gz ZWZUKRKGZRJANU-CABCVRRESA-N 1 1 310.441 3.680 20 10 DHCDMO CCCOCc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000882901894 1024165375 /nfs/dbraw/zinc/16/53/75/1024165375.db2.gz STISCJWAZKFGON-UHFFFAOYSA-N 1 1 321.367 3.887 20 10 DHCDMO CC[C@@H]([NH2+][C@H](c1cnn(C)c1)C(C)C)c1ccc(F)cc1O ZINC000927067265 1033496263 /nfs/dbraw/zinc/49/62/63/1033496263.db2.gz FDNHETHZCCJPBV-WBVHZDCISA-N 1 1 305.397 3.703 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000882937209 1024179768 /nfs/dbraw/zinc/17/97/68/1024179768.db2.gz KXQLLKPMXMVOCO-SJORKVTESA-N 1 1 319.351 3.680 20 10 DHCDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C1 ZINC000130657696 1024196944 /nfs/dbraw/zinc/19/69/44/1024196944.db2.gz VDBSDUXLOLOVBK-QFBILLFUSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1csc(C2([NH2+]Cc3cc(F)cc(F)c3O)CCCC2)n1 ZINC000882994520 1024200904 /nfs/dbraw/zinc/20/09/04/1024200904.db2.gz JDQWXNWFXOBQKN-UHFFFAOYSA-N 1 1 324.396 3.994 20 10 DHCDMO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2cc(F)cc(F)c2O)CCO1 ZINC000883084382 1024237264 /nfs/dbraw/zinc/23/72/64/1024237264.db2.gz PUNMKNQLBBJKBU-GOEBONIOSA-N 1 1 313.388 3.744 20 10 DHCDMO CSCc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000883099455 1024241885 /nfs/dbraw/zinc/24/18/85/1024241885.db2.gz VUOANOICFXUSLT-UHFFFAOYSA-N 1 1 309.381 3.823 20 10 DHCDMO CC(C)OCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172451719 1033205554 /nfs/dbraw/zinc/20/55/54/1033205554.db2.gz UMMNTYZJRKZOHH-KRWDZBQOSA-N 1 1 304.478 3.922 20 10 DHCDMO CC(C)(C[NH2+]Cc1c(O)ccc(Cl)c1F)N1CCCCC1 ZINC000790946689 1024402052 /nfs/dbraw/zinc/40/20/52/1024402052.db2.gz GMRCLQIKKCWMPH-UHFFFAOYSA-N 1 1 314.832 3.539 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000790956572 1024403933 /nfs/dbraw/zinc/40/39/33/1024403933.db2.gz VCZHKLVCHQXGKC-UHFFFAOYSA-N 1 1 301.695 3.753 20 10 DHCDMO COc1cccc(C[C@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)c1 ZINC000790959351 1024405159 /nfs/dbraw/zinc/40/51/59/1024405159.db2.gz ZPQJGGYYNUJNPZ-NSHDSACASA-N 1 1 323.795 3.914 20 10 DHCDMO Cc1cc(CC[NH2+]Cc2c(O)ccc(Cl)c2F)cc(C)c1O ZINC000790990956 1024413154 /nfs/dbraw/zinc/41/31/54/1024413154.db2.gz IXADXNMODSPTFO-UHFFFAOYSA-N 1 1 323.795 3.839 20 10 DHCDMO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790991695 1024413423 /nfs/dbraw/zinc/41/34/23/1024413423.db2.gz ZJYQMAISASGPHK-RYUDHWBXSA-N 1 1 315.816 3.868 20 10 DHCDMO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792181267 1024644485 /nfs/dbraw/zinc/64/44/85/1024644485.db2.gz ZOLSUMXHJLAZRN-INIZCTEOSA-N 1 1 315.816 3.558 20 10 DHCDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792181267 1024644488 /nfs/dbraw/zinc/64/44/88/1024644488.db2.gz ZOLSUMXHJLAZRN-INIZCTEOSA-N 1 1 315.816 3.558 20 10 DHCDMO CCc1cc(C[N@H+]2CCCOC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000772822306 1024810037 /nfs/dbraw/zinc/81/00/37/1024810037.db2.gz PFYOJNMXEVQLHJ-AWEZNQCLSA-N 1 1 305.462 3.863 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H](C2CC2)O1 ZINC000793221220 1024936260 /nfs/dbraw/zinc/93/62/60/1024936260.db2.gz YAPNJOBTGWILSE-UZLBHIALSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)c(O)c1C ZINC000793569297 1025103931 /nfs/dbraw/zinc/10/39/31/1025103931.db2.gz MUXCNQPOCPTNIO-CQSZACIVSA-N 1 1 309.413 3.779 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCc2ccc(Br)cc2C1 ZINC000793609311 1025129641 /nfs/dbraw/zinc/12/96/41/1025129641.db2.gz AGYBVRAFIMORTR-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC000793706828 1025153643 /nfs/dbraw/zinc/15/36/43/1025153643.db2.gz UWBMIBWMIUZANI-ZDUSSCGKSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC000793706828 1025153651 /nfs/dbraw/zinc/15/36/51/1025153651.db2.gz UWBMIBWMIUZANI-ZDUSSCGKSA-N 1 1 317.351 3.551 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000793792999 1025166285 /nfs/dbraw/zinc/16/62/85/1025166285.db2.gz QVMGXYQKNAVCCR-CYBMUJFWSA-N 1 1 323.502 3.970 20 10 DHCDMO CC(C)n1nccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000279720100 1025183294 /nfs/dbraw/zinc/18/32/94/1025183294.db2.gz URGAPZVXIPBNCZ-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CC(C)n1nccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000279720100 1025183305 /nfs/dbraw/zinc/18/33/05/1025183305.db2.gz URGAPZVXIPBNCZ-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CCN(C#N)CC[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC001168244679 1025381640 /nfs/dbraw/zinc/38/16/40/1025381640.db2.gz QXGPMFMFDKADSM-QGZVFWFLSA-N 1 1 323.440 3.758 20 10 DHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@H](CO)C2)c(O)c(C(C)(C)C)c1 ZINC000092764828 1025460778 /nfs/dbraw/zinc/46/07/78/1025460778.db2.gz ROIALDUJZGVBPR-AWEZNQCLSA-N 1 1 319.489 3.801 20 10 DHCDMO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886491364 1025649937 /nfs/dbraw/zinc/64/99/37/1025649937.db2.gz ASLQXJUNNAGDOS-NWDGAFQWSA-N 1 1 319.376 3.960 20 10 DHCDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886491366 1025650083 /nfs/dbraw/zinc/65/00/83/1025650083.db2.gz ASLQXJUNNAGDOS-VXGBXAGGSA-N 1 1 319.376 3.960 20 10 DHCDMO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(F)cc(F)c2O)s1 ZINC000894014611 1025656257 /nfs/dbraw/zinc/65/62/57/1025656257.db2.gz NLNUMVQDWMPWNH-VIFPVBQESA-N 1 1 312.385 3.937 20 10 DHCDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(F)cc(F)c2O)s1 ZINC000894014611 1025656267 /nfs/dbraw/zinc/65/62/67/1025656267.db2.gz NLNUMVQDWMPWNH-VIFPVBQESA-N 1 1 312.385 3.937 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2O)n1 ZINC000894031129 1025657909 /nfs/dbraw/zinc/65/79/09/1025657909.db2.gz PHMMIVIOPZVCQA-INIZCTEOSA-N 1 1 304.340 3.711 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2O)n1 ZINC000894031129 1025657920 /nfs/dbraw/zinc/65/79/20/1025657920.db2.gz PHMMIVIOPZVCQA-INIZCTEOSA-N 1 1 304.340 3.711 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)c1O ZINC000894014923 1025659531 /nfs/dbraw/zinc/65/95/31/1025659531.db2.gz USKXZCLQRMYLGV-LBPRGKRZSA-N 1 1 320.458 3.976 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1c(O)cccc1F ZINC000886518768 1025671011 /nfs/dbraw/zinc/67/10/11/1025671011.db2.gz FTCYCJFJIIXNDW-LLVKDONJSA-N 1 1 306.356 3.587 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C[C@H](C)O)c1ccccc1)c1c(O)cccc1F ZINC000886540312 1025688225 /nfs/dbraw/zinc/68/82/25/1025688225.db2.gz CMWCWAWXDYFDIL-LZWOXQAQSA-N 1 1 317.404 3.737 20 10 DHCDMO COc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886547970 1025696336 /nfs/dbraw/zinc/69/63/36/1025696336.db2.gz VLIZJOFZUKLGRF-BXUZGUMPSA-N 1 1 317.360 3.714 20 10 DHCDMO COc1cccc(C2([NH2+][C@@H](C)c3c(O)cccc3F)CC2)c1 ZINC000886576971 1025716435 /nfs/dbraw/zinc/71/64/35/1025716435.db2.gz UHEDIELNWISOEQ-LBPRGKRZSA-N 1 1 301.361 3.880 20 10 DHCDMO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)CCO2 ZINC000886592200 1025726376 /nfs/dbraw/zinc/72/63/76/1025726376.db2.gz NFNBZTQKRBZASB-ABAIWWIYSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1c(O)cccc1F ZINC000886612149 1025736018 /nfs/dbraw/zinc/73/60/18/1025736018.db2.gz DGINZQIOTIMMMS-DIFFPNOSSA-N 1 1 321.417 3.732 20 10 DHCDMO C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886623917 1025747537 /nfs/dbraw/zinc/74/75/37/1025747537.db2.gz SRPPVBFFDDTXGA-KGLIPLIRSA-N 1 1 302.393 3.988 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1[N+](=O)[O-] ZINC000886646584 1025757572 /nfs/dbraw/zinc/75/75/72/1025757572.db2.gz NGXCQLCZOLZDRW-LLVKDONJSA-N 1 1 304.321 3.599 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Br)ccc1O ZINC000806179223 1025836601 /nfs/dbraw/zinc/83/66/01/1025836601.db2.gz BJYVSPBJVKMNEL-QPUJVOFHSA-N 1 1 320.177 3.993 20 10 DHCDMO CC[N@@H+](Cc1ccncc1)Cc1cc(Br)ccc1O ZINC000076118603 1025861170 /nfs/dbraw/zinc/86/11/70/1025861170.db2.gz GMSWUXDGNIEYEG-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc(C)c2O)o1 ZINC000137069629 1025879820 /nfs/dbraw/zinc/87/98/20/1025879820.db2.gz JMCQCTFMJXEWGQ-MRXNPFEDSA-N 1 1 301.386 3.777 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c1O ZINC000289744089 1026155026 /nfs/dbraw/zinc/15/50/26/1026155026.db2.gz QIHAGTJZELWBNR-AABGKKOBSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c1O ZINC000808677015 1026356378 /nfs/dbraw/zinc/35/63/78/1026356378.db2.gz OJTQJXRNPUXSGM-RCBQFDQVSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1O ZINC000808677015 1026356388 /nfs/dbraw/zinc/35/63/88/1026356388.db2.gz OJTQJXRNPUXSGM-RCBQFDQVSA-N 1 1 308.853 3.631 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000808729097 1026382293 /nfs/dbraw/zinc/38/22/93/1026382293.db2.gz ZHPPVFIBPNHEMZ-LRDDRELGSA-N 1 1 301.361 3.748 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1O ZINC000809693044 1026584878 /nfs/dbraw/zinc/58/48/78/1026584878.db2.gz MTRJPTCNGYYRGJ-HNNXBMFYSA-N 1 1 305.809 3.804 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1O ZINC000809693044 1026584886 /nfs/dbraw/zinc/58/48/86/1026584886.db2.gz MTRJPTCNGYYRGJ-HNNXBMFYSA-N 1 1 305.809 3.804 20 10 DHCDMO CN(C)CC[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000809728141 1026596020 /nfs/dbraw/zinc/59/60/20/1026596020.db2.gz MLHJOAUEDGPCSD-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO CN(C)CC[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000809728141 1026596024 /nfs/dbraw/zinc/59/60/24/1026596024.db2.gz MLHJOAUEDGPCSD-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO Cc1cccc(C[N@@H+](CCN(C)C)Cc2cccc(C)c2O)c1 ZINC000809741655 1026611242 /nfs/dbraw/zinc/61/12/42/1026611242.db2.gz RKZIHZHPBWBZMH-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1cccc(C[N@H+](CCN(C)C)Cc2cccc(C)c2O)c1 ZINC000809741655 1026611247 /nfs/dbraw/zinc/61/12/47/1026611247.db2.gz RKZIHZHPBWBZMH-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1O ZINC000809758141 1026618745 /nfs/dbraw/zinc/61/87/45/1026618745.db2.gz DTTADWBHXQZOKO-GJZGRUSLSA-N 1 1 323.864 3.993 20 10 DHCDMO Cc1cc(Br)cc(C[NH2+][C@@H]2CCCC2(F)F)c1O ZINC000809779857 1026622844 /nfs/dbraw/zinc/62/28/44/1026622844.db2.gz BNPNBPQLTXYSFV-LLVKDONJSA-N 1 1 320.177 3.741 20 10 DHCDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC000809790993 1026629134 /nfs/dbraw/zinc/62/91/34/1026629134.db2.gz RMMPHAYFKCJFFZ-LJQANCHMSA-N 1 1 322.468 3.656 20 10 DHCDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cccc(C)c1O)C2 ZINC000811519686 1027020433 /nfs/dbraw/zinc/02/04/33/1027020433.db2.gz ZYXFAVCSZBFABD-UHFFFAOYSA-N 1 1 309.409 3.757 20 10 DHCDMO Oc1ccc(F)cc1CN1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000811508466 1027024978 /nfs/dbraw/zinc/02/49/78/1027024978.db2.gz RJIPWYDVCHNLPU-KRWDZBQOSA-N 1 1 312.388 3.516 20 10 DHCDMO Cc1ncsc1C[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000295388726 1027248124 /nfs/dbraw/zinc/24/81/24/1027248124.db2.gz PRGNSGZTQQOHQX-UHFFFAOYSA-N 1 1 300.786 3.582 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C(C)C)[C@H]2CCOC2)cc1F ZINC000812777189 1027399866 /nfs/dbraw/zinc/39/98/66/1027399866.db2.gz YVKLSWOXNYLRIF-INIZCTEOSA-N 1 1 308.441 3.671 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCCC4(CC4)C3)cc2)CC1 ZINC000295753468 1027415664 /nfs/dbraw/zinc/41/56/64/1027415664.db2.gz OBXGJYWSRAONPP-UHFFFAOYSA-N 1 1 314.473 3.678 20 10 DHCDMO COCC1(C[N@@H+](Cc2ccccc2O)C2CCCC2)CCC1 ZINC000812826387 1027419187 /nfs/dbraw/zinc/41/91/87/1027419187.db2.gz LKNPSPVULKWRPX-UHFFFAOYSA-N 1 1 303.446 3.954 20 10 DHCDMO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1cc2c(cc1O)CCCC2 ZINC000296286404 1027597197 /nfs/dbraw/zinc/59/71/97/1027597197.db2.gz FHADAYOHSZLOLH-TZUVLKIQSA-N 1 1 314.473 3.547 20 10 DHCDMO C[N@@H+](CCOCC1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000158636139 1027600900 /nfs/dbraw/zinc/60/09/00/1027600900.db2.gz PRJWCTZDQMJTMO-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO COc1cc(Br)cc(C[N@H+]2CCCC[C@@H]2C)c1O ZINC000158924297 1027669256 /nfs/dbraw/zinc/66/92/56/1027669256.db2.gz NQFCDDKLKXZKCZ-JTQLQIEISA-N 1 1 314.223 3.538 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccc(F)cc1O ZINC000296608782 1027684451 /nfs/dbraw/zinc/68/44/51/1027684451.db2.gz WEIBGVIEJGIDFG-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)cc1 ZINC000778985394 1027716722 /nfs/dbraw/zinc/71/67/22/1027716722.db2.gz SCIUICVIWINTCE-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@@H]1C[C@@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)CCO1 ZINC000778985415 1027716974 /nfs/dbraw/zinc/71/69/74/1027716974.db2.gz SYRAMOQQLSUAKX-CVEARBPZSA-N 1 1 315.413 3.803 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCO[C@H](C)C2)cc1 ZINC000778995557 1027733701 /nfs/dbraw/zinc/73/37/01/1027733701.db2.gz ZFVXCJANURKEJA-SJLPKXTDSA-N 1 1 304.478 3.780 20 10 DHCDMO C[C@H]1C[C@@H](C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCO1 ZINC000778995690 1027735158 /nfs/dbraw/zinc/73/51/58/1027735158.db2.gz FRSJEOZTMHZCNS-RDJZCZTQSA-N 1 1 302.462 3.532 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813882913 1027750123 /nfs/dbraw/zinc/75/01/23/1027750123.db2.gz AFWDMEKGKDUDLW-TZMCWYRMSA-N 1 1 318.367 3.600 20 10 DHCDMO CCc1nccn1[C@H]1CCC[N@H+]([C@@H](CC)c2ccccc2O)C1 ZINC000364622942 1027857541 /nfs/dbraw/zinc/85/75/41/1027857541.db2.gz MLHLWJXPJVYNJZ-RDJZCZTQSA-N 1 1 313.445 3.939 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@@H](C)CO1 ZINC000779021432 1027863414 /nfs/dbraw/zinc/86/34/14/1027863414.db2.gz YOXPUEDBDDUDHM-LIRRHRJNSA-N 1 1 315.388 3.802 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)c1 ZINC000814178365 1027916495 /nfs/dbraw/zinc/91/64/95/1027916495.db2.gz NEZYPQPBWBRFBB-HNNXBMFYSA-N 1 1 314.404 3.550 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(OCC2CC2)CC1 ZINC000365268580 1027916831 /nfs/dbraw/zinc/91/68/31/1027916831.db2.gz ZDJGGDAHNHVZJB-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321746 1028165857 /nfs/dbraw/zinc/16/58/57/1028165857.db2.gz JNNIEGKTFRGLQV-WMZOPIPTSA-N 1 1 302.462 3.794 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321746 1028165867 /nfs/dbraw/zinc/16/58/67/1028165867.db2.gz JNNIEGKTFRGLQV-WMZOPIPTSA-N 1 1 302.462 3.794 20 10 DHCDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000367968435 1028266025 /nfs/dbraw/zinc/26/60/25/1028266025.db2.gz XNPFARSRZVBDCJ-HXUWFJFHSA-N 1 1 316.489 3.517 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H](c3ccco3)C2)c1O ZINC000368621915 1028385854 /nfs/dbraw/zinc/38/58/54/1028385854.db2.gz BLPDIJFWGHZRQG-NSHDSACASA-N 1 1 307.777 3.637 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c1O ZINC000779150597 1028439079 /nfs/dbraw/zinc/43/90/79/1028439079.db2.gz RUKWQZSQZVVDBE-ZANVPECISA-N 1 1 316.214 3.643 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c1O ZINC000779150597 1028439085 /nfs/dbraw/zinc/43/90/85/1028439085.db2.gz RUKWQZSQZVVDBE-ZANVPECISA-N 1 1 316.214 3.643 20 10 DHCDMO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815578604 1028550971 /nfs/dbraw/zinc/55/09/71/1028550971.db2.gz RTVGKUMGBSLKFV-QMTHXVAHSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(F)n1)c1cccc(C(F)(F)F)c1O ZINC000815598621 1028564146 /nfs/dbraw/zinc/56/41/46/1028564146.db2.gz YVSPGHXMJDJWBQ-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO COCCCCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815571557 1028566571 /nfs/dbraw/zinc/56/65/71/1028566571.db2.gz GYBFUXKPNVGONX-NSHDSACASA-N 1 1 305.340 3.878 20 10 DHCDMO CCN(CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000815573691 1028566827 /nfs/dbraw/zinc/56/68/27/1028566827.db2.gz QSJYMQGNUPHDBG-LBPRGKRZSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCC=CO1)c1cccc(C(F)(F)F)c1O ZINC000815618206 1028573314 /nfs/dbraw/zinc/57/33/14/1028573314.db2.gz GTKUOQDBGMDUAD-GHMZBOCLSA-N 1 1 301.308 3.754 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)C1CCCC1)c1cccc(C(F)(F)F)c1O ZINC000815627558 1028576812 /nfs/dbraw/zinc/57/68/12/1028576812.db2.gz DDAVFNJZONAEOI-IINYFYTJSA-N 1 1 317.351 3.613 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCSCC[C@H]3C)c2c1 ZINC000189910162 1028709218 /nfs/dbraw/zinc/70/92/18/1028709218.db2.gz KUDKELHESUMTIB-CYBMUJFWSA-N 1 1 317.454 3.881 20 10 DHCDMO COCC[C@@H]1CCCC[N@H+]([C@@H](C)c2cc(OC)ccc2O)C1 ZINC000372718252 1028887121 /nfs/dbraw/zinc/88/71/21/1028887121.db2.gz PQAQSQAHBVPDIE-GJZGRUSLSA-N 1 1 307.434 3.600 20 10 DHCDMO COc1cccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)c1 ZINC000816480995 1028887489 /nfs/dbraw/zinc/88/74/89/1028887489.db2.gz DPFUIIRIPRZMCG-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)c1 ZINC000816480995 1028887506 /nfs/dbraw/zinc/88/75/06/1028887506.db2.gz DPFUIIRIPRZMCG-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO Oc1c(C[N@H+]2CCOc3ccccc3C2)ccc2ccccc21 ZINC000816494305 1028897764 /nfs/dbraw/zinc/89/77/64/1028897764.db2.gz GFZKGWNBZLXSEY-UHFFFAOYSA-N 1 1 305.377 3.940 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H]2CN2CCCC2)ccc2ccccc21 ZINC000816497855 1028906227 /nfs/dbraw/zinc/90/62/27/1028906227.db2.gz WHLQNLKRGPQVFC-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(CN2CCC[C@@H]2C[NH+]2CCCC2)ccc2ccccc21 ZINC000816497855 1028906248 /nfs/dbraw/zinc/90/62/48/1028906248.db2.gz WHLQNLKRGPQVFC-GOSISDBHSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCCC[C@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816499525 1028908854 /nfs/dbraw/zinc/90/88/54/1028908854.db2.gz SYDOHALJHQYXAD-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(CN2CCCC[C@H]([NH+]3CCCC3)C2)ccc2ccccc21 ZINC000816499525 1028908867 /nfs/dbraw/zinc/90/88/67/1028908867.db2.gz SYDOHALJHQYXAD-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](n3ccnc3)C2)ccc2ccccc21 ZINC000816501933 1028909768 /nfs/dbraw/zinc/90/97/68/1028909768.db2.gz HLBDGABPPZXWAG-KRWDZBQOSA-N 1 1 307.397 3.579 20 10 DHCDMO CC(C)[NH+](CCNCc1ccc2ccccc2c1O)C(C)C ZINC000816528532 1028918876 /nfs/dbraw/zinc/91/88/76/1028918876.db2.gz HGTZUNASPJZGMK-UHFFFAOYSA-N 1 1 300.446 3.754 20 10 DHCDMO C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816529930 1028924262 /nfs/dbraw/zinc/92/42/62/1028924262.db2.gz MPPNUVAPCMCGBU-INIZCTEOSA-N 1 1 312.457 3.900 20 10 DHCDMO C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816529930 1028924269 /nfs/dbraw/zinc/92/42/69/1028924269.db2.gz MPPNUVAPCMCGBU-INIZCTEOSA-N 1 1 312.457 3.900 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816549066 1028930008 /nfs/dbraw/zinc/93/00/08/1028930008.db2.gz CALUBZAXSKDRGM-UHFFFAOYSA-N 1 1 322.811 3.849 20 10 DHCDMO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816560774 1028943711 /nfs/dbraw/zinc/94/37/11/1028943711.db2.gz ZXONJXUZCNSELG-QWHCGFSZSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000816560662 1028946427 /nfs/dbraw/zinc/94/64/27/1028946427.db2.gz WUBZGRFVLGPRIY-OAHLLOKOSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000816560662 1028946438 /nfs/dbraw/zinc/94/64/38/1028946438.db2.gz WUBZGRFVLGPRIY-OAHLLOKOSA-N 1 1 313.800 3.576 20 10 DHCDMO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816574149 1028953270 /nfs/dbraw/zinc/95/32/70/1028953270.db2.gz YORPMDPGPMNIPZ-GOEBONIOSA-N 1 1 315.816 3.868 20 10 DHCDMO C[NH+]1CCC2(CCC[N@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816598405 1028956190 /nfs/dbraw/zinc/95/61/90/1028956190.db2.gz AKNBIIOYBPBTHK-UHFFFAOYSA-N 1 1 324.468 3.853 20 10 DHCDMO C[NH+]1CCC2(CCC[N@@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816598405 1028956203 /nfs/dbraw/zinc/95/62/03/1028956203.db2.gz AKNBIIOYBPBTHK-UHFFFAOYSA-N 1 1 324.468 3.853 20 10 DHCDMO C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816610875 1028960610 /nfs/dbraw/zinc/96/06/10/1028960610.db2.gz BLUWDERIGQOXSN-SFHVURJKSA-N 1 1 324.468 3.709 20 10 DHCDMO C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816610875 1028960619 /nfs/dbraw/zinc/96/06/19/1028960619.db2.gz BLUWDERIGQOXSN-SFHVURJKSA-N 1 1 324.468 3.709 20 10 DHCDMO COCC[N@@H+](Cc1ccccn1)Cc1ccc2ccccc2c1O ZINC000816610350 1028961474 /nfs/dbraw/zinc/96/14/74/1028961474.db2.gz HULLXIUHWAFWHR-UHFFFAOYSA-N 1 1 322.408 3.589 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000816659553 1028980250 /nfs/dbraw/zinc/98/02/50/1028980250.db2.gz SBSVBUHWQYYKSP-MRXNPFEDSA-N 1 1 303.789 3.699 20 10 DHCDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816662385 1028982091 /nfs/dbraw/zinc/98/20/91/1028982091.db2.gz OEHZVPICVWQTLR-FQEVSTJZSA-N 1 1 313.441 3.776 20 10 DHCDMO CCc1nc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)cs1 ZINC000042627450 1029024269 /nfs/dbraw/zinc/02/42/69/1029024269.db2.gz GJDYFLPFFGWWFP-UHFFFAOYSA-N 1 1 303.475 3.794 20 10 DHCDMO CCc1nc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)cs1 ZINC000042627450 1029024287 /nfs/dbraw/zinc/02/42/87/1029024287.db2.gz GJDYFLPFFGWWFP-UHFFFAOYSA-N 1 1 303.475 3.794 20 10 DHCDMO Cc1nc2c(s1)CCC[C@H]2C[NH2+]Cc1cccc(F)c1O ZINC000373506571 1029065626 /nfs/dbraw/zinc/06/56/26/1029065626.db2.gz FGBLWHVPKYAZPW-NSHDSACASA-N 1 1 306.406 3.506 20 10 DHCDMO Cc1ccc(C)c([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938402 1029282035 /nfs/dbraw/zinc/28/20/35/1029282035.db2.gz JVXQTPJLAZEBSH-OXQOHEQNSA-N 1 1 311.473 3.720 20 10 DHCDMO Cc1cc(F)ccc1[C@H](C)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940006 1029282647 /nfs/dbraw/zinc/28/26/47/1029282647.db2.gz DTOJPNWGEQWTLM-IFXJQAMLSA-N 1 1 315.436 3.551 20 10 DHCDMO Cc1cc(C)cc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938504 1029283449 /nfs/dbraw/zinc/28/34/49/1029283449.db2.gz LTSSXHXXEBSJJO-UZLBHIALSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@@H]1C[C@H](NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c2ccccc21 ZINC000817939504 1029283877 /nfs/dbraw/zinc/28/38/77/1029283877.db2.gz BXAWYCGDTJCNOE-XMCHAPAWSA-N 1 1 309.457 3.591 20 10 DHCDMO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C(F)(F)F)c1O ZINC000817956802 1029298317 /nfs/dbraw/zinc/29/83/17/1029298317.db2.gz DDUIOMMWNKPWBW-NSHDSACASA-N 1 1 324.346 3.887 20 10 DHCDMO C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2[O-])cc1 ZINC000817962825 1029300161 /nfs/dbraw/zinc/30/01/61/1029300161.db2.gz LEPRITLMQXQYNM-VXGBXAGGSA-N 1 1 304.821 3.916 20 10 DHCDMO C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2[O-])cc1 ZINC000817962822 1029301008 /nfs/dbraw/zinc/30/10/08/1029301008.db2.gz LEPRITLMQXQYNM-NEPJUHHUSA-N 1 1 304.821 3.916 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000817967030 1029306964 /nfs/dbraw/zinc/30/69/64/1029306964.db2.gz CRJUUHFOUYBZHZ-GTNSWQLSSA-N 1 1 300.377 3.842 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977997 1029318083 /nfs/dbraw/zinc/31/80/83/1029318083.db2.gz SSQOTFQGCUYDHL-MFKMUULPSA-N 1 1 304.356 3.579 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000817985164 1029323327 /nfs/dbraw/zinc/32/33/27/1029323327.db2.gz BJYTZJALLSMJDD-QMCVQRASSA-N 1 1 310.441 3.584 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1[O-] ZINC000817984995 1029323673 /nfs/dbraw/zinc/32/36/73/1029323673.db2.gz DXHOFTYDCUEUEA-DZGCQCFKSA-N 1 1 308.853 3.761 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)c1ccc(Cl)c(Cl)c1[O-] ZINC000530215823 1029785108 /nfs/dbraw/zinc/78/51/08/1029785108.db2.gz JLKGQSYPUOXNTL-BXKDBHETSA-N 1 1 315.244 3.634 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCCc2n[nH]cc2C1 ZINC000828013769 1029813689 /nfs/dbraw/zinc/81/36/89/1029813689.db2.gz KDSAGGVMDQSJCH-UHFFFAOYSA-N 1 1 319.408 3.731 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cn(C3CC3)cn2)c(C)n1-c1ccccc1 ZINC000865643543 1029956744 /nfs/dbraw/zinc/95/67/44/1029956744.db2.gz ZYYKWTFYEJUIJJ-UHFFFAOYSA-N 1 1 320.440 3.915 20 10 DHCDMO Cc1ncc([C@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)s1 ZINC000865701391 1029981037 /nfs/dbraw/zinc/98/10/37/1029981037.db2.gz FCXMQLCYZHQSBD-ZETCQYMHSA-N 1 1 300.786 3.800 20 10 DHCDMO CCCC[N@H+](Cc1nc(C(F)F)no1)Cc1ccccc1O ZINC000823026677 1030194591 /nfs/dbraw/zinc/19/45/91/1030194591.db2.gz ZZOYYFBWBBZUGT-UHFFFAOYSA-N 1 1 311.332 3.515 20 10 DHCDMO CCCC[N@@H+](Cc1nc(C(F)F)no1)Cc1ccccc1O ZINC000823026677 1030194600 /nfs/dbraw/zinc/19/46/00/1030194600.db2.gz ZZOYYFBWBBZUGT-UHFFFAOYSA-N 1 1 311.332 3.515 20 10 DHCDMO COCCc1cc[nH+]c(N[C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841758726 1030233285 /nfs/dbraw/zinc/23/32/85/1030233285.db2.gz UULZHICOSYRBHJ-LLVKDONJSA-N 1 1 306.793 3.803 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)cs1 ZINC000823387355 1030274592 /nfs/dbraw/zinc/27/45/92/1030274592.db2.gz YJGZSHMPCZVZPO-KRWDZBQOSA-N 1 1 317.454 3.943 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000866518243 1030342158 /nfs/dbraw/zinc/34/21/58/1030342158.db2.gz VSPWEWFMJHLMAZ-CECOHMBGSA-N 1 1 320.452 3.932 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1 ZINC000866543997 1030366009 /nfs/dbraw/zinc/36/60/09/1030366009.db2.gz DDXDVPANLRLTSO-JTQLQIEISA-N 1 1 315.360 3.511 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000866596478 1030389221 /nfs/dbraw/zinc/38/92/21/1030389221.db2.gz MQIHVEBRYFAMDY-BDJLRTHQSA-N 1 1 307.340 3.901 20 10 DHCDMO COc1cccc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000866596128 1030389962 /nfs/dbraw/zinc/38/99/62/1030389962.db2.gz BFGSRMKDYKNFHZ-XHDPSFHLSA-N 1 1 307.340 3.901 20 10 DHCDMO CC[C@H](C[C@H](C)O)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000866632630 1030413777 /nfs/dbraw/zinc/41/37/77/1030413777.db2.gz AHRFTXSMBWTPNB-HBNTYKKESA-N 1 1 305.340 3.611 20 10 DHCDMO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1c(O)cccc1Cl)CCC2 ZINC000824176351 1030493056 /nfs/dbraw/zinc/49/30/56/1030493056.db2.gz MVQHPIAVFNDDPQ-OAHLLOKOSA-N 1 1 319.836 3.990 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@](C)(COC)C2)cc1F ZINC000824583770 1030594886 /nfs/dbraw/zinc/59/48/86/1030594886.db2.gz QIOBCSNSXNABAU-SFHVURJKSA-N 1 1 308.441 3.530 20 10 DHCDMO Cn1ccnc1[C@H]1[N@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824620481 1030603433 /nfs/dbraw/zinc/60/34/33/1030603433.db2.gz QNPOAXPFFAETRJ-GOSISDBHSA-N 1 1 321.424 3.862 20 10 DHCDMO Cn1ccnc1[C@H]1[N@@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824620481 1030603443 /nfs/dbraw/zinc/60/34/43/1030603443.db2.gz QNPOAXPFFAETRJ-GOSISDBHSA-N 1 1 321.424 3.862 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1 ZINC000824716403 1030619325 /nfs/dbraw/zinc/61/93/25/1030619325.db2.gz UFPNFZRJMSDCQK-DGCLKSJQSA-N 1 1 317.351 3.954 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c(O)c1 ZINC000824714264 1030620037 /nfs/dbraw/zinc/62/00/37/1030620037.db2.gz AVMXGGMDPNFONK-AAEUAGOBSA-N 1 1 317.351 3.954 20 10 DHCDMO CC[N@@H+](Cc1ccccn1)Cc1ccc(Br)cc1O ZINC000824783570 1030651718 /nfs/dbraw/zinc/65/17/18/1030651718.db2.gz WATIBHGORDTYQA-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO CSCC[C@H](C)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000824843511 1030660345 /nfs/dbraw/zinc/66/03/45/1030660345.db2.gz PKAACWRDQFBCEA-JTQLQIEISA-N 1 1 318.280 3.728 20 10 DHCDMO CCC1([NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CCCCC1 ZINC000824925701 1030673570 /nfs/dbraw/zinc/67/35/70/1030673570.db2.gz CZXDAZBPZXKQPX-UHFFFAOYSA-N 1 1 308.378 3.512 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cn(C)cn2)c(C)n1-c1ccccc1 ZINC000926763658 1030912186 /nfs/dbraw/zinc/91/21/86/1030912186.db2.gz DKCQDGBDDZPJEA-HNNXBMFYSA-N 1 1 308.429 3.678 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926904402 1030978975 /nfs/dbraw/zinc/97/89/75/1030978975.db2.gz HKGWJGNZXUIRRF-CHIMOYNISA-N 1 1 321.314 3.682 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC34CCCC4)cc2)CC1 ZINC000844361216 1031082944 /nfs/dbraw/zinc/08/29/44/1031082944.db2.gz XQPFZXLZZFDMPT-UHFFFAOYSA-N 1 1 314.473 3.820 20 10 DHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1ccc(F)cc1 ZINC000123499378 1031144129 /nfs/dbraw/zinc/14/41/29/1031144129.db2.gz BAEUCQGZSBHYPJ-UHFFFAOYSA-N 1 1 311.360 3.621 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2cc(C)c(C)cc2O)C(C)C)cn1 ZINC000844738425 1031320829 /nfs/dbraw/zinc/32/08/29/1031320829.db2.gz PAGWQKFXJZXHNM-UHFFFAOYSA-N 1 1 301.434 3.636 20 10 DHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)[C@@H]1C ZINC001144299929 1031438995 /nfs/dbraw/zinc/43/89/95/1031438995.db2.gz MSAOKQJMXDQYFT-NXEZZACHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@@H]1C ZINC001144299929 1031439004 /nfs/dbraw/zinc/43/90/04/1031439004.db2.gz MSAOKQJMXDQYFT-NXEZZACHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2[O-])C2(CC2)C1 ZINC001144308128 1031458762 /nfs/dbraw/zinc/45/87/62/1031458762.db2.gz QOZNOZJSTNWCON-SECBINFHSA-N 1 1 314.198 3.668 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)C2(CC2)C1 ZINC001144308128 1031458778 /nfs/dbraw/zinc/45/87/78/1031458778.db2.gz QOZNOZJSTNWCON-SECBINFHSA-N 1 1 314.198 3.668 20 10 DHCDMO CCc1onc(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000929295962 1031487522 /nfs/dbraw/zinc/48/75/22/1031487522.db2.gz NJEACDBADNJWIB-UHFFFAOYSA-N 1 1 313.445 3.776 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](n3ccnc3C(C)C)C2)c1O ZINC000360792046 1031562233 /nfs/dbraw/zinc/56/22/33/1031562233.db2.gz SNIYYJFOEVATFH-KRWDZBQOSA-N 1 1 313.445 3.858 20 10 DHCDMO Cc1nc(C)c(C[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000293758999 1031606896 /nfs/dbraw/zinc/60/68/96/1031606896.db2.gz YWIXSHXJVRTLEQ-UHFFFAOYSA-N 1 1 300.786 3.548 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c1 ZINC000872721186 1031648494 /nfs/dbraw/zinc/64/84/94/1031648494.db2.gz CVVVSILHDMVGFE-JSGCOSHPSA-N 1 1 321.486 3.580 20 10 DHCDMO COC/C(C)=C/C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000929970062 1031663596 /nfs/dbraw/zinc/66/35/96/1031663596.db2.gz HTLHLNVGQRSXCU-OQLLNIDSSA-N 1 1 301.386 3.580 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c(O)c1 ZINC001144514657 1031672857 /nfs/dbraw/zinc/67/28/57/1031672857.db2.gz NTUXITJIHYVDLR-HNNXBMFYSA-N 1 1 313.397 3.573 20 10 DHCDMO CCCOc1ccc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000873014456 1031693903 /nfs/dbraw/zinc/69/39/03/1031693903.db2.gz RONAPINCOHFKHW-ZWKOTPCHSA-N 1 1 302.462 3.500 20 10 DHCDMO CCCOc1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C ZINC000873014456 1031693915 /nfs/dbraw/zinc/69/39/15/1031693915.db2.gz RONAPINCOHFKHW-ZWKOTPCHSA-N 1 1 302.462 3.500 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1 ZINC000294011005 1031752729 /nfs/dbraw/zinc/75/27/29/1031752729.db2.gz UHNXKQABTOXYPC-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO C[C@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)C[C@@]1(F)Cl ZINC000846032077 1031825212 /nfs/dbraw/zinc/82/52/12/1031825212.db2.gz CQDKSWNNAPBOJC-STQMWFEESA-N 1 1 310.171 3.979 20 10 DHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@](C)(O)c1ccccc1 ZINC000846045923 1031838852 /nfs/dbraw/zinc/83/88/52/1031838852.db2.gz XFYMAOVOKKPXMH-APPDUMDISA-N 1 1 323.795 3.571 20 10 DHCDMO C[C@@H](CCO)[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000846111462 1031864057 /nfs/dbraw/zinc/86/40/57/1031864057.db2.gz PKGIGBNLVALDFA-HNNXBMFYSA-N 1 1 318.486 3.587 20 10 DHCDMO FC(F)O[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000781531452 1031870953 /nfs/dbraw/zinc/87/09/53/1031870953.db2.gz CFAAEXTVDPICEK-QGZVFWFLSA-N 1 1 324.415 3.881 20 10 DHCDMO C[C@H]([NH2+]CCC1(CO)CCC1)c1cccc(C(F)(F)F)c1O ZINC000846211133 1031909390 /nfs/dbraw/zinc/90/93/90/1031909390.db2.gz TVBFDBAJJKWAKY-NSHDSACASA-N 1 1 317.351 3.614 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000877516610 1033329625 /nfs/dbraw/zinc/32/96/25/1033329625.db2.gz GYAPVKDWLIOIKB-AABGKKOBSA-N 1 1 323.436 3.705 20 10 DHCDMO CCC(CC)[N@@H+](CC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877536233 1033342921 /nfs/dbraw/zinc/34/29/21/1033342921.db2.gz MFTVUSOGCYRHLU-UHFFFAOYSA-N 1 1 304.478 3.658 20 10 DHCDMO Oc1cccc2c1C[N@H+](Cc1c(F)cccc1N1CCCC1)C2 ZINC000877703501 1033417471 /nfs/dbraw/zinc/41/74/71/1033417471.db2.gz MGRBMGYDJWLKCA-UHFFFAOYSA-N 1 1 312.388 3.647 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1c(F)cccc1N1CCCC1)C2 ZINC000877703501 1033417479 /nfs/dbraw/zinc/41/74/79/1033417479.db2.gz MGRBMGYDJWLKCA-UHFFFAOYSA-N 1 1 312.388 3.647 20 10 DHCDMO Cc1csc([C@H]2CC[N@H+](Cc3ccc(N(C)C)cc3)C2)n1 ZINC000877813866 1033465642 /nfs/dbraw/zinc/46/56/42/1033465642.db2.gz PQZAXODIZGJYDI-HNNXBMFYSA-N 1 1 301.459 3.507 20 10 DHCDMO Cc1csc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)cc3)C2)n1 ZINC000877813868 1033466329 /nfs/dbraw/zinc/46/63/29/1033466329.db2.gz PQZAXODIZGJYDI-OAHLLOKOSA-N 1 1 301.459 3.507 20 10 DHCDMO CC[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCOC1)c1ccc(F)cc1O ZINC000927070457 1033517999 /nfs/dbraw/zinc/51/79/99/1033517999.db2.gz SDIXUFXESQFFOJ-RPVQJOFSSA-N 1 1 307.409 3.777 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1cc(F)cc(F)c1O ZINC000927102299 1033718267 /nfs/dbraw/zinc/71/82/67/1033718267.db2.gz RZXDPYQEQOJBDW-QWRGUYRKSA-N 1 1 313.388 3.915 20 10 DHCDMO C[C@@H]([NH2+]Cc1cscn1)c1ccc(N2CCCCC2)cc1 ZINC000127276799 1033791785 /nfs/dbraw/zinc/79/17/85/1033791785.db2.gz ZNVQDFNBNRUJOR-CQSZACIVSA-N 1 1 301.459 3.984 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1F ZINC000862367124 1033831607 /nfs/dbraw/zinc/83/16/07/1033831607.db2.gz WUUDFVYQVXBKJC-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1F ZINC000862367124 1033831618 /nfs/dbraw/zinc/83/16/18/1033831618.db2.gz WUUDFVYQVXBKJC-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1F ZINC000862376674 1033834773 /nfs/dbraw/zinc/83/47/73/1033834773.db2.gz ZLTYYSPURNQGRI-CABCVRRESA-N 1 1 316.342 3.508 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1F ZINC000862376674 1033834784 /nfs/dbraw/zinc/83/47/84/1033834784.db2.gz ZLTYYSPURNQGRI-CABCVRRESA-N 1 1 316.342 3.508 20 10 DHCDMO CN(C)c1cc(F)c(C[NH+]2CCC3(CC3(F)F)CC2)cc1F ZINC000862402846 1033843225 /nfs/dbraw/zinc/84/32/25/1033843225.db2.gz LDXBOWIHMGBBKP-UHFFFAOYSA-N 1 1 316.342 3.652 20 10 DHCDMO Cc1cc(Br)c(O)c(Cn2c[nH+]c3c2CCCC3)c1 ZINC000862431901 1033849837 /nfs/dbraw/zinc/84/98/37/1033849837.db2.gz VIUIGPKWTZDIOQ-UHFFFAOYSA-N 1 1 321.218 3.587 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000862476392 1033861180 /nfs/dbraw/zinc/86/11/80/1033861180.db2.gz SAVUNZGRDGMCNC-VQIMIIECSA-N 1 1 316.489 3.833 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000119327205 1034022199 /nfs/dbraw/zinc/02/21/99/1034022199.db2.gz MYGISYTUWDYUBU-UHFFFAOYSA-N 1 1 324.468 3.797 20 10 DHCDMO C[C@@H]1CC[C@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CN1 ZINC000863546197 1034125397 /nfs/dbraw/zinc/12/53/97/1034125397.db2.gz JVCWQLCTSPOPHT-KPFFTGBYSA-N 1 1 324.468 3.796 20 10 DHCDMO C[C@@H]1CC[C@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2O)CN1 ZINC000863546192 1034127175 /nfs/dbraw/zinc/12/71/75/1034127175.db2.gz JVCWQLCTSPOPHT-IMFGXOCKSA-N 1 1 324.468 3.796 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1Cl ZINC000826142374 1034210149 /nfs/dbraw/zinc/21/01/49/1034210149.db2.gz ANQVFCYMLSQKMW-AWEZNQCLSA-N 1 1 301.764 3.975 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1OC ZINC000179476096 1034310631 /nfs/dbraw/zinc/31/06/31/1034310631.db2.gz LSTZAZNNTNSZAG-MRXNPFEDSA-N 1 1 313.397 3.529 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2O)cc1OC ZINC000179555395 1034316165 /nfs/dbraw/zinc/31/61/65/1034316165.db2.gz KYZCNFCYKASZQD-INIZCTEOSA-N 1 1 313.397 3.747 20 10 DHCDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183714967 1034414711 /nfs/dbraw/zinc/41/47/11/1034414711.db2.gz SWAXYAKWXZUVPY-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)o1 ZINC000185676908 1034564365 /nfs/dbraw/zinc/56/43/65/1034564365.db2.gz IJGUFAPXRXAUFB-OAHLLOKOSA-N 1 1 305.349 3.608 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185838366 1034577090 /nfs/dbraw/zinc/57/70/90/1034577090.db2.gz DQDTVXJGAMOLOS-BWACUDIHSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccc(F)cc1O ZINC000186507569 1034639462 /nfs/dbraw/zinc/63/94/62/1034639462.db2.gz QVBYGQWESSMMMP-GFCCVEGCSA-N 1 1 318.392 3.954 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cc(F)ccc1O ZINC000186819442 1034663570 /nfs/dbraw/zinc/66/35/70/1034663570.db2.gz APXZDULMSLPUIZ-NSHDSACASA-N 1 1 322.380 3.685 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)on1 ZINC000192830698 1034820047 /nfs/dbraw/zinc/82/00/47/1034820047.db2.gz MRESCJYAOBVXQB-QMMMGPOBSA-N 1 1 301.173 3.846 20 10 DHCDMO Cc1ccccc1[C@@H](CO)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001176176046 1035212449 /nfs/dbraw/zinc/21/24/49/1035212449.db2.gz OPFBXWOWTXRQJQ-HXUWFJFHSA-N 1 1 312.457 3.535 20 10 DHCDMO Cc1cc([C@H]2CCCC[N@@H+]2Cc2ccc(N(C)C)c(C)c2)[nH]n1 ZINC001176484121 1035278278 /nfs/dbraw/zinc/27/82/78/1035278278.db2.gz ANQNPJKOKJTDFI-LJQANCHMSA-N 1 1 312.461 3.820 20 10 DHCDMO CC(C)[NH+](CCCNC/C=C/c1ccc(N(C)C)cc1)C(C)C ZINC001177948025 1035402529 /nfs/dbraw/zinc/40/25/29/1035402529.db2.gz DJFHCVRAWPZPLZ-VQHVLOKHSA-N 1 1 317.521 3.864 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)cc1 ZINC000773765445 1035443261 /nfs/dbraw/zinc/44/32/61/1035443261.db2.gz KBNMZJXKNDFVRW-MRXNPFEDSA-N 1 1 312.457 3.911 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042931 1035573400 /nfs/dbraw/zinc/57/34/00/1035573400.db2.gz MLJGNIROTSASLE-DVOMOZLQSA-N 1 1 324.415 3.508 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042931 1035573404 /nfs/dbraw/zinc/57/34/04/1035573404.db2.gz MLJGNIROTSASLE-DVOMOZLQSA-N 1 1 324.415 3.508 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001180052869 1035577171 /nfs/dbraw/zinc/57/71/71/1035577171.db2.gz WEIGVBXWAGLEDE-NVXWUHKLSA-N 1 1 307.459 3.569 20 10 DHCDMO COc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247834 1035592228 /nfs/dbraw/zinc/59/22/28/1035592228.db2.gz AMLLGETVDJYYPA-FUHWJXTLSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC001193247834 1035592235 /nfs/dbraw/zinc/59/22/35/1035592235.db2.gz AMLLGETVDJYYPA-FUHWJXTLSA-N 1 1 316.489 3.746 20 10 DHCDMO COc1ccc(CN[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001193247834 1035592243 /nfs/dbraw/zinc/59/22/43/1035592243.db2.gz AMLLGETVDJYYPA-FUHWJXTLSA-N 1 1 316.489 3.746 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(N(C)CC)cc2)o1 ZINC000773838930 1035597984 /nfs/dbraw/zinc/59/79/84/1035597984.db2.gz ODAHYCBWQMKASH-GOSISDBHSA-N 1 1 316.445 3.775 20 10 DHCDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1c(O)ccc2ccncc21 ZINC000905746862 1035622286 /nfs/dbraw/zinc/62/22/86/1035622286.db2.gz XZEKANNHERYGEX-UHFFFAOYSA-N 1 1 321.424 3.994 20 10 DHCDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632878 1036121421 /nfs/dbraw/zinc/12/14/21/1036121421.db2.gz CRLKXQFQEZNMHO-FQEVSTJZSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(C)N1CC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632878 1036121432 /nfs/dbraw/zinc/12/14/32/1036121432.db2.gz CRLKXQFQEZNMHO-FQEVSTJZSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(C)N1CC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632878 1036121450 /nfs/dbraw/zinc/12/14/50/1036121450.db2.gz CRLKXQFQEZNMHO-FQEVSTJZSA-N 1 1 315.505 3.591 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)c1O ZINC001182271606 1036161615 /nfs/dbraw/zinc/16/16/15/1036161615.db2.gz JFUOJHHFWMKXSO-CQSZACIVSA-N 1 1 317.404 3.911 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)cc1 ZINC000775643091 1036162289 /nfs/dbraw/zinc/16/22/89/1036162289.db2.gz LPZFLUBJEPHUSH-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO CCN(CC)CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774112670 1036170520 /nfs/dbraw/zinc/17/05/20/1036170520.db2.gz SCFWAGLFMHCEPU-JTQLQIEISA-N 1 1 305.249 3.691 20 10 DHCDMO C[N@@H+](CCOc1ccc(F)cc1)Cc1cccc(Cl)c1[O-] ZINC000775647332 1036175016 /nfs/dbraw/zinc/17/50/16/1036175016.db2.gz SBMCPISTXKHUOP-UHFFFAOYSA-N 1 1 309.768 3.696 20 10 DHCDMO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CCCC[C@H]1C ZINC001195358062 1036228057 /nfs/dbraw/zinc/22/80/57/1036228057.db2.gz KCKWXYFIFGUPRR-HZPDHXFCSA-N 1 1 319.445 3.584 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCc3ccc(O)cc3C2)c1O ZINC000775656442 1036248785 /nfs/dbraw/zinc/24/87/85/1036248785.db2.gz UREWUPKURQCAMU-UHFFFAOYSA-N 1 1 303.789 3.618 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)on1 ZINC000775656067 1036250326 /nfs/dbraw/zinc/25/03/26/1036250326.db2.gz OAKZJZRYKVDNFA-CQSZACIVSA-N 1 1 306.793 3.988 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774266041 1036265212 /nfs/dbraw/zinc/26/52/12/1036265212.db2.gz NEJJTIXEQZPUGK-PSASIEDQSA-N 1 1 304.217 3.511 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1O ZINC000775660258 1036266967 /nfs/dbraw/zinc/26/69/67/1036266967.db2.gz DPIKMEXOUKALJM-LJQANCHMSA-N 1 1 311.425 3.882 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@@H](O)C1(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774360997 1036298017 /nfs/dbraw/zinc/29/80/17/1036298017.db2.gz WJWNYCIHACPYBV-HAGUPOPPSA-N 1 1 304.217 3.509 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)CCC(C)(C)C2CC2)cc1 ZINC001195790938 1036347271 /nfs/dbraw/zinc/34/72/71/1036347271.db2.gz WMCJNSMXCNVONC-UHFFFAOYSA-N 1 1 304.478 3.890 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001203561156 1036549510 /nfs/dbraw/zinc/54/95/10/1036549510.db2.gz MMNBMMAFJQSRMW-INIZCTEOSA-N 1 1 303.402 3.898 20 10 DHCDMO C[N@H+](Cc1nccn1C(F)F)Cc1c(O)ccc2ccccc21 ZINC000029886861 1036554959 /nfs/dbraw/zinc/55/49/59/1036554959.db2.gz NAAKSJLPMXGCTP-UHFFFAOYSA-N 1 1 317.339 3.769 20 10 DHCDMO C[N@@H+](Cc1nccn1C(F)F)Cc1c(O)ccc2ccccc21 ZINC000029886861 1036554974 /nfs/dbraw/zinc/55/49/74/1036554974.db2.gz NAAKSJLPMXGCTP-UHFFFAOYSA-N 1 1 317.339 3.769 20 10 DHCDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC001183875779 1036690150 /nfs/dbraw/zinc/69/01/50/1036690150.db2.gz HJFLGJHBGCWJLU-IAGOWNOFSA-N 1 1 316.489 3.516 20 10 DHCDMO COc1cc(C)c(C[N@@H+]2CCc3cc(F)cc(F)c3C2)c(O)c1 ZINC001184418887 1036843361 /nfs/dbraw/zinc/84/33/61/1036843361.db2.gz SZMBEBZMQPPISR-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCc3cc(F)cc(F)c3C2)c(O)c1 ZINC001184418887 1036843377 /nfs/dbraw/zinc/84/33/77/1036843377.db2.gz SZMBEBZMQPPISR-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1O ZINC000246586325 1036877745 /nfs/dbraw/zinc/87/77/45/1036877745.db2.gz MIKWNZJYNUCDAF-GDBMZVCRSA-N 1 1 307.459 3.569 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)cn1 ZINC000153679904 1037133724 /nfs/dbraw/zinc/13/37/24/1037133724.db2.gz MGGBKLSYPBOCEC-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)cn1 ZINC000153679904 1037133734 /nfs/dbraw/zinc/13/37/34/1037133734.db2.gz MGGBKLSYPBOCEC-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO CC[C@H](C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879606 1037155083 /nfs/dbraw/zinc/15/50/83/1037155083.db2.gz JGTMWLMJSBYCPW-NWDGAFQWSA-N 1 1 322.405 3.708 20 10 DHCDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879606 1037155088 /nfs/dbraw/zinc/15/50/88/1037155088.db2.gz JGTMWLMJSBYCPW-NWDGAFQWSA-N 1 1 322.405 3.708 20 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/nfs/dbraw/zinc/81/93/60/1037819360.db2.gz OLMOXBMGSYJNOO-IBGZPJMESA-N 1 1 303.446 3.611 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2nnc(C)s2)cc1 ZINC001201954018 1037952123 /nfs/dbraw/zinc/95/21/23/1037952123.db2.gz DTLMQNBEJUJOCR-UHFFFAOYSA-N 1 1 318.490 3.763 20 10 DHCDMO C[C@H](CSc1ncc(C(C)(C)C)s1)C[NH+]1CCOCC1 ZINC001188942804 1038017038 /nfs/dbraw/zinc/01/70/38/1038017038.db2.gz UKLAUGSWVDJMAQ-LBPRGKRZSA-N 1 1 314.520 3.501 20 10 DHCDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000164596072 1038232526 /nfs/dbraw/zinc/23/25/26/1038232526.db2.gz GEXFHBNDXUBZEU-MRXNPFEDSA-N 1 1 319.445 3.564 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)c1 ZINC000775371080 1038282883 /nfs/dbraw/zinc/28/28/83/1038282883.db2.gz SQNCTYCWZAYGSM-LLVKDONJSA-N 1 1 304.390 3.537 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccccc1O ZINC000775487344 1038557280 /nfs/dbraw/zinc/55/72/80/1038557280.db2.gz LYQPETDPFYDVAY-IEBWSBKVSA-N 1 1 321.424 3.956 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000760881008 1038957898 /nfs/dbraw/zinc/95/78/98/1038957898.db2.gz LAGUCBZKLAGBLR-RYUDHWBXSA-N 1 1 304.463 3.714 20 10 DHCDMO C[C@@H]([NH2+]CCCn1cnc2ccccc21)c1ccc(F)cc1O ZINC000170788935 1038979674 /nfs/dbraw/zinc/97/96/74/1038979674.db2.gz UBZGLDRKFRLVME-CYBMUJFWSA-N 1 1 313.376 3.622 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000172484947 1039919692 /nfs/dbraw/zinc/91/96/92/1039919692.db2.gz MGQZZQYPUZTVAT-QGZVFWFLSA-N 1 1 310.441 3.606 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)C2Cc3ccccc3C2)c1O ZINC000761194705 1040554768 /nfs/dbraw/zinc/55/47/68/1040554768.db2.gz FKPVYSDROLLINM-UHFFFAOYSA-N 1 1 317.816 3.653 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3ccccc3C2)c1O ZINC000228560954 1040942569 /nfs/dbraw/zinc/94/25/69/1040942569.db2.gz PTYYBBJBQZWGDG-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CCC[N@@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccccc1O ZINC000092705074 185334413 /nfs/dbraw/zinc/33/44/13/185334413.db2.gz BQNWNCMOEZUGER-UHFFFAOYSA-N 1 1 301.434 3.756 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccccc1NC(C)=O ZINC000092705056 185334432 /nfs/dbraw/zinc/33/44/32/185334432.db2.gz ZNTFKGRCYVYNKX-UHFFFAOYSA-N 1 1 312.413 3.763 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1OC(F)F ZINC000091956821 193133343 /nfs/dbraw/zinc/13/33/43/193133343.db2.gz BWZMCWQHUQAENG-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@@H](C)c1cccc(O)c1 ZINC000091975175 193134859 /nfs/dbraw/zinc/13/48/59/193134859.db2.gz YNJMLFRGEDNBFP-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(OCC)ccc2O)CC1 ZINC000093317580 193230625 /nfs/dbraw/zinc/23/06/25/193230625.db2.gz DCMFKXVOVWBJRO-INIZCTEOSA-N 1 1 307.434 3.572 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(F)cc1O ZINC000062745233 184252156 /nfs/dbraw/zinc/25/21/56/184252156.db2.gz ZETPFIUTIRZRGS-BXUZGUMPSA-N 1 1 308.422 3.546 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3occc32)c1 ZINC000273437053 130122652 /nfs/dbraw/zinc/12/26/52/130122652.db2.gz XDTOITOLTNSCCF-ABAIWWIYSA-N 1 1 315.369 3.500 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273491837 130128530 /nfs/dbraw/zinc/12/85/30/130128530.db2.gz NKXPKYACSRHRPX-MJGOQNOKSA-N 1 1 315.388 3.883 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](C)C2CCC(F)(F)CC2)c1O ZINC000286739855 131248292 /nfs/dbraw/zinc/24/82/92/131248292.db2.gz HXUCWVIFEIAKQB-UHFFFAOYSA-N 1 1 315.335 3.744 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000286739855 131248293 /nfs/dbraw/zinc/24/82/93/131248293.db2.gz HXUCWVIFEIAKQB-UHFFFAOYSA-N 1 1 315.335 3.744 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](C)CCCO)c1cc(Cl)c(Cl)cc1O ZINC000296603853 335145053 /nfs/dbraw/zinc/14/50/53/335145053.db2.gz VUBRYISNAHBVKN-VHSXEESVSA-N 1 1 306.233 3.758 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCCC[C@H]1C[C@@H](O)c1ccco1 ZINC000305750355 337035608 /nfs/dbraw/zinc/03/56/08/337035608.db2.gz ZHUKPQQIOQOBHJ-FUHWJXTLSA-N 1 1 315.413 3.854 20 10 DHCDMO Cc1cccc(-c2nnc([C@H](C)[N@H+](C)Cc3ccccc3O)o2)c1 ZINC000377600654 337055887 /nfs/dbraw/zinc/05/58/87/337055887.db2.gz KEVQJPFSKIBUTG-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO Cc1cccc(-c2nnc([C@H](C)[N@@H+](C)Cc3ccccc3O)o2)c1 ZINC000377600654 337055888 /nfs/dbraw/zinc/05/58/88/337055888.db2.gz KEVQJPFSKIBUTG-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO CN(C)c1ccc(C[NH2+]C[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000377757670 337060252 /nfs/dbraw/zinc/06/02/52/337060252.db2.gz AIZJDMGEGGNQFS-FPOVZHCZSA-N 1 1 323.484 3.535 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1C ZINC000184807812 337200347 /nfs/dbraw/zinc/20/03/47/337200347.db2.gz JLHWZUMLTSVZHE-HXUWFJFHSA-N 1 1 309.409 3.640 20 10 DHCDMO Cc1nnc([C@@H]([NH2+][C@@H](C)c2cc(C)ccc2O)c2ccccc2)[nH]1 ZINC000185324296 337205111 /nfs/dbraw/zinc/20/51/11/337205111.db2.gz PHTWMGYRCBXIHW-UGSOOPFHSA-N 1 1 322.412 3.567 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186442304 337256140 /nfs/dbraw/zinc/25/61/40/337256140.db2.gz YYTVNGZFEUVKNQ-SFHVURJKSA-N 1 1 315.800 3.677 20 10 DHCDMO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+](C)Cc1ccccc1O ZINC000109773457 337388480 /nfs/dbraw/zinc/38/84/80/337388480.db2.gz FBXVZQQVHBWLFD-CYBMUJFWSA-N 1 1 309.369 3.635 20 10 DHCDMO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)Cc1ccccc1O ZINC000109773457 337388481 /nfs/dbraw/zinc/38/84/81/337388481.db2.gz FBXVZQQVHBWLFD-CYBMUJFWSA-N 1 1 309.369 3.635 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ncc(C)s2)cc1F ZINC000266192081 520909300 /nfs/dbraw/zinc/90/93/00/520909300.db2.gz YUYWYMDFEQBGNL-UHFFFAOYSA-N 1 1 307.438 3.727 20 10 DHCDMO CC[N@@H+](Cc1ccc(COC)o1)Cc1ccc(N(C)C)cc1 ZINC000156836991 521307675 /nfs/dbraw/zinc/30/76/75/521307675.db2.gz GMSOPZPRMFKPRU-UHFFFAOYSA-N 1 1 302.418 3.514 20 10 DHCDMO COC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000156409201 522766253 /nfs/dbraw/zinc/76/62/53/522766253.db2.gz JANBNDDGMSFOQW-PBHICJAKSA-N 1 1 302.418 3.692 20 10 DHCDMO COc1cc(O)c(C[N@@H+](Cc2cccs2)C2CC2)cc1OC ZINC000158851147 522774168 /nfs/dbraw/zinc/77/41/68/522774168.db2.gz JGKCIDPIWIZVNN-UHFFFAOYSA-N 1 1 319.426 3.636 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)c1 ZINC000180154072 524732623 /nfs/dbraw/zinc/73/26/23/524732623.db2.gz GMQJVKVEWLFQHT-NSHDSACASA-N 1 1 306.431 3.667 20 10 DHCDMO C[C@@H]1[N@H+](Cc2c(O)ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780833 525547108 /nfs/dbraw/zinc/54/71/08/525547108.db2.gz XFXBLFRYSAXMMC-NSHDSACASA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@@H]1[N@@H+](Cc2c(O)ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780833 525547111 /nfs/dbraw/zinc/54/71/11/525547111.db2.gz XFXBLFRYSAXMMC-NSHDSACASA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000365664661 526346166 /nfs/dbraw/zinc/34/61/66/526346166.db2.gz WJJFBCCQXBZUJX-HOTGVXAUSA-N 1 1 307.821 3.579 20 10 DHCDMO CCCCc1noc(C[N@H+](CCC)Cc2ccccc2O)n1 ZINC000299628858 535119911 /nfs/dbraw/zinc/11/99/11/535119911.db2.gz 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1013377669 /nfs/dbraw/zinc/37/76/69/1013377669.db2.gz CYURPFHMYNVYSC-MEDUHNTESA-N 1 1 304.340 3.649 20 10 DHCDMO CC(C)(CO)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000894578473 1013420608 /nfs/dbraw/zinc/42/06/08/1013420608.db2.gz LFADUJHVJWPLTC-QGZVFWFLSA-N 1 1 321.367 3.520 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c(O)cc1C ZINC000160435572 1014068002 /nfs/dbraw/zinc/06/80/02/1014068002.db2.gz ACXBKGLLHLOUJW-QGZVFWFLSA-N 1 1 312.413 3.750 20 10 DHCDMO COc1ccc(F)cc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000726980634 1014318644 /nfs/dbraw/zinc/31/86/44/1014318644.db2.gz CKPCGUXALOFBHZ-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(O)c1OC ZINC000891477200 1015311383 /nfs/dbraw/zinc/31/13/83/1015311383.db2.gz CWWQUQJZAKSKAA-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)c(O)c1OC ZINC000891498658 1015329288 /nfs/dbraw/zinc/32/92/88/1015329288.db2.gz KRSRJIVLVMAHRL-ZDUSSCGKSA-N 1 1 319.426 3.808 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccs2)c(O)c1OC ZINC000891639906 1015477300 /nfs/dbraw/zinc/47/73/00/1015477300.db2.gz JUWDOXGNVDCOBC-LLVKDONJSA-N 1 1 307.415 3.664 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001140464445 1015507195 /nfs/dbraw/zinc/50/71/95/1015507195.db2.gz QCZRSTWPEPUJMX-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001140464445 1015507204 /nfs/dbraw/zinc/50/72/04/1015507204.db2.gz QCZRSTWPEPUJMX-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO CCc1cccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)c1O ZINC000896422361 1015580744 /nfs/dbraw/zinc/58/07/44/1015580744.db2.gz AUAQSAWAUNZTNG-WBVHZDCISA-N 1 1 301.361 3.516 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000896639605 1015693267 /nfs/dbraw/zinc/69/32/67/1015693267.db2.gz XCSGCYRYUYUPSP-DZGCQCFKSA-N 1 1 300.377 3.742 20 10 DHCDMO Cn1cc(C[NH2+]Cc2c(O)cccc2F)c(C2CCCCC2)n1 ZINC000896636230 1015693546 /nfs/dbraw/zinc/69/35/46/1015693546.db2.gz AYLDGKLOYDUSFQ-UHFFFAOYSA-N 1 1 317.408 3.602 20 10 DHCDMO CC(C)c1ccc(C[NH2+]Cc2c(O)cccc2F)cc1[N+](=O)[O-] ZINC000896641070 1015695259 /nfs/dbraw/zinc/69/52/59/1015695259.db2.gz OIEQPUXDHMBUFV-UHFFFAOYSA-N 1 1 318.348 3.853 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c(C)n1 ZINC000892013252 1016108386 /nfs/dbraw/zinc/10/83/86/1016108386.db2.gz UJLXXNVFTBXNET-UHFFFAOYSA-N 1 1 313.445 3.862 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c1O ZINC000399575830 1016167881 /nfs/dbraw/zinc/16/78/81/1016167881.db2.gz HWNRMLLLBUYZHS-QJPTWQEYSA-N 1 1 312.251 3.939 20 10 DHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)[nH]1 ZINC000277324755 1016204804 /nfs/dbraw/zinc/20/48/04/1016204804.db2.gz TZYBGCRVOQRAFP-GARJFASQSA-N 1 1 306.385 3.575 20 10 DHCDMO Cn1nccc1[C@H]1CCCCN1Cc1cccc(Cl)c1[O-] ZINC000281223241 1016403903 /nfs/dbraw/zinc/40/39/03/1016403903.db2.gz KLQKCTHNPRECFY-OAHLLOKOSA-N 1 1 305.809 3.506 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000247034324 1016694961 /nfs/dbraw/zinc/69/49/61/1016694961.db2.gz NUKDMQHPCQVNDV-QZTJIDSGSA-N 1 1 317.521 3.914 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000247034324 1016694965 /nfs/dbraw/zinc/69/49/65/1016694965.db2.gz NUKDMQHPCQVNDV-QZTJIDSGSA-N 1 1 317.521 3.914 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000247034324 1016694974 /nfs/dbraw/zinc/69/49/74/1016694974.db2.gz NUKDMQHPCQVNDV-QZTJIDSGSA-N 1 1 317.521 3.914 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccc(F)cc1O ZINC000185233619 1016777370 /nfs/dbraw/zinc/77/73/70/1016777370.db2.gz SBCINUQHYXXITC-ZDUSSCGKSA-N 1 1 314.404 3.765 20 10 DHCDMO Cc1cc(C)c([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1 ZINC000294943802 1032222306 /nfs/dbraw/zinc/22/23/06/1032222306.db2.gz YCMNPCXSTAKEKL-HNNXBMFYSA-N 1 1 304.478 3.923 20 10 DHCDMO CC(C)[N@@H+]1CCCC[C@@H]1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773086077 1032555290 /nfs/dbraw/zinc/55/52/90/1032555290.db2.gz YCKALHCPDXYLRK-QFBILLFUSA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773086077 1032555293 /nfs/dbraw/zinc/55/52/93/1032555293.db2.gz YCKALHCPDXYLRK-QFBILLFUSA-N 1 1 303.494 3.666 20 10 DHCDMO Cc1cc(C[N@@H+]2CCc3nc(C(C)C)ncc3C2)ccc1N(C)C ZINC000857881621 1032699604 /nfs/dbraw/zinc/69/96/04/1032699604.db2.gz ZIEPFLABUIABNI-UHFFFAOYSA-N 1 1 324.472 3.533 20 10 DHCDMO Cc1cc(C[N@H+]2CCc3nc(C(C)C)ncc3C2)ccc1N(C)C ZINC000857881621 1032699621 /nfs/dbraw/zinc/69/96/21/1032699621.db2.gz ZIEPFLABUIABNI-UHFFFAOYSA-N 1 1 324.472 3.533 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858016634 1032746793 /nfs/dbraw/zinc/74/67/93/1032746793.db2.gz NVSLNORWMCOFBJ-SFHVURJKSA-N 1 1 324.424 3.626 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000766120371 1018416801 /nfs/dbraw/zinc/41/68/01/1018416801.db2.gz RSXWVIWYJJPCMD-NSHDSACASA-N 1 1 310.319 3.715 20 10 DHCDMO C[N@@H+](C/C=C/c1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000161838814 1018638806 /nfs/dbraw/zinc/63/88/06/1018638806.db2.gz JHAKOJBERYAVFH-VMPITWQZSA-N 1 1 322.452 3.668 20 10 DHCDMO C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765449466 1018789967 /nfs/dbraw/zinc/78/99/67/1018789967.db2.gz KZEMOCOPFMSKCY-IRXDYDNUSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@H](CO)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278657883 1019003474 /nfs/dbraw/zinc/00/34/74/1019003474.db2.gz ILPPRTBRSZVMJP-UWVGGRQHSA-N 1 1 306.233 3.758 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCC[C@]1(C)O ZINC001143103495 1019369886 /nfs/dbraw/zinc/36/98/86/1019369886.db2.gz DRXWZSIACMJQAK-KUHUBIRLSA-N 1 1 305.462 3.673 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)nn1C ZINC000858292871 1032833002 /nfs/dbraw/zinc/83/30/02/1032833002.db2.gz GZKIFLSHAALDJV-UHFFFAOYSA-N 1 1 322.456 3.734 20 10 DHCDMO CCCC[N@@H+](Cc1ccnn1CCC)Cc1ccccc1O ZINC000825788449 1032833843 /nfs/dbraw/zinc/83/38/43/1032833843.db2.gz HHSONZSRYPAVOB-UHFFFAOYSA-N 1 1 301.434 3.801 20 10 DHCDMO CC[N@H+](Cc1occc1Br)Cc1ccccc1O ZINC001143129113 1019609500 /nfs/dbraw/zinc/60/95/00/1019609500.db2.gz YJSPUCOJVOWBOW-UHFFFAOYSA-N 1 1 310.191 3.770 20 10 DHCDMO CC[N@@H+](Cc1occc1Br)Cc1ccccc1O ZINC001143129113 1019609509 /nfs/dbraw/zinc/60/95/09/1019609509.db2.gz YJSPUCOJVOWBOW-UHFFFAOYSA-N 1 1 310.191 3.770 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001203556517 1020093919 /nfs/dbraw/zinc/09/39/19/1020093919.db2.gz RGLXYRDXKJNSBX-MRXNPFEDSA-N 1 1 303.402 3.821 20 10 DHCDMO CCN(CC)c1ccc(CNc2[nH+]cnc3[nH]ccc32)cc1F ZINC000731352389 1020096322 /nfs/dbraw/zinc/09/63/22/1020096322.db2.gz VYDOJQGEWUPYEO-UHFFFAOYSA-N 1 1 313.380 3.555 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCc3sccc3[C@H]2C)c1O ZINC000732526599 1020248549 /nfs/dbraw/zinc/24/85/49/1020248549.db2.gz MTUSUEALYLKKMT-GFCCVEGCSA-N 1 1 303.427 3.890 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1cnn(CC2CCC2)c1 ZINC000903404156 1020406824 /nfs/dbraw/zinc/40/68/24/1020406824.db2.gz ITZDRNGZXHNRSG-CHWSQXEVSA-N 1 1 317.408 3.940 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000179583986 1020412692 /nfs/dbraw/zinc/41/26/92/1020412692.db2.gz YRUJUUFZIKOGOB-IBGZPJMESA-N 1 1 311.425 3.616 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2ncc(Cl)s2)cc1Cl ZINC000877806422 1033457200 /nfs/dbraw/zinc/45/72/00/1033457200.db2.gz GUUYVAJSAZZZAH-UHFFFAOYSA-N 1 1 303.214 3.754 20 10 DHCDMO CC[N@H+](Cc1cc(C)cc(C(C)(C)C)c1O)C[C@H]1CCOC1 ZINC000738079880 1020857292 /nfs/dbraw/zinc/85/72/92/1020857292.db2.gz DPPBFFKPXCNYRK-OAHLLOKOSA-N 1 1 305.462 3.857 20 10 DHCDMO CN(C)[C@@H]1CCC[N@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738144613 1020861824 /nfs/dbraw/zinc/86/18/24/1020861824.db2.gz QTYZIILOZKQQSJ-OAHLLOKOSA-N 1 1 324.424 3.818 20 10 DHCDMO CN(C)[C@@H]1CCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738144613 1020861831 /nfs/dbraw/zinc/86/18/31/1020861831.db2.gz QTYZIILOZKQQSJ-OAHLLOKOSA-N 1 1 324.424 3.818 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(C)c(C)cc2O)CCO1 ZINC000742163236 1021092202 /nfs/dbraw/zinc/09/22/02/1021092202.db2.gz RUQMACYUAZDNHJ-FQEVSTJZSA-N 1 1 311.425 3.891 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccccc1-n1cccn1 ZINC001137100852 1032966525 /nfs/dbraw/zinc/96/65/25/1032966525.db2.gz PTWYSUZTDCHVAM-UHFFFAOYSA-N 1 1 307.397 3.600 20 10 DHCDMO Oc1ccc2oc3c(c2c1C[N@H+]1CCCSCC1)CCCC3 ZINC000917462010 1021267886 /nfs/dbraw/zinc/26/78/86/1021267886.db2.gz GQGQOFVVVIWIBF-UHFFFAOYSA-N 1 1 317.454 3.956 20 10 DHCDMO Cc1cc(C[N@@H+](C)CC2CCOCC2)c(C)n1-c1ccccc1 ZINC001137854016 1021282425 /nfs/dbraw/zinc/28/24/25/1021282425.db2.gz FACMOJXYUMRGTK-UHFFFAOYSA-N 1 1 312.457 3.953 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCS1 ZINC000743400155 1021283902 /nfs/dbraw/zinc/28/39/02/1021283902.db2.gz JDLJPJHOWFHULN-CQSZACIVSA-N 1 1 309.475 3.723 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@H](c2ccccc2)CO1 ZINC000743409062 1021290893 /nfs/dbraw/zinc/29/08/93/1021290893.db2.gz QYTFQLHUZICXEW-YWZLYKJASA-N 1 1 323.436 3.843 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2ccc(F)c(F)c2F)cc1F ZINC000850099061 1021421131 /nfs/dbraw/zinc/42/11/31/1021421131.db2.gz DVRITSUEUGHPPZ-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nccn2C(C)C)cc1F ZINC000850128762 1021422881 /nfs/dbraw/zinc/42/28/81/1021422881.db2.gz IYNGYKBWIOWWED-UHFFFAOYSA-N 1 1 318.440 3.739 20 10 DHCDMO Cc1ccccc1-c1cnc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000744402128 1021533697 /nfs/dbraw/zinc/53/36/97/1021533697.db2.gz JRAUWMZXYOEOHI-UHFFFAOYSA-N 1 1 308.381 3.988 20 10 DHCDMO Cc1ccccc1-c1cnc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000744402128 1021533710 /nfs/dbraw/zinc/53/37/10/1021533710.db2.gz JRAUWMZXYOEOHI-UHFFFAOYSA-N 1 1 308.381 3.988 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)C1(CO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000850516536 1021573893 /nfs/dbraw/zinc/57/38/93/1021573893.db2.gz WYHMJPQTLFGPBB-BDAKNGLRSA-N 1 1 304.217 3.511 20 10 DHCDMO CC[C@@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1ccc(F)cc1O ZINC000850552321 1021600763 /nfs/dbraw/zinc/60/07/63/1021600763.db2.gz VNDRSWADWCAQCB-MRXNPFEDSA-N 1 1 317.408 3.773 20 10 DHCDMO CC[C@H]([NH2+]CCC1SCCS1)c1ccc(F)cc1O ZINC000850568718 1021611437 /nfs/dbraw/zinc/61/14/37/1021611437.db2.gz GVGIWXSTOISBLV-LBPRGKRZSA-N 1 1 301.452 3.768 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1nccn1C ZINC000850573036 1021616877 /nfs/dbraw/zinc/61/68/77/1021616877.db2.gz SODZCZXZYXLTJW-VHSXEESVSA-N 1 1 313.323 3.556 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H](C)O)c1ccc(F)cc1O ZINC000850583637 1021622331 /nfs/dbraw/zinc/62/23/31/1021622331.db2.gz MYJGPDFDHBFDNL-PUECVXPYSA-N 1 1 303.377 3.694 20 10 DHCDMO CC(C)[N@@H+](CCCCCO)Cc1c(O)ccc(F)c1Cl ZINC001237127646 1021712974 /nfs/dbraw/zinc/71/29/74/1021712974.db2.gz HWBQUKUOHDSTGP-UHFFFAOYSA-N 1 1 303.805 3.558 20 10 DHCDMO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)Cc1ccccc1O ZINC000109773640 1021747147 /nfs/dbraw/zinc/74/71/47/1021747147.db2.gz MLLBUXUTDFRJAX-UHFFFAOYSA-N 1 1 308.381 3.988 20 10 DHCDMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)Cc1ccccc1O ZINC000109773640 1021747159 /nfs/dbraw/zinc/74/71/59/1021747159.db2.gz MLLBUXUTDFRJAX-UHFFFAOYSA-N 1 1 308.381 3.988 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1cc2c(cc1O)CCC2)c1nccs1 ZINC000182844397 1021831170 /nfs/dbraw/zinc/83/11/70/1021831170.db2.gz HAJKWDXEPKLGCZ-GFCCVEGCSA-N 1 1 302.443 3.573 20 10 DHCDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc2c(cc1O)OCO2 ZINC000746034383 1021832197 /nfs/dbraw/zinc/83/21/97/1021832197.db2.gz QKGHKHAYSXIYEQ-UHFFFAOYSA-N 1 1 317.360 3.672 20 10 DHCDMO CCc1cc(C[N@H+]2CCO[C@H](CC)C2)c(O)c(C(C)(C)C)c1 ZINC000919939928 1021978405 /nfs/dbraw/zinc/97/84/05/1021978405.db2.gz KPMOQGNHUUYEOJ-MRXNPFEDSA-N 1 1 305.462 3.863 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000919954224 1021984264 /nfs/dbraw/zinc/98/42/64/1021984264.db2.gz NTRACXYFPYOXNM-SFHVURJKSA-N 1 1 305.381 3.673 20 10 DHCDMO CCN(C)c1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000766472734 1022123015 /nfs/dbraw/zinc/12/30/15/1022123015.db2.gz BCSPGSXRKCRPGA-VDZJLULYSA-N 1 1 303.494 3.666 20 10 DHCDMO CCCn1c(C)cc(C(=O)C[N@H+](C)Cc2ccccc2O)c1C ZINC000111235719 1022252412 /nfs/dbraw/zinc/25/24/12/1022252412.db2.gz YZYKIZJLPDWHPV-UHFFFAOYSA-N 1 1 314.429 3.535 20 10 DHCDMO CCCn1c(C)cc(C(=O)C[N@@H+](C)Cc2ccccc2O)c1C ZINC000111235719 1022252423 /nfs/dbraw/zinc/25/24/23/1022252423.db2.gz YZYKIZJLPDWHPV-UHFFFAOYSA-N 1 1 314.429 3.535 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000179583277 1022475904 /nfs/dbraw/zinc/47/59/04/1022475904.db2.gz DVYXCMGTPRWJAI-LJQANCHMSA-N 1 1 324.468 3.736 20 10 DHCDMO CC[N@H+](Cc1ccccc1O)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000179583277 1022475909 /nfs/dbraw/zinc/47/59/09/1022475909.db2.gz DVYXCMGTPRWJAI-LJQANCHMSA-N 1 1 324.468 3.736 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1O ZINC000179617932 1022493361 /nfs/dbraw/zinc/49/33/61/1022493361.db2.gz JNXZBQUPTLOKFK-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000179661278 1022502531 /nfs/dbraw/zinc/50/25/31/1022502531.db2.gz LEHNKHYIFKLUQZ-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](F)CC2)cc1Br ZINC001237677325 1022514242 /nfs/dbraw/zinc/51/42/42/1022514242.db2.gz LSBQNMRLJROOKE-GFCCVEGCSA-N 1 1 316.214 3.787 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000272900415 1022516812 /nfs/dbraw/zinc/51/68/12/1022516812.db2.gz UZWNTZWZAQVWAO-LNLFQRSKSA-N 1 1 324.468 3.953 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)COc1ccccc1)c1cc(F)cc(F)c1O ZINC000756497050 1022537037 /nfs/dbraw/zinc/53/70/37/1022537037.db2.gz ZZEDMYSTVPOZBL-NWDGAFQWSA-N 1 1 307.340 3.789 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000776770570 1022558245 /nfs/dbraw/zinc/55/82/45/1022558245.db2.gz BGGCYJWGYDUDCT-LJQANCHMSA-N 1 1 311.425 3.936 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC000180027147 1022610444 /nfs/dbraw/zinc/61/04/44/1022610444.db2.gz OZLZYKMMOUHWGY-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1 ZINC000276140510 1022621994 /nfs/dbraw/zinc/62/19/94/1022621994.db2.gz DYEKFRHSBCGETI-ZDUSSCGKSA-N 1 1 303.324 3.564 20 10 DHCDMO Cc1cc([C@H]2C[N@H+](Cc3cc(F)ccc3O)CCO2)ccc1F ZINC000180194507 1022659504 /nfs/dbraw/zinc/65/95/04/1022659504.db2.gz RDQQFFMVZOCGLI-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cc([C@H]2C[N@@H+](Cc3cc(F)ccc3O)CCO2)ccc1F ZINC000180194507 1022659507 /nfs/dbraw/zinc/65/95/07/1022659507.db2.gz RDQQFFMVZOCGLI-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCc3ccc(F)c(F)c3C2)cc1C ZINC000767781853 1022812009 /nfs/dbraw/zinc/81/20/09/1022812009.db2.gz LYHDCTHKOZSXSA-UHFFFAOYSA-N 1 1 303.352 3.846 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCc3ccc(F)c(F)c3C2)cc1C ZINC000767781853 1022812026 /nfs/dbraw/zinc/81/20/26/1022812026.db2.gz LYHDCTHKOZSXSA-UHFFFAOYSA-N 1 1 303.352 3.846 20 10 DHCDMO OC1CCN(c2ccc(C[N@H+]3CC[C@H]3c3ccccc3)cc2)CC1 ZINC000876512584 1033083597 /nfs/dbraw/zinc/08/35/97/1033083597.db2.gz SPFAKVZFOHOWFM-NRFANRHFSA-N 1 1 322.452 3.595 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccc(Cl)o1)C[C@H]1CCCO1 ZINC000768162559 1022906796 /nfs/dbraw/zinc/90/67/96/1022906796.db2.gz QDIOEFAUXPXDAR-CQSZACIVSA-N 1 1 321.804 3.820 20 10 DHCDMO COc1ccc(C[N@H+](C)Cc2c(O)cccc2Cl)cc1F ZINC000768200339 1022913222 /nfs/dbraw/zinc/91/32/22/1022913222.db2.gz MUMAFLLVSBPICH-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1F ZINC000768200339 1022913227 /nfs/dbraw/zinc/91/32/27/1022913227.db2.gz MUMAFLLVSBPICH-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1ccc(N(C)C)c(F)c1 ZINC000768196759 1022923878 /nfs/dbraw/zinc/92/38/78/1022923878.db2.gz GUQHMNDFTZEVTB-UHFFFAOYSA-N 1 1 322.449 3.602 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)Cc2cnn(C)c2)cc1 ZINC000768197398 1022925355 /nfs/dbraw/zinc/92/53/55/1022925355.db2.gz JWNUPODZXKPFEN-UHFFFAOYSA-N 1 1 314.477 3.679 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)C2CCN(C(C)C)CC2)cc1 ZINC000768227557 1022930719 /nfs/dbraw/zinc/93/07/19/1022930719.db2.gz BQLQLZQAZFHMKY-UHFFFAOYSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCN(C(C)C)CC2)cc1 ZINC000768227557 1022930732 /nfs/dbraw/zinc/93/07/32/1022930732.db2.gz BQLQLZQAZFHMKY-UHFFFAOYSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(CN(C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000768227557 1022930747 /nfs/dbraw/zinc/93/07/47/1022930747.db2.gz BQLQLZQAZFHMKY-UHFFFAOYSA-N 1 1 317.521 3.837 20 10 DHCDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000768337286 1022946596 /nfs/dbraw/zinc/94/65/96/1022946596.db2.gz CVWTZJOLYRZIRV-CQSZACIVSA-N 1 1 305.422 3.815 20 10 DHCDMO CC(C)n1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cn1 ZINC000768353394 1022952585 /nfs/dbraw/zinc/95/25/85/1022952585.db2.gz SXRRWMJIXNXSCM-UHFFFAOYSA-N 1 1 314.477 3.941 20 10 DHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc(OC)c(OC)cc1O ZINC000768439813 1022964644 /nfs/dbraw/zinc/96/46/44/1022964644.db2.gz KGGFNOFSUSXEEU-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO COc1cc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c(O)cc1C ZINC000768439792 1022965528 /nfs/dbraw/zinc/96/55/28/1022965528.db2.gz JYCBWBWHZKCKIT-KWOWKCNFSA-N 1 1 301.430 3.720 20 10 DHCDMO COc1cc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)c(O)cc1C ZINC000768464169 1022973367 /nfs/dbraw/zinc/97/33/67/1022973367.db2.gz NWZKMWUPZHJMTD-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C[N@H+]2CCc3c(F)ccc(F)c3C2)c(O)cc1C ZINC000768464169 1022973384 /nfs/dbraw/zinc/97/33/84/1022973384.db2.gz NWZKMWUPZHJMTD-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C[N@@H+]2CCc3c(F)cc(F)cc3C2)c(O)cc1C ZINC000768461379 1022973939 /nfs/dbraw/zinc/97/39/39/1022973939.db2.gz CBAZBSDQCLJTGL-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C[N@H+]2CCc3c(F)cc(F)cc3C2)c(O)cc1C ZINC000768461379 1022973952 /nfs/dbraw/zinc/97/39/52/1022973952.db2.gz CBAZBSDQCLJTGL-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000768542816 1022986890 /nfs/dbraw/zinc/98/68/90/1022986890.db2.gz ZUWJCGBPIOGCTL-OAHLLOKOSA-N 1 1 308.441 3.530 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCc2ccccc2F)c(O)c1 ZINC000769029611 1023071088 /nfs/dbraw/zinc/07/10/88/1023071088.db2.gz LVUPDNGCECCZSZ-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)C[C@H](c2ccccc2)O1 ZINC000769102996 1023092212 /nfs/dbraw/zinc/09/22/12/1023092212.db2.gz RNSFRKPJWHFSKN-OXQOHEQNSA-N 1 1 310.441 3.715 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)c(O)c1 ZINC000769234573 1023104191 /nfs/dbraw/zinc/10/41/91/1023104191.db2.gz VXMDCVXBLFUXJK-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(Cc3ccccc3)CC[C@@H]2C)c1 ZINC000769307295 1023117508 /nfs/dbraw/zinc/11/75/08/1023117508.db2.gz GMOYJPIVBIXFCN-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO C[C@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769389495 1023139565 /nfs/dbraw/zinc/13/95/65/1023139565.db2.gz PJHDGUQHBJLCIG-AWEZNQCLSA-N 1 1 303.406 3.569 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)cc1 ZINC000769422845 1023145212 /nfs/dbraw/zinc/14/52/12/1023145212.db2.gz DKTMBZVGYBDCOD-OAQYLSRUSA-N 1 1 324.468 3.625 20 10 DHCDMO C[C@]1(c2ccccc2)C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769397286 1023149937 /nfs/dbraw/zinc/14/99/37/1023149937.db2.gz CLHDDATXROBDGD-GOSISDBHSA-N 1 1 317.816 3.793 20 10 DHCDMO C[C@]1(c2ccccc2)C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769397286 1023149938 /nfs/dbraw/zinc/14/99/38/1023149938.db2.gz CLHDDATXROBDGD-GOSISDBHSA-N 1 1 317.816 3.793 20 10 DHCDMO CC[N@H+](Cc1cc(C)c(C)cc1O)C[C@H](O)c1ccc(C)cc1 ZINC000769484346 1023152753 /nfs/dbraw/zinc/15/27/53/1023152753.db2.gz UNMTVXQQNCTPDY-FQEVSTJZSA-N 1 1 313.441 3.873 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCN(CC)[C@@H](C)C2)cc1 ZINC000769470648 1023161866 /nfs/dbraw/zinc/16/18/66/1023161866.db2.gz NEBXSSDZPTXTAB-FXAWDEMLSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCN(CC)[C@@H](C)C2)cc1 ZINC000769470648 1023161870 /nfs/dbraw/zinc/16/18/70/1023161870.db2.gz NEBXSSDZPTXTAB-FXAWDEMLSA-N 1 1 317.521 3.837 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cncc(OC)c1C ZINC000876654360 1033114639 /nfs/dbraw/zinc/11/46/39/1033114639.db2.gz DAINBYUDWYOCFV-UHFFFAOYSA-N 1 1 300.402 3.516 20 10 DHCDMO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCC[C@H]1O ZINC000770292653 1023292808 /nfs/dbraw/zinc/29/28/08/1023292808.db2.gz NVHYPTDUOVHNIF-IEBWSBKVSA-N 1 1 311.425 3.652 20 10 DHCDMO CCOc1ccc(C[N@H+](C)[C@H]2C[C@H](OCC)C23CCC3)c(O)c1 ZINC000770352456 1023303572 /nfs/dbraw/zinc/30/35/72/1023303572.db2.gz NWRKERXYBLFSIP-ROUUACIJSA-N 1 1 319.445 3.570 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000876805387 1033146625 /nfs/dbraw/zinc/14/66/25/1033146625.db2.gz ZQPSIWDTOJEIQX-PBHICJAKSA-N 1 1 317.454 3.850 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1F ZINC000787042755 1023752672 /nfs/dbraw/zinc/75/26/72/1023752672.db2.gz SOGDUHUBSGCPMV-UHFFFAOYSA-N 1 1 316.420 3.922 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC000787416846 1023790721 /nfs/dbraw/zinc/79/07/21/1023790721.db2.gz HWMYIYCHDLTRGU-AWEZNQCLSA-N 1 1 317.351 3.954 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2C[C@H](O)C[C@H]2C)cc1 ZINC000788270097 1023870305 /nfs/dbraw/zinc/87/03/05/1023870305.db2.gz PFMSVQZPDWMIPU-DYESRHJHSA-N 1 1 324.468 3.668 20 10 DHCDMO CC1(C)CC[N@@H+](Cc2c(O)ccc3ccncc32)CCS1 ZINC000788379448 1023879270 /nfs/dbraw/zinc/87/92/70/1023879270.db2.gz YPNPFRQCFPCXKF-UHFFFAOYSA-N 1 1 302.443 3.658 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)CN1CCC[C@H](C)C1)c1ccc(F)cc1O ZINC000796703176 1023900457 /nfs/dbraw/zinc/90/04/57/1023900457.db2.gz FQULDICZRXIWQV-ZQIUZPCESA-N 1 1 308.441 3.692 20 10 DHCDMO CCCCOCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788568879 1023909097 /nfs/dbraw/zinc/90/90/97/1023909097.db2.gz FCSYANXVFFETOK-NSHDSACASA-N 1 1 305.340 3.878 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1cnn(C)c1 ZINC000788615108 1023913891 /nfs/dbraw/zinc/91/38/91/1023913891.db2.gz VAUFGRDIAMLESF-ZJUUUORDSA-N 1 1 313.323 3.556 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCS1)c1cccc(C(F)(F)F)c1O ZINC000788629563 1023916832 /nfs/dbraw/zinc/91/68/32/1023916832.db2.gz WJGFPFLRTDHVTE-UWVGGRQHSA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@H]([NH2+]CC(C)(C)CCCO)c1cccc(C(F)(F)F)c1O ZINC000788652740 1023916953 /nfs/dbraw/zinc/91/69/53/1023916953.db2.gz UJHMPEZWFVWDSO-NSHDSACASA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@@H]([NH2+]CC1(CO)CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788754499 1023929259 /nfs/dbraw/zinc/92/92/59/1023929259.db2.gz PIGCOVUGFOMOKE-LLVKDONJSA-N 1 1 317.351 3.614 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCC[C@H]1CCO)c1cccc(C(F)(F)F)c1O ZINC000788760493 1023930088 /nfs/dbraw/zinc/93/00/88/1023930088.db2.gz BDWNZSLLOIJUPA-MJVIPROJSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788795700 1023935540 /nfs/dbraw/zinc/93/55/40/1023935540.db2.gz BABYSCAQKGYBKF-ZJUUUORDSA-N 1 1 305.365 3.815 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccc(F)cc1O ZINC000796702917 1023939378 /nfs/dbraw/zinc/93/93/78/1023939378.db2.gz QLOSAGFCWPBWFH-FUHWJXTLSA-N 1 1 303.377 3.960 20 10 DHCDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000789586287 1024120544 /nfs/dbraw/zinc/12/05/44/1024120544.db2.gz JZQMQCXJIQCQAF-OAGGEKHMSA-N 1 1 320.452 3.529 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882897247 1024164496 /nfs/dbraw/zinc/16/44/96/1024164496.db2.gz DQDZJJWLOXANKN-UHFFFAOYSA-N 1 1 307.340 3.749 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000882937206 1024179100 /nfs/dbraw/zinc/17/91/00/1024179100.db2.gz KXQLLKPMXMVOCO-DLBZAZTESA-N 1 1 319.351 3.680 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000268853534 1024180378 /nfs/dbraw/zinc/18/03/78/1024180378.db2.gz QFGVVBJBZAOWOX-SFHVURJKSA-N 1 1 319.408 3.950 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000882947013 1024182396 /nfs/dbraw/zinc/18/23/96/1024182396.db2.gz GYRXYHUCDGDQTO-HNNXBMFYSA-N 1 1 305.324 3.674 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccc(Br)o2)c1 ZINC000130701397 1024203665 /nfs/dbraw/zinc/20/36/65/1024203665.db2.gz ATOKZSSGHZIVTG-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1O ZINC000130725235 1024208814 /nfs/dbraw/zinc/20/88/14/1024208814.db2.gz FCJZVVYSMFGIET-UHFFFAOYSA-N 1 1 300.358 3.713 20 10 DHCDMO CSc1cc(C)ccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883038310 1024218289 /nfs/dbraw/zinc/21/82/89/1024218289.db2.gz FBAYGFSTGVYOOU-UHFFFAOYSA-N 1 1 309.381 3.991 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000883049444 1024222989 /nfs/dbraw/zinc/22/29/89/1024222989.db2.gz MTRQIISNDFBFFH-CQSZACIVSA-N 1 1 311.372 3.642 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000883082167 1024234350 /nfs/dbraw/zinc/23/43/50/1024234350.db2.gz YRDFZKNFPDAAKE-SUMWQHHRSA-N 1 1 319.351 3.538 20 10 DHCDMO CC[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(N(C)C)cc1 ZINC000883312713 1024367310 /nfs/dbraw/zinc/36/73/10/1024367310.db2.gz LGCCOYRAJYYMIC-QGZVFWFLSA-N 1 1 310.445 3.663 20 10 DHCDMO CC(C)n1cc([C@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)cn1 ZINC000790958722 1024404597 /nfs/dbraw/zinc/40/45/97/1024404597.db2.gz MCWUOEFUGGYYDK-JTQLQIEISA-N 1 1 311.788 3.813 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000790962217 1024406941 /nfs/dbraw/zinc/40/69/41/1024406941.db2.gz IMRAOZRXOKNNDR-UHFFFAOYSA-N 1 1 304.752 3.956 20 10 DHCDMO CCO[C@H](CC[NH2+]Cc1c(O)ccc(Cl)c1F)C(C)C ZINC000790971697 1024408670 /nfs/dbraw/zinc/40/86/70/1024408670.db2.gz UNFPZSOSTFREAW-CQSZACIVSA-N 1 1 303.805 3.726 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cc(F)ccc1F ZINC000790970566 1024409956 /nfs/dbraw/zinc/40/99/56/1024409956.db2.gz KZWDLZNUYVUALT-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3c(O)ccc(Cl)c3F)ccc21 ZINC000790981480 1024423343 /nfs/dbraw/zinc/42/33/43/1024423343.db2.gz PJQHWWLOVGGGCB-UHFFFAOYSA-N 1 1 305.740 3.684 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000791577746 1024518900 /nfs/dbraw/zinc/51/89/00/1024518900.db2.gz DKBKYDIQWQBPSD-ISVAXAHUSA-N 1 1 319.298 3.507 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000791577746 1024518905 /nfs/dbraw/zinc/51/89/05/1024518905.db2.gz DKBKYDIQWQBPSD-ISVAXAHUSA-N 1 1 319.298 3.507 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000792174901 1024640580 /nfs/dbraw/zinc/64/05/80/1024640580.db2.gz MNWVGLZXYVAWPC-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000792174901 1024640587 /nfs/dbraw/zinc/64/05/87/1024640587.db2.gz MNWVGLZXYVAWPC-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO CS[C@@H]1CCCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173449 1024642091 /nfs/dbraw/zinc/64/20/91/1024642091.db2.gz WQAJVHTWTYTWOX-SNVBAGLBSA-N 1 1 303.830 3.902 20 10 DHCDMO CS[C@@H]1CCCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173449 1024642099 /nfs/dbraw/zinc/64/20/99/1024642099.db2.gz WQAJVHTWTYTWOX-SNVBAGLBSA-N 1 1 303.830 3.902 20 10 DHCDMO CC(C)n1nccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000792788420 1024792384 /nfs/dbraw/zinc/79/23/84/1024792384.db2.gz FCTBBQHPLBFTOH-UHFFFAOYSA-N 1 1 314.477 3.941 20 10 DHCDMO CN(C)c1ccc(CNC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000747100869 1024867204 /nfs/dbraw/zinc/86/72/04/1024867204.db2.gz WYDSFLVSWPQWSB-UHFFFAOYSA-N 1 1 315.505 3.639 20 10 DHCDMO CCc1nc(NCc2ccc(N3CCCCC3)cc2)cc(C)[nH+]1 ZINC000804386346 1025268152 /nfs/dbraw/zinc/26/81/52/1025268152.db2.gz AHICLOINTNDCIY-UHFFFAOYSA-N 1 1 310.445 3.950 20 10 DHCDMO CSCC[C@@H](C)[N@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135821383 1025287777 /nfs/dbraw/zinc/28/77/77/1025287777.db2.gz CSNBQRUUIOBHKJ-SNVBAGLBSA-N 1 1 315.866 3.822 20 10 DHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135821383 1025287788 /nfs/dbraw/zinc/28/77/88/1025287788.db2.gz CSNBQRUUIOBHKJ-SNVBAGLBSA-N 1 1 315.866 3.822 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1c(O)cccc1F ZINC000886489437 1025650168 /nfs/dbraw/zinc/65/01/68/1025650168.db2.gz ISLKTVMXJYBGNQ-UKRRQHHQSA-N 1 1 318.392 3.612 20 10 DHCDMO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886493487 1025650306 /nfs/dbraw/zinc/65/03/06/1025650306.db2.gz NSQBKGJQVWPIBF-LBPRGKRZSA-N 1 1 313.376 3.540 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(F)cc(F)c1O)CCC2 ZINC000894021273 1025654297 /nfs/dbraw/zinc/65/42/97/1025654297.db2.gz QUPRQCNMZMOARX-AWEZNQCLSA-N 1 1 324.396 3.945 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(F)cc(F)c1O)CCC2 ZINC000894021273 1025654308 /nfs/dbraw/zinc/65/43/08/1025654308.db2.gz QUPRQCNMZMOARX-AWEZNQCLSA-N 1 1 324.396 3.945 20 10 DHCDMO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610958 1025737043 /nfs/dbraw/zinc/73/70/43/1025737043.db2.gz OKTNFDGXOXBQJR-NHYWBVRUSA-N 1 1 323.795 3.959 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1c(O)cccc1F ZINC000886612151 1025737171 /nfs/dbraw/zinc/73/71/71/1025737171.db2.gz DGINZQIOTIMMMS-PIGZYNQJSA-N 1 1 321.417 3.732 20 10 DHCDMO CC[N@@H+](Cc1ccccn1)Cc1cc(Br)ccc1O ZINC000076118453 1025862567 /nfs/dbraw/zinc/86/25/67/1025862567.db2.gz LVWUCQDECBKFFQ-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@H](C)c2ccc[nH]2)c1 ZINC001308359582 1025909692 /nfs/dbraw/zinc/90/96/92/1025909692.db2.gz YXRDQBADQOSJAV-SNVBAGLBSA-N 1 1 309.207 3.642 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1O ZINC000289744097 1026154897 /nfs/dbraw/zinc/15/48/97/1026154897.db2.gz QIHAGTJZELWBNR-AQNXPRMDSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)c1O ZINC000808677815 1026356655 /nfs/dbraw/zinc/35/66/55/1026356655.db2.gz DTYSMHYNJXZBPE-CYBMUJFWSA-N 1 1 322.880 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1[O-] ZINC000808713468 1026363295 /nfs/dbraw/zinc/36/32/95/1026363295.db2.gz NINFABWGTQUFQK-ZDUSSCGKSA-N 1 1 310.869 3.737 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000809693382 1026584517 /nfs/dbraw/zinc/58/45/17/1026584517.db2.gz UWRLTZLXEIBUCL-IBGZPJMESA-N 1 1 312.461 3.983 20 10 DHCDMO CCCC[N@@H+](CCCO)Cc1ccc(N2CCCCC2)cc1 ZINC000809752610 1026616833 /nfs/dbraw/zinc/61/68/33/1026616833.db2.gz TVYQNPGTXMGVBB-UHFFFAOYSA-N 1 1 304.478 3.661 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCC(CO)CC2)cc1F ZINC000809763352 1026619818 /nfs/dbraw/zinc/61/98/18/1026619818.db2.gz ACJZDMAHZWKUJI-UHFFFAOYSA-N 1 1 322.468 3.655 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000809787143 1026625998 /nfs/dbraw/zinc/62/59/98/1026625998.db2.gz UUWBMWZABPVXCE-GFCCVEGCSA-N 1 1 310.235 3.777 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000809787143 1026626002 /nfs/dbraw/zinc/62/60/02/1026626002.db2.gz UUWBMWZABPVXCE-GFCCVEGCSA-N 1 1 310.235 3.777 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000809789806 1026627850 /nfs/dbraw/zinc/62/78/50/1026627850.db2.gz HPLMWBGZXNXOPE-TXEJJXNPSA-N 1 1 317.351 3.954 20 10 DHCDMO CC[C@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccc(F)cc1O ZINC000796856869 1026677671 /nfs/dbraw/zinc/67/76/71/1026677671.db2.gz NJRAPUJSOLCSET-CJNGLKHVSA-N 1 1 309.425 3.761 20 10 DHCDMO CCc1nnc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)s1 ZINC000810260191 1026720570 /nfs/dbraw/zinc/72/05/70/1026720570.db2.gz GVHKUTUYPOGOSE-NSHDSACASA-N 1 1 311.838 3.700 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000811512212 1027026862 /nfs/dbraw/zinc/02/68/62/1027026862.db2.gz HODSXRHJVTZZQM-IBGZPJMESA-N 1 1 313.372 3.501 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1O ZINC000811512163 1027027118 /nfs/dbraw/zinc/02/71/18/1027027118.db2.gz FLCRSSICOWUVBW-HXUWFJFHSA-N 1 1 309.409 3.670 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(Br)ccc2O)[C@H]1C1CC1 ZINC000811513326 1027029159 /nfs/dbraw/zinc/02/91/59/1027029159.db2.gz GFWODFALIXUWDV-AWEZNQCLSA-N 1 1 310.235 3.775 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](n3cccn3)C2)c(O)c(C(C)(C)C)c1 ZINC000812295647 1027247627 /nfs/dbraw/zinc/24/76/27/1027247627.db2.gz GEYDJFUIGHCNAL-INIZCTEOSA-N 1 1 313.445 3.642 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cc1 ZINC000931910192 1027299835 /nfs/dbraw/zinc/29/98/35/1027299835.db2.gz AXYCECIKDBNFMW-CQSZACIVSA-N 1 1 316.342 3.619 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1 ZINC000812776988 1027401576 /nfs/dbraw/zinc/40/15/76/1027401576.db2.gz UFFOBZJOOQZEMP-LJQANCHMSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@@H](CF)C2)c1O ZINC000711498517 1027630086 /nfs/dbraw/zinc/63/00/86/1027630086.db2.gz PFYUGATXROUEGS-NSHDSACASA-N 1 1 316.214 3.645 20 10 DHCDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000296488228 1027652984 /nfs/dbraw/zinc/65/29/84/1027652984.db2.gz KWIOLTRXLZQFBQ-MRXNPFEDSA-N 1 1 304.478 3.922 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cnc(OC)c(Cl)c1)c1ccc(F)cc1O ZINC000296656923 1027697730 /nfs/dbraw/zinc/69/77/30/1027697730.db2.gz ZKDVMNUCEGVLNO-CQSZACIVSA-N 1 1 324.783 3.829 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)[C@H](C)C(C)C)cc2)CC1 ZINC000296662454 1027703743 /nfs/dbraw/zinc/70/37/43/1027703743.db2.gz YNXJJNHYSDGGLD-MRXNPFEDSA-N 1 1 304.478 3.778 20 10 DHCDMO C[C@@H]1C[C@H](C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCO1 ZINC000778995686 1027732547 /nfs/dbraw/zinc/73/25/47/1027732547.db2.gz FRSJEOZTMHZCNS-NVXWUHKLSA-N 1 1 302.462 3.532 20 10 DHCDMO C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000813879193 1027750567 /nfs/dbraw/zinc/75/05/67/1027750567.db2.gz SYENLHDPFJCATA-JKSUJKDBSA-N 1 1 321.484 3.664 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1noc(-c2ccccc2)n1 ZINC000296986505 1027773569 /nfs/dbraw/zinc/77/35/69/1027773569.db2.gz SDGNWKQZRQXKCM-DOMZBBRYSA-N 1 1 321.380 3.780 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccccc3-c3ccnn3C)ccc21 ZINC000814294114 1027982594 /nfs/dbraw/zinc/98/25/94/1027982594.db2.gz KFCUOEGYZWEEFK-UHFFFAOYSA-N 1 1 317.396 3.586 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc(F)cc1O ZINC000528000668 1028023322 /nfs/dbraw/zinc/02/33/22/1028023322.db2.gz KLGUUWDOGLADAT-WBVHZDCISA-N 1 1 306.425 3.589 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCC1CCOCC1)Cc1ccco1 ZINC000814627034 1028128755 /nfs/dbraw/zinc/12/87/55/1028128755.db2.gz CDZCLMIFSKAAQG-UHFFFAOYSA-N 1 1 315.413 3.804 20 10 DHCDMO CC(C)[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000814630844 1028131482 /nfs/dbraw/zinc/13/14/82/1028131482.db2.gz ZESAXOBYEOKLPF-UZLBHIALSA-N 1 1 313.441 3.972 20 10 DHCDMO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@H]1C1CC1)c1ccc(F)cc1O ZINC000367584971 1028206624 /nfs/dbraw/zinc/20/66/24/1028206624.db2.gz CAJUSTPDFDWLBS-RYQLBKOJSA-N 1 1 307.409 3.777 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137221 1028312169 /nfs/dbraw/zinc/31/21/69/1028312169.db2.gz YGDHAAGYDYYVEV-SJLPKXTDSA-N 1 1 302.462 3.507 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137221 1028312189 /nfs/dbraw/zinc/31/21/89/1028312189.db2.gz YGDHAAGYDYYVEV-SJLPKXTDSA-N 1 1 302.462 3.507 20 10 DHCDMO Cc1cc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)ccc1N(C)C ZINC000815055106 1028336657 /nfs/dbraw/zinc/33/66/57/1028336657.db2.gz VZQZNEGWPXHJQK-FQEVSTJZSA-N 1 1 312.457 3.617 20 10 DHCDMO COCC[N@@H+](Cc1ccc(C)o1)Cc1ccc(N(C)C)c(C)c1 ZINC000815061320 1028346657 /nfs/dbraw/zinc/34/66/57/1028346657.db2.gz QJNUVTPXTXHCBT-UHFFFAOYSA-N 1 1 316.445 3.611 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1ccc(N(C)C)c(C)c1 ZINC000815075574 1028353966 /nfs/dbraw/zinc/35/39/66/1028353966.db2.gz BFNHLFPOGQAEGL-UHFFFAOYSA-N 1 1 303.475 3.582 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccccc1O ZINC000368484441 1028362234 /nfs/dbraw/zinc/36/22/34/1028362234.db2.gz YIPIBUJRXOEHSA-RIFZZMRRSA-N 1 1 310.441 3.736 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cc1 ZINC000815108920 1028383277 /nfs/dbraw/zinc/38/32/77/1028383277.db2.gz QBFAKQPUXCEHGH-WFASDCNBSA-N 1 1 300.368 3.915 20 10 DHCDMO CSCc1cnc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000815136203 1028396661 /nfs/dbraw/zinc/39/66/61/1028396661.db2.gz RCGCWGFMXIIDCN-GFCCVEGCSA-N 1 1 321.515 3.923 20 10 DHCDMO C[C@@H]([NH2+]C1CCC(C)(O)CC1)c1cccc(C(F)(F)F)c1O ZINC000815586895 1028555869 /nfs/dbraw/zinc/55/58/69/1028555869.db2.gz UXUZHBPHSFWYMP-RWWNRMGGSA-N 1 1 317.351 3.755 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1O ZINC000815588313 1028559053 /nfs/dbraw/zinc/55/90/53/1028559053.db2.gz KCYXTXPBXNNSDW-SRVKXCTJSA-N 1 1 317.351 3.613 20 10 DHCDMO CO[C@@H]1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815600671 1028564845 /nfs/dbraw/zinc/56/48/45/1028564845.db2.gz AYGZYZSOPFFWGH-COPLHBTASA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H]([NH2+]CCc1nccs1)c1cccc(C(F)(F)F)c1O ZINC000815572068 1028567193 /nfs/dbraw/zinc/56/71/93/1028567193.db2.gz UIWFFRFTJNDYGO-VIFPVBQESA-N 1 1 316.348 3.761 20 10 DHCDMO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370201386 1028578052 /nfs/dbraw/zinc/57/80/52/1028578052.db2.gz KASANPPMLMCUSM-OAHLLOKOSA-N 1 1 305.809 3.506 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C(C)(C)O ZINC000815652382 1028596079 /nfs/dbraw/zinc/59/60/79/1028596079.db2.gz ZXRQUSOYWYZUGH-SDBXPKJASA-N 1 1 306.233 3.899 20 10 DHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@@H](C)Cc1ccsc1 ZINC000190259717 1028866272 /nfs/dbraw/zinc/86/62/72/1028866272.db2.gz OZUBNTWTLIQPSJ-LBPRGKRZSA-N 1 1 319.426 3.636 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@@H](n2nc(C)cc2C)C1 ZINC000372597183 1028874173 /nfs/dbraw/zinc/87/41/73/1028874173.db2.gz XUJIVPPEFIDESN-SJLPKXTDSA-N 1 1 313.445 3.994 20 10 DHCDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816494402 1028899945 /nfs/dbraw/zinc/89/99/45/1028899945.db2.gz JWQQYALKTMEKDE-INIZCTEOSA-N 1 1 321.424 3.659 20 10 DHCDMO c1nc(C[NH2+]Cc2ccc3c(c2)CCO3)c(-c2ccccc2)o1 ZINC000372785006 1028901301 /nfs/dbraw/zinc/90/13/01/1028901301.db2.gz FWDGFBYRPCXXFA-UHFFFAOYSA-N 1 1 306.365 3.566 20 10 DHCDMO COc1cc(C[NH2+]Cc2cc(Cl)c(F)cc2O)ccc1C ZINC000816541345 1028926910 /nfs/dbraw/zinc/92/69/10/1028926910.db2.gz JZEYGNXEYCNVDS-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO CCc1nc(CC[NH2+]Cc2cc(Cl)c(F)cc2O)cs1 ZINC000816545297 1028927109 /nfs/dbraw/zinc/92/71/09/1028927109.db2.gz LGRVAJHPXPOASG-UHFFFAOYSA-N 1 1 314.813 3.536 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc2c(c1)COC2 ZINC000816557366 1028941100 /nfs/dbraw/zinc/94/11/00/1028941100.db2.gz NUHJNRASPUNZSC-UHFFFAOYSA-N 1 1 307.752 3.505 20 10 DHCDMO CC1(C)C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C(C)(C)O1 ZINC000816564353 1028944231 /nfs/dbraw/zinc/94/42/31/1028944231.db2.gz CHTXUAJPQZEAJH-ZDUSSCGKSA-N 1 1 301.789 3.620 20 10 DHCDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@H]1O ZINC000816560436 1028945062 /nfs/dbraw/zinc/94/50/62/1028945062.db2.gz OYDZUZWKHIPSQV-QZTJIDSGSA-N 1 1 313.441 3.774 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000816574909 1028951724 /nfs/dbraw/zinc/95/17/24/1028951724.db2.gz WJMNMDUQIZLULA-ZDUSSCGKSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000816574909 1028951735 /nfs/dbraw/zinc/95/17/35/1028951735.db2.gz WJMNMDUQIZLULA-ZDUSSCGKSA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@](O)(CC[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816574565 1028951963 /nfs/dbraw/zinc/95/19/63/1028951963.db2.gz MGHZQKKKPZVYOP-KRWDZBQOSA-N 1 1 323.795 3.572 20 10 DHCDMO Cc1nccn1CCC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816610974 1028958555 /nfs/dbraw/zinc/95/85/55/1028958555.db2.gz DVUNAHVGCGLDDT-UHFFFAOYSA-N 1 1 309.413 3.572 20 10 DHCDMO C[C@@H]1C[C@H](N2CCCC2)C[N@H+]1Cc1ccc2ccccc2c1O ZINC000816608978 1028959104 /nfs/dbraw/zinc/95/91/04/1028959104.db2.gz OWBKSGCEXYNDHD-QAPCUYQASA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1Cc1ccc2ccccc2c1O ZINC000816608978 1028959117 /nfs/dbraw/zinc/95/91/17/1028959117.db2.gz OWBKSGCEXYNDHD-QAPCUYQASA-N 1 1 310.441 3.604 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)cc1F ZINC000816621695 1028968395 /nfs/dbraw/zinc/96/83/95/1028968395.db2.gz NLNOWLODELYIHP-GOSISDBHSA-N 1 1 313.420 3.870 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)cc1F ZINC000816621695 1028968410 /nfs/dbraw/zinc/96/84/10/1028968410.db2.gz NLNOWLODELYIHP-GOSISDBHSA-N 1 1 313.420 3.870 20 10 DHCDMO COc1cc(Cl)cc(CNc2cccc(C3CC3)[nH+]2)c1O ZINC000816636436 1028989540 /nfs/dbraw/zinc/98/95/40/1028989540.db2.gz VCFYKMGVFZVINY-UHFFFAOYSA-N 1 1 304.777 3.939 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c(O)cc1C ZINC000817363515 1029144594 /nfs/dbraw/zinc/14/45/94/1029144594.db2.gz FCIWYFZEJCDMHA-LBPRGKRZSA-N 1 1 317.351 3.874 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c1O ZINC000155231711 1029205659 /nfs/dbraw/zinc/20/56/59/1029205659.db2.gz JLGLGUZYOQTLDG-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1csc(Cl)c1 ZINC000817940741 1029281422 /nfs/dbraw/zinc/28/14/22/1029281422.db2.gz HPEHQGPMOKYBKI-NHYWBVRUSA-N 1 1 323.893 3.818 20 10 DHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(Cl)c1 ZINC000817939107 1029281584 /nfs/dbraw/zinc/28/15/84/1029281584.db2.gz ZAVYWEXIJCDQDU-UGSOOPFHSA-N 1 1 317.864 3.757 20 10 DHCDMO CCc1ccc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938940 1029284135 /nfs/dbraw/zinc/28/41/35/1029284135.db2.gz WAVHMPKXKBICCD-FOIQADDNSA-N 1 1 311.473 3.666 20 10 DHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc2c(c1)CCC2 ZINC000817938631 1029285253 /nfs/dbraw/zinc/28/52/53/1029285253.db2.gz OPXQOPVOYHPBRW-YCRPNKLZSA-N 1 1 323.484 3.592 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1cc2ccccc2o1 ZINC000817938108 1029285286 /nfs/dbraw/zinc/28/52/86/1029285286.db2.gz DQVGICRXSVAHHB-RDTXWAMCSA-N 1 1 323.440 3.849 20 10 DHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817943318 1029289310 /nfs/dbraw/zinc/28/93/10/1029289310.db2.gz UJKSWHIAKNWGRI-OALUTQOASA-N 1 1 315.436 3.632 20 10 DHCDMO CC(C)[C@H](N)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817960035 1029300290 /nfs/dbraw/zinc/30/02/90/1029300290.db2.gz WQSSDGNSTKHDKE-RTBURBONSA-N 1 1 312.457 3.639 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1c(C)cc(C)nc1OC ZINC000805743192 1029677213 /nfs/dbraw/zinc/67/72/13/1029677213.db2.gz SSYVFQLWABCRAK-UHFFFAOYSA-N 1 1 314.429 3.825 20 10 DHCDMO CCc1nnc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000290154158 1029918063 /nfs/dbraw/zinc/91/80/63/1029918063.db2.gz LLLZXHSDIFHLBV-LLVKDONJSA-N 1 1 317.458 3.536 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@@](C)(O)c1ccccc1 ZINC000822516581 1030054410 /nfs/dbraw/zinc/05/44/10/1030054410.db2.gz MSHSMNVSULQLRC-QGZVFWFLSA-N 1 1 323.795 3.524 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@@](C)(O)c1ccccc1 ZINC000822516581 1030054421 /nfs/dbraw/zinc/05/44/21/1030054421.db2.gz MSHSMNVSULQLRC-QGZVFWFLSA-N 1 1 323.795 3.524 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](CC)[C@H](C)c2cccnc2)c1 ZINC000290557553 1030106275 /nfs/dbraw/zinc/10/62/75/1030106275.db2.gz SCZDJKABHPOSEJ-CQSZACIVSA-N 1 1 300.402 3.769 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c1O ZINC000245951914 1030212401 /nfs/dbraw/zinc/21/24/01/1030212401.db2.gz XFHAZDSCKUFOEO-XJKSGUPXSA-N 1 1 303.427 3.724 20 10 DHCDMO Clc1cccc2c1[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)COC2 ZINC000924899728 1030221453 /nfs/dbraw/zinc/22/14/53/1030221453.db2.gz GWHXWVGJCRKNDQ-INIZCTEOSA-N 1 1 315.800 3.636 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)C1 ZINC000823458888 1030295003 /nfs/dbraw/zinc/29/50/03/1030295003.db2.gz JHEGJAAOVJTCBM-KRWDZBQOSA-N 1 1 316.470 3.605 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000291038287 1030303739 /nfs/dbraw/zinc/30/37/39/1030303739.db2.gz YXZJLHVQCCMWLH-HZPDHXFCSA-N 1 1 307.821 3.579 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000866518246 1030342644 /nfs/dbraw/zinc/34/26/44/1030342644.db2.gz VSPWEWFMJHLMAZ-WTWWAQLFSA-N 1 1 320.452 3.932 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1 ZINC000866543998 1030364315 /nfs/dbraw/zinc/36/43/15/1030364315.db2.gz DDXDVPANLRLTSO-SNVBAGLBSA-N 1 1 315.360 3.511 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000866596479 1030391016 /nfs/dbraw/zinc/39/10/16/1030391016.db2.gz MQIHVEBRYFAMDY-BZNIZROVSA-N 1 1 307.340 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccnn1C ZINC000866615238 1030405299 /nfs/dbraw/zinc/40/52/99/1030405299.db2.gz SILSYOJHINVLGE-DTWKUNHWSA-N 1 1 314.216 3.844 20 10 DHCDMO CC[C@H](C[C@H](C)O)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000866632628 1030412993 /nfs/dbraw/zinc/41/29/93/1030412993.db2.gz AHRFTXSMBWTPNB-GARJFASQSA-N 1 1 305.340 3.611 20 10 DHCDMO COc1cccc(C[N@H+](C)Cc2cc(Cl)ccc2OC)c1O ZINC000121218339 1030438624 /nfs/dbraw/zinc/43/86/24/1030438624.db2.gz IIVLTORTFRAEAE-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(N)ccn1)c1ccc(N2CCCCCC2)cc1 ZINC000925770039 1030487840 /nfs/dbraw/zinc/48/78/40/1030487840.db2.gz FFNZQUWTLURBDZ-INIZCTEOSA-N 1 1 324.472 3.895 20 10 DHCDMO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C(C)(C)C ZINC000824721297 1030619430 /nfs/dbraw/zinc/61/94/30/1030619430.db2.gz CMBIITVPXFXERO-ZDUSSCGKSA-N 1 1 310.394 3.613 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000824779931 1030636085 /nfs/dbraw/zinc/63/60/85/1030636085.db2.gz YWIKOOFYHFYNHV-LBPRGKRZSA-N 1 1 322.202 3.737 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000824941759 1030678179 /nfs/dbraw/zinc/67/81/79/1030678179.db2.gz QLTDLKKPQKNMQP-HIFRSBDPSA-N 1 1 322.246 3.775 20 10 DHCDMO [O-]c1c(Br)cccc1C[N@H+]1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000824941759 1030678164 /nfs/dbraw/zinc/67/81/64/1030678164.db2.gz QLTDLKKPQKNMQP-HIFRSBDPSA-N 1 1 322.246 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000824941759 1030678173 /nfs/dbraw/zinc/67/81/73/1030678173.db2.gz QLTDLKKPQKNMQP-HIFRSBDPSA-N 1 1 322.246 3.775 20 10 DHCDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000825321774 1030775704 /nfs/dbraw/zinc/77/57/04/1030775704.db2.gz NJHQWNIJAGGIGV-LJQANCHMSA-N 1 1 316.489 3.925 20 10 DHCDMO COc1ccc(O)c(CNc2ccc([NH+]3CCCC3)cc2C)c1 ZINC000237363415 1030825586 /nfs/dbraw/zinc/82/55/86/1030825586.db2.gz VZRBGEBTINZLDG-UHFFFAOYSA-N 1 1 312.413 3.922 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2[nH]cnc2c1 ZINC001137046646 1030832188 /nfs/dbraw/zinc/83/21/88/1030832188.db2.gz JGMBBXOTPJUSNS-UHFFFAOYSA-N 1 1 320.440 3.795 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2nc[nH]c2c1 ZINC001137046646 1030832205 /nfs/dbraw/zinc/83/22/05/1030832205.db2.gz JGMBBXOTPJUSNS-UHFFFAOYSA-N 1 1 320.440 3.795 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2nc[nH]c2c1 ZINC001137046646 1030832226 /nfs/dbraw/zinc/83/22/26/1030832226.db2.gz JGMBBXOTPJUSNS-UHFFFAOYSA-N 1 1 320.440 3.795 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1O ZINC000292222382 1030888331 /nfs/dbraw/zinc/88/83/31/1030888331.db2.gz AGXJXIXCVXCCOE-GXTWGEPZSA-N 1 1 317.763 3.531 20 10 DHCDMO C[C@@H]([NH2+]CCc1nc2c(s1)CCC2)c1cc(F)cc(F)c1O ZINC000926930251 1031002876 /nfs/dbraw/zinc/00/28/76/1031002876.db2.gz HAKGQEJEODVUMQ-SECBINFHSA-N 1 1 324.396 3.509 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)[C@H](C)CO1 ZINC000844732729 1031321241 /nfs/dbraw/zinc/32/12/41/1031321241.db2.gz RILFYYCZEFEQPC-HIFRSBDPSA-N 1 1 315.413 3.553 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC001308817602 1031342835 /nfs/dbraw/zinc/34/28/35/1031342835.db2.gz HJQLVWSKOWTIQK-LBPRGKRZSA-N 1 1 310.235 3.777 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CNc2ccccc2C1)c1ccc(F)cc1O ZINC000844921744 1031402249 /nfs/dbraw/zinc/40/22/49/1031402249.db2.gz SMKLDJDMXMBPFN-HOCLYGCPSA-N 1 1 300.377 3.609 20 10 DHCDMO C[N@H+](Cc1ccccc1)Cc1cc(Br)c(F)cc1O ZINC001144299153 1031439646 /nfs/dbraw/zinc/43/96/46/1031439646.db2.gz QLEDYAZFPRITHJ-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1ccccc1)Cc1cc(Br)c(F)cc1O ZINC001144299153 1031439650 /nfs/dbraw/zinc/43/96/50/1031439650.db2.gz QLEDYAZFPRITHJ-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@H+](CCC1CC1)Cc1cc(Br)c(F)cc1O ZINC001144306781 1031456845 /nfs/dbraw/zinc/45/68/45/1031456845.db2.gz QCYNYWJGOUOPHF-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO C[N@@H+](CCC1CC1)Cc1cc(Br)c(F)cc1O ZINC001144306781 1031456851 /nfs/dbraw/zinc/45/68/51/1031456851.db2.gz QCYNYWJGOUOPHF-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO CN(C)c1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000293640270 1031551343 /nfs/dbraw/zinc/55/13/43/1031551343.db2.gz NWUDESHVWQQYHW-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO CCc1cccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872259835 1031566422 /nfs/dbraw/zinc/56/64/22/1031566422.db2.gz LDQQXPXQGIGMLQ-GOSISDBHSA-N 1 1 303.446 3.878 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1CNc2ccccc21)c1ccc(F)cc1O ZINC000873237489 1031769341 /nfs/dbraw/zinc/76/93/41/1031769341.db2.gz PVFRLWYRKWBWIN-OLZOCXBDSA-N 1 1 300.377 3.781 20 10 DHCDMO C[C@]12CC[N@H+](Cc3cc(Cl)c(F)cc3O)C[C@H]1C2(F)F ZINC000294085471 1031791113 /nfs/dbraw/zinc/79/11/13/1031791113.db2.gz ZDYDFRMQIDTAQY-OLZOCXBDSA-N 1 1 305.727 3.662 20 10 DHCDMO C[C@]12CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C[C@H]1C2(F)F ZINC000294085471 1031791124 /nfs/dbraw/zinc/79/11/24/1031791124.db2.gz ZDYDFRMQIDTAQY-OLZOCXBDSA-N 1 1 305.727 3.662 20 10 DHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@](C)(O)c1ccccc1 ZINC000846045926 1031838125 /nfs/dbraw/zinc/83/81/25/1031838125.db2.gz XFYMAOVOKKPXMH-PIGZYNQJSA-N 1 1 323.795 3.571 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846054952 1031846125 /nfs/dbraw/zinc/84/61/25/1031846125.db2.gz RBDGXMAXRKPSCH-UHFFFAOYSA-N 1 1 305.727 3.806 20 10 DHCDMO COc1cc(C[N@@H+](C)CC2CCOCC2)c(O)c(C(C)(C)C)c1 ZINC000124666997 1031939207 /nfs/dbraw/zinc/93/92/07/1031939207.db2.gz SSNJUBPTDDVYAS-UHFFFAOYSA-N 1 1 321.461 3.557 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000898319500 1032019803 /nfs/dbraw/zinc/01/98/03/1032019803.db2.gz GQFPVUSDHIUPLZ-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000294492812 1032027442 /nfs/dbraw/zinc/02/74/42/1032027442.db2.gz BELHYVUTMRQPSN-UHFFFAOYSA-N 1 1 320.795 3.748 20 10 DHCDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877459519 1033307360 /nfs/dbraw/zinc/30/73/60/1033307360.db2.gz IASNPYBDSXOYGT-GOSISDBHSA-N 1 1 316.489 3.516 20 10 DHCDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877508908 1033330969 /nfs/dbraw/zinc/33/09/69/1033330969.db2.gz FJZOKQHLMOCDNB-JXFKEZNVSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000877507969 1033331903 /nfs/dbraw/zinc/33/19/03/1033331903.db2.gz TWUFLSIOCFVSDH-KGLIPLIRSA-N 1 1 300.229 3.716 20 10 DHCDMO Cc1ccc(C[N@H+]2Cc3cccc(O)c3C2)c(-c2cnn(C)c2)c1 ZINC000877703017 1033417109 /nfs/dbraw/zinc/41/71/09/1033417109.db2.gz ORSIBLAIBPESHD-UHFFFAOYSA-N 1 1 319.408 3.617 20 10 DHCDMO Cc1cccc(O)c1CN1CCC(C)([NH+]2CCCCC2)CC1 ZINC000877794921 1033454878 /nfs/dbraw/zinc/45/48/78/1033454878.db2.gz WAMLSGIYINHHCL-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1cc(F)cc(F)c1O ZINC000927102301 1033719217 /nfs/dbraw/zinc/71/92/17/1033719217.db2.gz RZXDPYQEQOJBDW-WDEREUQCSA-N 1 1 313.388 3.915 20 10 DHCDMO C[C@H]([NH2+]Cc1cscn1)c1ccc(N2CCCCC2)cc1 ZINC000127276584 1033791974 /nfs/dbraw/zinc/79/19/74/1033791974.db2.gz ZNVQDFNBNRUJOR-AWEZNQCLSA-N 1 1 301.459 3.984 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473487 1033862326 /nfs/dbraw/zinc/86/23/26/1033862326.db2.gz SEVCZQAMVPJIPN-ZJUUUORDSA-N 1 1 301.814 3.655 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473487 1033862330 /nfs/dbraw/zinc/86/23/30/1033862330.db2.gz SEVCZQAMVPJIPN-ZJUUUORDSA-N 1 1 301.814 3.655 20 10 DHCDMO Cc1[nH+]ccn1CCCN1CCCc2cc(OC(F)F)ccc21 ZINC000127422723 1033871534 /nfs/dbraw/zinc/87/15/34/1033871534.db2.gz QAUHYMFZUILUSH-UHFFFAOYSA-N 1 1 321.371 3.636 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nc(C2CC2)no1 ZINC000174374769 1033927312 /nfs/dbraw/zinc/92/73/12/1033927312.db2.gz ARUDSTWSCSZOFS-LBPRGKRZSA-N 1 1 301.390 3.626 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(C2CC2)no1 ZINC000174374769 1033927324 /nfs/dbraw/zinc/92/73/24/1033927324.db2.gz ARUDSTWSCSZOFS-LBPRGKRZSA-N 1 1 301.390 3.626 20 10 DHCDMO CCC1([NH+]2CCCC2)CC[NH+](Cc2ccc(F)c(F)c2[O-])CC1 ZINC000864050787 1034278917 /nfs/dbraw/zinc/27/89/17/1034278917.db2.gz QSBDKYUSMLRSFB-UHFFFAOYSA-N 1 1 324.415 3.511 20 10 DHCDMO CC[N@@H+](Cc1cccs1)Cc1ccc(N2CCOCC2)cc1 ZINC000119995169 1034321285 /nfs/dbraw/zinc/32/12/85/1034321285.db2.gz JZGIZUZVSFQYCQ-UHFFFAOYSA-N 1 1 316.470 3.607 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000794663710 1034321312 /nfs/dbraw/zinc/32/13/12/1034321312.db2.gz VDFDRAFSPCZBRD-IINYFYTJSA-N 1 1 310.319 3.713 20 10 DHCDMO CC[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(C)cc1O ZINC000794812760 1034518959 /nfs/dbraw/zinc/51/89/59/1034518959.db2.gz FTDHBBLKAAJQLF-QGZVFWFLSA-N 1 1 304.478 3.863 20 10 DHCDMO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(F)cc1O ZINC000185104304 1034527211 /nfs/dbraw/zinc/52/72/11/1034527211.db2.gz PJCIIKWMFXDASI-AWEZNQCLSA-N 1 1 314.404 3.851 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cc(F)ccc1O ZINC000185459759 1034548400 /nfs/dbraw/zinc/54/84/00/1034548400.db2.gz YALITJHRTITPHI-GFCCVEGCSA-N 1 1 320.383 3.583 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000211486813 1034570357 /nfs/dbraw/zinc/57/03/57/1034570357.db2.gz BOZPLQMWOGUUFR-FZMZJTMJSA-N 1 1 310.235 3.919 20 10 DHCDMO C[C@H]([NH2+]CCN1CC=CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794836650 1034593934 /nfs/dbraw/zinc/59/39/34/1034593934.db2.gz VIBNNZLGVVQTEF-NSHDSACASA-N 1 1 315.244 3.612 20 10 DHCDMO CC[C@@H](CCO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192944976 1034824902 /nfs/dbraw/zinc/82/49/02/1034824902.db2.gz XCUVPNHRRJBNDK-UWVGGRQHSA-N 1 1 306.233 3.758 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc(F)c1F ZINC001143610064 1034869785 /nfs/dbraw/zinc/86/97/85/1034869785.db2.gz PYHDEIVVBYLTEM-UHFFFAOYSA-N 1 1 319.351 3.633 20 10 DHCDMO Cc1cc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)cc(F)c1F ZINC001143610064 1034869792 /nfs/dbraw/zinc/86/97/92/1034869792.db2.gz PYHDEIVVBYLTEM-UHFFFAOYSA-N 1 1 319.351 3.633 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](c2ncccn2)C2CC2)cc1 ZINC000903325487 1035299766 /nfs/dbraw/zinc/29/97/66/1035299766.db2.gz HSDKKAGOGJLBQN-KDOFPFPSSA-N 1 1 310.445 3.735 20 10 DHCDMO CCN(C)c1ccc(CN2CCC[N@H+](C3CCCC3)CC2)cc1 ZINC000773750572 1035436279 /nfs/dbraw/zinc/43/62/79/1035436279.db2.gz DCYPVCPAKPZENZ-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)cc1 ZINC000773755682 1035439829 /nfs/dbraw/zinc/43/98/29/1035439829.db2.gz MTWUAKGSCAQDNW-OAQYLSRUSA-N 1 1 324.468 3.889 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2CCCC[C@@H]2F)c1 ZINC001179304214 1035473140 /nfs/dbraw/zinc/47/31/40/1035473140.db2.gz IFTCYTXAQSSXBM-QWHCGFSZSA-N 1 1 316.214 3.833 20 10 DHCDMO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1cc(F)c(F)cc1O ZINC001180092218 1035577367 /nfs/dbraw/zinc/57/73/67/1035577367.db2.gz KPJMKSMVNLJZKO-UHFFFAOYSA-N 1 1 302.324 3.784 20 10 DHCDMO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1cc(F)c(F)cc1O ZINC001180092218 1035577377 /nfs/dbraw/zinc/57/73/77/1035577377.db2.gz KPJMKSMVNLJZKO-UHFFFAOYSA-N 1 1 302.324 3.784 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)n1 ZINC001180076116 1035584749 /nfs/dbraw/zinc/58/47/49/1035584749.db2.gz ASPUUVDRXNQMHQ-UHFFFAOYSA-N 1 1 314.477 3.688 20 10 DHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c(O)c1 ZINC001180213505 1035623684 /nfs/dbraw/zinc/62/36/84/1035623684.db2.gz VHHNLZUIRGOMFV-MRXNPFEDSA-N 1 1 311.381 3.766 20 10 DHCDMO CCCn1cncc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC001180288334 1035646324 /nfs/dbraw/zinc/64/63/24/1035646324.db2.gz DYCUXWIBNFVUMB-UHFFFAOYSA-N 1 1 313.445 3.944 20 10 DHCDMO CCc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1O ZINC001181153318 1035851854 /nfs/dbraw/zinc/85/18/54/1035851854.db2.gz AZASAKQAOVPNKO-UHFFFAOYSA-N 1 1 314.385 3.537 20 10 DHCDMO Cc1cc(CC[NH2+]Cc2cc(F)c(F)cc2O)ccc1Cl ZINC001182053375 1036089741 /nfs/dbraw/zinc/08/97/41/1036089741.db2.gz ORXCECUXEMRCCV-UHFFFAOYSA-N 1 1 311.759 3.965 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)c1 ZINC000775641757 1036157724 /nfs/dbraw/zinc/15/77/24/1036157724.db2.gz DNNMHTQFIBXEGS-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)CCOc2ccccc2Cl)c1 ZINC000775647291 1036176922 /nfs/dbraw/zinc/17/69/22/1036176922.db2.gz RJXMFRFWPOIIPS-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774148870 1036197587 /nfs/dbraw/zinc/19/75/87/1036197587.db2.gz UHSVCXVULWIVLF-UWVGGRQHSA-N 1 1 304.217 3.919 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)CCOc2cccc(Cl)c2)c1 ZINC000775647667 1036213789 /nfs/dbraw/zinc/21/37/89/1036213789.db2.gz XOJDQLBDRZZUAL-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[C@@H]([NH2+]CCOCC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774174021 1036214684 /nfs/dbraw/zinc/21/46/84/1036214684.db2.gz NFVFSHCSLMWMJJ-SECBINFHSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774189361 1036217963 /nfs/dbraw/zinc/21/79/63/1036217963.db2.gz WPRQZPCUPGCLKM-YMTOWFKASA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774211455 1036232938 /nfs/dbraw/zinc/23/29/38/1036232938.db2.gz UELDVFKILQVOSA-GHMZBOCLSA-N 1 1 317.260 3.834 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@@H]2CCCN(Cc3ccccc3)C2)c1O ZINC000775655843 1036252787 /nfs/dbraw/zinc/25/27/87/1036252787.db2.gz LPPGPORYTZXISE-HXUWFJFHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)ccc1N(C)C ZINC001195546836 1036281573 /nfs/dbraw/zinc/28/15/73/1036281573.db2.gz KCGWJMBRYBNKPQ-LJQANCHMSA-N 1 1 309.457 3.836 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(Cc3ccccc3)CC[C@@H]2C)c1O ZINC000775674655 1036381870 /nfs/dbraw/zinc/38/18/70/1036381870.db2.gz HRAJVXMKUUDQPD-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001182574068 1036391170 /nfs/dbraw/zinc/39/11/70/1036391170.db2.gz JVAXQWLOUHRAGD-AWEZNQCLSA-N 1 1 321.779 3.838 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001182574068 1036391189 /nfs/dbraw/zinc/39/11/89/1036391189.db2.gz JVAXQWLOUHRAGD-AWEZNQCLSA-N 1 1 321.779 3.838 20 10 DHCDMO CCC[N@@H+](Cc1cccc(C)c1O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000775715825 1036533223 /nfs/dbraw/zinc/53/32/23/1036533223.db2.gz LVLIZCDEVBUWAA-KBAYOESNSA-N 1 1 303.446 3.726 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)c(O)cc1Br ZINC001250120618 1036646437 /nfs/dbraw/zinc/64/64/37/1036646437.db2.gz KRLFQBXXAJTXHL-AWEZNQCLSA-N 1 1 316.214 3.787 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)c(O)cc1Br ZINC001250120618 1036646443 /nfs/dbraw/zinc/64/64/43/1036646443.db2.gz KRLFQBXXAJTXHL-AWEZNQCLSA-N 1 1 316.214 3.787 20 10 DHCDMO COc1ccc(F)cc1CC[NH2+]Cc1ccc(Cl)cc1O ZINC001183811320 1036668779 /nfs/dbraw/zinc/66/87/79/1036668779.db2.gz JALNBJOKTARWKR-UHFFFAOYSA-N 1 1 309.768 3.526 20 10 DHCDMO Cc1csc(C[C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3O)C2)n1 ZINC001183971259 1036722272 /nfs/dbraw/zinc/72/22/72/1036722272.db2.gz FXYGHAOFCXREKO-LBPRGKRZSA-N 1 1 322.861 3.875 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC001184278868 1036799878 /nfs/dbraw/zinc/79/98/78/1036799878.db2.gz WSPUXEQXQSFBOB-TXEJJXNPSA-N 1 1 310.235 3.695 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC001184278868 1036799897 /nfs/dbraw/zinc/79/98/97/1036799897.db2.gz WSPUXEQXQSFBOB-TXEJJXNPSA-N 1 1 310.235 3.695 20 10 DHCDMO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2c(F)cccc2F)c1O ZINC000774864355 1037130248 /nfs/dbraw/zinc/13/02/48/1037130248.db2.gz DNCOOEAQHPZRAK-SECBINFHSA-N 1 1 323.314 3.863 20 10 DHCDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2ccccc2O)cc1F ZINC000761504911 1037340056 /nfs/dbraw/zinc/34/00/56/1037340056.db2.gz AOOLGGPXLZMKEA-AWEZNQCLSA-N 1 1 317.404 3.851 20 10 DHCDMO C[C@@H]1CCC[N@@H+](C(C)(C)CNCc2c(O)cccc2Cl)C1 ZINC000776044005 1037400527 /nfs/dbraw/zinc/40/05/27/1037400527.db2.gz YWZUNPQSOOMCOG-CYBMUJFWSA-N 1 1 310.869 3.646 20 10 DHCDMO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2c(O)cccc2Cl)C1 ZINC000776044005 1037400534 /nfs/dbraw/zinc/40/05/34/1037400534.db2.gz YWZUNPQSOOMCOG-CYBMUJFWSA-N 1 1 310.869 3.646 20 10 DHCDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C1 ZINC000130657057 1037826319 /nfs/dbraw/zinc/82/63/19/1037826319.db2.gz VDBSDUXLOLOVBK-APWZRJJASA-N 1 1 302.462 3.534 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487045 1038553474 /nfs/dbraw/zinc/55/34/74/1038553474.db2.gz GYLJACKXCOJFIO-DZKIICNBSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487045 1038553481 /nfs/dbraw/zinc/55/34/81/1038553481.db2.gz GYLJACKXCOJFIO-DZKIICNBSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775493446 1038575961 /nfs/dbraw/zinc/57/59/61/1038575961.db2.gz SJPXIBCBTQOIMW-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000760905938 1039043715 /nfs/dbraw/zinc/04/37/15/1039043715.db2.gz NCXBOYCQNFKEFY-ONGXEEELSA-N 1 1 319.323 3.560 20 10 DHCDMO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000760905934 1039044764 /nfs/dbraw/zinc/04/47/64/1039044764.db2.gz NCXBOYCQNFKEFY-KOLCDFICSA-N 1 1 319.323 3.560 20 10 DHCDMO Oc1ccc(CCNc2cc[nH+]c3cc(Cl)ccc23)cc1O ZINC000169305423 1040465320 /nfs/dbraw/zinc/46/53/20/1040465320.db2.gz DWSNZLLFABJSRZ-UHFFFAOYSA-N 1 1 314.772 3.954 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)c1O ZINC000761192349 1040556742 /nfs/dbraw/zinc/55/67/42/1040556742.db2.gz KWNGGTXCXIAMCP-CYBMUJFWSA-N 1 1 322.792 3.688 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2cc(C)no2)c1O ZINC000761192349 1040556761 /nfs/dbraw/zinc/55/67/61/1040556761.db2.gz KWNGGTXCXIAMCP-CYBMUJFWSA-N 1 1 322.792 3.688 20 10 DHCDMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N(C)C)cc1 ZINC000090459429 185297700 /nfs/dbraw/zinc/29/77/00/185297700.db2.gz ZDRCFVFVTWBBFN-GFCCVEGCSA-N 1 1 301.459 3.937 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@H]2c2cn[nH]c2)c(O)c1 ZINC000093438336 193251357 /nfs/dbraw/zinc/25/13/57/193251357.db2.gz LWIBWNCJEOFFAB-KRWDZBQOSA-N 1 1 315.417 3.631 20 10 DHCDMO O=C(c1ccccc1)C1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000272316414 130019849 /nfs/dbraw/zinc/01/98/49/130019849.db2.gz SRIPEJVVPNOTOG-UHFFFAOYSA-N 1 1 313.372 3.626 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccc(F)cc1O ZINC000273347961 130109290 /nfs/dbraw/zinc/10/92/90/130109290.db2.gz BCRLCEOJUVJQRR-LBPRGKRZSA-N 1 1 317.360 3.543 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000273414831 130118738 /nfs/dbraw/zinc/11/87/38/130118738.db2.gz QOXRQYYZCOFPQI-IAQYHMDHSA-N 1 1 308.422 3.546 20 10 DHCDMO COc1cccc(C2([NH2+][C@H](C)c3ccc(F)cc3O)CC2)c1 ZINC000273520482 130132319 /nfs/dbraw/zinc/13/23/19/130132319.db2.gz UBWGJZRHYINNJS-GFCCVEGCSA-N 1 1 301.361 3.880 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc2c(cc1O)CCCC2 ZINC000273527087 130132748 /nfs/dbraw/zinc/13/27/48/130132748.db2.gz VNHPKJGONPXUMW-SJCJKPOMSA-N 1 1 311.429 3.722 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(N(C)C)cc1 ZINC000285747623 131198416 /nfs/dbraw/zinc/19/84/16/131198416.db2.gz RSROIYQGANZOCZ-NEPJUHHUSA-N 1 1 305.372 3.838 20 10 DHCDMO CC[C@@H]([NH2+][C@H](COC)c1ccccc1)c1ccc(F)cc1O ZINC000286000724 131214696 /nfs/dbraw/zinc/21/46/96/131214696.db2.gz HNMDYOZIGJDLDO-IAGOWNOFSA-N 1 1 303.377 3.960 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1[O-] ZINC000286880212 131253500 /nfs/dbraw/zinc/25/35/00/131253500.db2.gz CIXNXORSGOMYKY-IUODEOHRSA-N 1 1 319.836 3.545 20 10 DHCDMO C[C@@H]([NH2+]CC1=CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000286973723 131258837 /nfs/dbraw/zinc/25/88/37/131258837.db2.gz IPXWSGXHXLKDMH-SECBINFHSA-N 1 1 302.201 3.696 20 10 DHCDMO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000287035349 131260597 /nfs/dbraw/zinc/26/05/97/131260597.db2.gz MBIHSRRBJXKUTF-ZBEGNZNMSA-N 1 1 323.795 3.959 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000295029774 335129722 /nfs/dbraw/zinc/12/97/22/335129722.db2.gz NTSZSHSICZKLEK-JQWIXIFHSA-N 1 1 303.324 3.564 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000373821099 336973842 /nfs/dbraw/zinc/97/38/42/336973842.db2.gz FHZCEQAHLXUAHF-OAHLLOKOSA-N 1 1 313.800 3.576 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000377641772 337057173 /nfs/dbraw/zinc/05/71/73/337057173.db2.gz AVBUBJAKGIZWHX-SMDDNHRTSA-N 1 1 304.415 3.755 20 10 DHCDMO c1[nH]nc2c1CCC[C@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000378164321 337067483 /nfs/dbraw/zinc/06/74/83/337067483.db2.gz NLWGIRZNNPRQLF-GOSISDBHSA-N 1 1 310.445 3.567 20 10 DHCDMO Cc1nnc([C@@H]([NH2+][C@@H](C)c2ccc(C)cc2O)c2ccccc2)[nH]1 ZINC000185324692 337205230 /nfs/dbraw/zinc/20/52/30/337205230.db2.gz UHBWPGWCFSEEQQ-UGSOOPFHSA-N 1 1 322.412 3.567 20 10 DHCDMO COC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(C)o1 ZINC000156408946 522759347 /nfs/dbraw/zinc/75/93/47/522759347.db2.gz JANBNDDGMSFOQW-YOEHRIQHSA-N 1 1 302.418 3.692 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000365614509 523104560 /nfs/dbraw/zinc/10/45/60/523104560.db2.gz UMLMTZRKEKHVDW-HIFRSBDPSA-N 1 1 305.809 3.640 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000266194861 524031753 /nfs/dbraw/zinc/03/17/53/524031753.db2.gz ZTOPSOHJQVOMIN-MRXNPFEDSA-N 1 1 320.408 3.524 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc(F)cc1O ZINC000285616411 535918183 /nfs/dbraw/zinc/91/81/83/535918183.db2.gz KMROVOKRVJEIPW-AWEZNQCLSA-N 1 1 303.333 3.501 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(Cl)c1[O-] ZINC000287893459 535947380 /nfs/dbraw/zinc/94/73/80/535947380.db2.gz ZDMVIGZUKWNJIZ-JYJNAYRXSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc(Cl)c1[O-] ZINC000287893459 535947382 /nfs/dbraw/zinc/94/73/82/535947382.db2.gz ZDMVIGZUKWNJIZ-JYJNAYRXSA-N 1 1 308.853 3.713 20 10 DHCDMO CC(C)(CO)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000894578472 1013420086 /nfs/dbraw/zinc/42/00/86/1013420086.db2.gz LFADUJHVJWPLTC-KRWDZBQOSA-N 1 1 321.367 3.520 20 10 DHCDMO Cc1cccc2c1CC[N@@H+](Cc1c(O)ccc3ccncc31)C2 ZINC000729466422 1013458286 /nfs/dbraw/zinc/45/82/86/1013458286.db2.gz URLUDKFCHWCGDS-UHFFFAOYSA-N 1 1 304.393 3.807 20 10 DHCDMO C[N@@H+](C/C=C\c1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000255058130 1013579654 /nfs/dbraw/zinc/57/96/54/1013579654.db2.gz JHAKOJBERYAVFH-YVMONPNESA-N 1 1 322.452 3.668 20 10 DHCDMO COc1cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(O)cc1C ZINC000160383382 1014036823 /nfs/dbraw/zinc/03/68/23/1014036823.db2.gz KSXPHGRUMMXLFQ-YOEHRIQHSA-N 1 1 307.459 3.569 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000796828055 1014101157 /nfs/dbraw/zinc/10/11/57/1014101157.db2.gz WGZWQDGYJCVVFS-HKUYNNGSSA-N 1 1 315.388 3.886 20 10 DHCDMO CCc1cc(C[N@@H+]2CCOC[C@H]2CC)c(O)c(C(C)(C)C)c1 ZINC000738085245 1015396429 /nfs/dbraw/zinc/39/64/29/1015396429.db2.gz RWLVCSKEHAPNOM-MRXNPFEDSA-N 1 1 305.462 3.863 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000896224692 1015506380 /nfs/dbraw/zinc/50/63/80/1015506380.db2.gz NEAMCNCUWXRIKX-AWEZNQCLSA-N 1 1 317.326 3.821 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)c(O)c1OC ZINC000891781563 1015614937 /nfs/dbraw/zinc/61/49/37/1015614937.db2.gz JFEODKXRHMXNEN-HNNXBMFYSA-N 1 1 305.418 3.564 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000896639181 1015694074 /nfs/dbraw/zinc/69/40/74/1015694074.db2.gz AYIZMMYLYHBLEQ-UHFFFAOYSA-N 1 1 317.332 3.870 20 10 DHCDMO CC(C)COC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccco1 ZINC000101596907 1016112249 /nfs/dbraw/zinc/11/22/49/1016112249.db2.gz PPWPCCCOOVOKMQ-KRWDZBQOSA-N 1 1 315.413 3.718 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1ccc(F)cc1O ZINC000185079856 1016546157 /nfs/dbraw/zinc/54/61/57/1016546157.db2.gz NOOYOSDGMFYIIX-YVEFUNNKSA-N 1 1 320.383 3.624 20 10 DHCDMO Cc1cc(NCc2cc(Cl)c3cccnc3c2O)nc(C)[nH+]1 ZINC001168527391 1016726725 /nfs/dbraw/zinc/72/67/25/1016726725.db2.gz FVAYKNMQTAGEBI-UHFFFAOYSA-N 1 1 314.776 3.613 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](c3cc(C)ccn3)C2)cc1 ZINC000846972954 1032151078 /nfs/dbraw/zinc/15/10/78/1032151078.db2.gz ZBTYIHRHPJUTSI-GOSISDBHSA-N 1 1 309.457 3.836 20 10 DHCDMO COc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185579975 1017029281 /nfs/dbraw/zinc/02/92/81/1017029281.db2.gz PCXJHBLLOBOABQ-STQMWFEESA-N 1 1 319.376 3.658 20 10 DHCDMO Cc1ncc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)o1 ZINC000840794566 1017037229 /nfs/dbraw/zinc/03/72/29/1017037229.db2.gz LOCWFEDXVJMUOC-MRVPVSSYSA-N 1 1 300.280 3.558 20 10 DHCDMO COc1ccc(O)c([C@@H](C)NCCC[NH+](C(C)C)C(C)C)c1 ZINC000185626860 1017061085 /nfs/dbraw/zinc/06/10/85/1017061085.db2.gz XTHLBFXMZJTLBV-OAHLLOKOSA-N 1 1 308.466 3.560 20 10 DHCDMO CC(C)[N@@H+]1CCCC[C@@H]1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000773086079 1032555234 /nfs/dbraw/zinc/55/52/34/1032555234.db2.gz YCKALHCPDXYLRK-VQIMIIECSA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000773086079 1032555249 /nfs/dbraw/zinc/55/52/49/1032555249.db2.gz YCKALHCPDXYLRK-VQIMIIECSA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)n1cc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)cn1 ZINC001137079590 1032628460 /nfs/dbraw/zinc/62/84/60/1032628460.db2.gz UAQNLLVAMUHDMI-UHFFFAOYSA-N 1 1 312.461 3.696 20 10 DHCDMO COc1ccccc1[C@@H](C)N(C)Cc1c([O-])cc(F)cc1F ZINC001140584044 1017195854 /nfs/dbraw/zinc/19/58/54/1017195854.db2.gz DRBOANJMNIEMIQ-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO COc1cccc(OCCC[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000186066343 1017679717 /nfs/dbraw/zinc/67/97/17/1017679717.db2.gz CHLBIMMZYLRGAB-ZDUSSCGKSA-N 1 1 319.376 3.660 20 10 DHCDMO COc1cc(C[N@@H+](C)[C@@H]2CCSC2)c(O)c(C(C)(C)C)c1 ZINC000125161054 1032739018 /nfs/dbraw/zinc/73/90/18/1032739018.db2.gz UJSUWGTVPRMOEK-CYBMUJFWSA-N 1 1 309.475 3.636 20 10 DHCDMO CC(C)C[N@@H+]1Cc2cccc(NC(=O)C3=CC(=O)CS3)c2C1 ZINC000764935922 1018434267 /nfs/dbraw/zinc/43/42/67/1018434267.db2.gz XSOFYFNXAWOOHE-UHFFFAOYSA-N 1 1 316.426 3.678 20 10 DHCDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)C3=CC(=O)CS3)c2C1 ZINC000764935922 1018434273 /nfs/dbraw/zinc/43/42/73/1018434273.db2.gz XSOFYFNXAWOOHE-UHFFFAOYSA-N 1 1 316.426 3.678 20 10 DHCDMO Cc1cc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414290 1018467619 /nfs/dbraw/zinc/46/76/19/1018467619.db2.gz UWGNBDZJMYBSKG-PZJWPPBQSA-N 1 1 323.484 3.811 20 10 DHCDMO Cc1cc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414290 1018467623 /nfs/dbraw/zinc/46/76/23/1018467623.db2.gz UWGNBDZJMYBSKG-PZJWPPBQSA-N 1 1 323.484 3.811 20 10 DHCDMO C[C@@H]1OCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@H]1C ZINC000765099358 1018475655 /nfs/dbraw/zinc/47/56/55/1018475655.db2.gz PDTDAWMFSBNCHV-STQMWFEESA-N 1 1 315.413 3.626 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2c(O)ccc3ccncc32)n1 ZINC000765107676 1018478530 /nfs/dbraw/zinc/47/85/30/1018478530.db2.gz XYPUTXDSIKGHAD-LJQANCHMSA-N 1 1 319.408 3.981 20 10 DHCDMO COC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC000858135665 1032778081 /nfs/dbraw/zinc/77/80/81/1032778081.db2.gz BQRFBBZEUHENGX-QGZVFWFLSA-N 1 1 320.383 3.508 20 10 DHCDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765303384 1018748626 /nfs/dbraw/zinc/74/86/26/1018748626.db2.gz ZZTICWCCMSQGKH-ZACQAIPSSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765303384 1018748644 /nfs/dbraw/zinc/74/86/44/1018748644.db2.gz ZZTICWCCMSQGKH-ZACQAIPSSA-N 1 1 303.494 3.524 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]CCCCOCc1ccccc1 ZINC000708554525 1018840765 /nfs/dbraw/zinc/84/07/65/1018840765.db2.gz ILDIEKXWQSCMPG-UHFFFAOYSA-N 1 1 321.367 3.757 20 10 DHCDMO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858164875 1032789526 /nfs/dbraw/zinc/78/95/26/1032789526.db2.gz GPDBLUMVFCXAME-ADLMAVQZSA-N 1 1 318.367 3.643 20 10 DHCDMO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000170789529 1019435939 /nfs/dbraw/zinc/43/59/39/1019435939.db2.gz ARVGUAKTRUFTGO-ZDUSSCGKSA-N 1 1 303.377 3.919 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@H](N3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000727170097 1019658431 /nfs/dbraw/zinc/65/84/31/1019658431.db2.gz SHLBSCVQPCRJPI-KRWDZBQOSA-N 1 1 316.489 3.668 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](N3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000727170097 1019658440 /nfs/dbraw/zinc/65/84/40/1019658440.db2.gz SHLBSCVQPCRJPI-KRWDZBQOSA-N 1 1 316.489 3.668 20 10 DHCDMO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3scnc32)cc1F ZINC000858357730 1032860879 /nfs/dbraw/zinc/86/08/79/1032860879.db2.gz KGUYVNOUXMEMDH-CYBMUJFWSA-N 1 1 305.422 3.515 20 10 DHCDMO c1ccc2c(c1)cc[nH+]c2NCc1ccc(N2CCOCC2)cc1 ZINC000858361240 1032861674 /nfs/dbraw/zinc/86/16/74/1032861674.db2.gz LMDYLYDLRBASCS-UHFFFAOYSA-N 1 1 319.408 3.684 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC001171760094 1032863215 /nfs/dbraw/zinc/86/32/15/1032863215.db2.gz QMRYLPUTXQHILR-YLJYHZDGSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171760094 1032863226 /nfs/dbraw/zinc/86/32/26/1032863226.db2.gz QMRYLPUTXQHILR-YLJYHZDGSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171760094 1032863234 /nfs/dbraw/zinc/86/32/34/1032863234.db2.gz QMRYLPUTXQHILR-YLJYHZDGSA-N 1 1 324.468 3.877 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1C ZINC000922519855 1020111889 /nfs/dbraw/zinc/11/18/89/1020111889.db2.gz HOECCEGLSRGQJF-MAUKXSAKSA-N 1 1 301.361 3.570 20 10 DHCDMO C[N@@H+](CCc1ccccc1F)Cc1c(O)ccc2ccncc21 ZINC000731663346 1020133931 /nfs/dbraw/zinc/13/39/31/1020133931.db2.gz ZIGYTAJGBCHOQY-UHFFFAOYSA-N 1 1 310.372 3.754 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000922584358 1020139541 /nfs/dbraw/zinc/13/95/41/1020139541.db2.gz IQFMHNLJMQBASW-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1nccn1C(F)F)C1CCCC1 ZINC000732205062 1020213069 /nfs/dbraw/zinc/21/30/69/1020213069.db2.gz YVNABGPKCCQMEM-UHFFFAOYSA-N 1 1 321.371 3.929 20 10 DHCDMO COc1ccnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000733613465 1020419299 /nfs/dbraw/zinc/41/92/99/1020419299.db2.gz XHFYDBMITSAIJL-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1ccc(F)cc1O ZINC000858452450 1032903340 /nfs/dbraw/zinc/90/33/40/1032903340.db2.gz CGAMEDAWJZYYPL-WMZOPIPTSA-N 1 1 315.388 3.714 20 10 DHCDMO CCCC[N@H+](Cc1nccn1C(F)F)Cc1ccccc1O ZINC000282573289 1020464456 /nfs/dbraw/zinc/46/44/56/1020464456.db2.gz ZUURAOSESICQSR-UHFFFAOYSA-N 1 1 309.360 3.786 20 10 DHCDMO CCCC[N@@H+](Cc1nccn1C(F)F)Cc1ccccc1O ZINC000282573289 1020464459 /nfs/dbraw/zinc/46/44/59/1020464459.db2.gz ZUURAOSESICQSR-UHFFFAOYSA-N 1 1 309.360 3.786 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CCc3ccc(C)cc3)CC2)cc1 ZINC000736309636 1020807906 /nfs/dbraw/zinc/80/79/06/1020807906.db2.gz ZVOZQWPKIVNARL-UHFFFAOYSA-N 1 1 324.468 3.758 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC2(CCCC2)C1 ZINC000310707056 1020822376 /nfs/dbraw/zinc/82/23/76/1020822376.db2.gz DISLHHUDELOOGE-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC2(CCCC2)C1 ZINC000310707056 1020822386 /nfs/dbraw/zinc/82/23/86/1020822386.db2.gz DISLHHUDELOOGE-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CO[C@H](C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000858546708 1032940948 /nfs/dbraw/zinc/94/09/48/1032940948.db2.gz DJECSDMUMDXUAT-CHIMOYNISA-N 1 1 315.335 3.629 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCN(C)[C@@H](C)C2)cc1 ZINC000742374850 1021114558 /nfs/dbraw/zinc/11/45/58/1021114558.db2.gz IBRRLGJRAYCAFI-PKOBYXMFSA-N 1 1 317.521 3.885 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)cc1)C(C)(C)C ZINC001202466797 1021260379 /nfs/dbraw/zinc/26/03/79/1021260379.db2.gz QAVJJJFUTKMJCH-LJQANCHMSA-N 1 1 317.521 3.743 20 10 DHCDMO CC[N@@H+](Cc1ccccc1Cl)Cc1cc2c(cc1O)OCO2 ZINC000917436826 1021261260 /nfs/dbraw/zinc/26/12/60/1021261260.db2.gz NSOLCYBXSPRDFE-UHFFFAOYSA-N 1 1 319.788 3.796 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)c1 ZINC000917617603 1021322941 /nfs/dbraw/zinc/32/29/41/1021322941.db2.gz MDOTYFBEHDYYDM-INIZCTEOSA-N 1 1 311.381 3.766 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCC3)n1 ZINC000178232693 1021323956 /nfs/dbraw/zinc/32/39/56/1021323956.db2.gz SPPPLANKKUHXRL-IBGZPJMESA-N 1 1 308.425 3.921 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2N(C)C)C2CC2)cc1 ZINC000743840934 1021367713 /nfs/dbraw/zinc/36/77/13/1021367713.db2.gz AMGLRLBYGTUEMV-UHFFFAOYSA-N 1 1 323.484 3.983 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1cc(C)cc(C)c1 ZINC000743870571 1021396173 /nfs/dbraw/zinc/39/61/73/1021396173.db2.gz XXEKJHHCVHTDTD-FQEVSTJZSA-N 1 1 313.441 3.955 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)Cc2ccc(OC)cc2)c1O ZINC000154670148 1021486901 /nfs/dbraw/zinc/48/69/01/1021486901.db2.gz HYQNVWIGPAGTOO-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c(Cl)c1 ZINC000850420391 1021522839 /nfs/dbraw/zinc/52/28/39/1021522839.db2.gz NJKMUJLTSPNFRC-UHFFFAOYSA-N 1 1 322.880 3.566 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccc(OC)cc2)c1 ZINC000125831918 1032987923 /nfs/dbraw/zinc/98/79/23/1032987923.db2.gz OGAQDCLQHUMQPH-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1ccc(F)cc1O ZINC000850524613 1021577925 /nfs/dbraw/zinc/57/79/25/1021577925.db2.gz CTKWKGRABVJHTC-JZXOWHBKSA-N 1 1 301.361 3.750 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nccc(OC)c2F)cc1 ZINC000850536971 1021591926 /nfs/dbraw/zinc/59/19/26/1021591926.db2.gz LKALFVQIJXJCCI-CYBMUJFWSA-N 1 1 317.408 3.536 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1ccc(F)cc1O ZINC000850537910 1021593967 /nfs/dbraw/zinc/59/39/67/1021593967.db2.gz AZSMZHHTPDEYRF-UKRRQHHQSA-N 1 1 306.425 3.589 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850554227 1021599354 /nfs/dbraw/zinc/59/93/54/1021599354.db2.gz HWTJHIRUUMMKNQ-YKQCJFHZSA-N 1 1 323.408 3.746 20 10 DHCDMO C[C@H]([NH2+]CC1SCCS1)c1cccc(C(F)(F)F)c1O ZINC000850561553 1021605108 /nfs/dbraw/zinc/60/51/08/1021605108.db2.gz PACCXNLMRJDWHV-QMMMGPOBSA-N 1 1 323.405 3.868 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)c1nccn1C ZINC000850573182 1021616160 /nfs/dbraw/zinc/61/61/60/1021616160.db2.gz VUOCUMPIGZBKTC-RKDXNWHRSA-N 1 1 314.216 3.844 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](O)[C@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000850573404 1021616504 /nfs/dbraw/zinc/61/65/04/1021616504.db2.gz LOWKPNNLQUMWQH-FMEYXAORSA-N 1 1 317.404 3.737 20 10 DHCDMO COC[C@@H]1CCCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078111 1021627825 /nfs/dbraw/zinc/62/78/25/1021627825.db2.gz OFZFRCAMFOPQQW-JTQLQIEISA-N 1 1 304.217 3.700 20 10 DHCDMO COC[C@@H]1CCCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078111 1021627832 /nfs/dbraw/zinc/62/78/32/1021627832.db2.gz OFZFRCAMFOPQQW-JTQLQIEISA-N 1 1 304.217 3.700 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]CCN(C(C)C)C(C)C)cc1 ZINC000314051861 1021700724 /nfs/dbraw/zinc/70/07/24/1021700724.db2.gz OZKHGCJVHZVIOS-UHFFFAOYSA-N 1 1 305.510 3.741 20 10 DHCDMO Cc1ccc(-c2nnc([C@H](C)[N@H+](C)Cc3ccccc3O)o2)cc1 ZINC000109769384 1021746603 /nfs/dbraw/zinc/74/66/03/1021746603.db2.gz NROJLJKOLLJFCB-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO Cc1ccc(-c2nnc([C@H](C)[N@@H+](C)Cc3ccccc3O)o2)cc1 ZINC000109769384 1021746614 /nfs/dbraw/zinc/74/66/14/1021746614.db2.gz NROJLJKOLLJFCB-AWEZNQCLSA-N 1 1 323.396 3.944 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1cc2c(cc1O)CCCC2)c1nccs1 ZINC000182837097 1021820739 /nfs/dbraw/zinc/82/07/39/1021820739.db2.gz UDMBNWQETZNGRH-ZDUSSCGKSA-N 1 1 316.470 3.963 20 10 DHCDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccccc1O ZINC000182873062 1021844648 /nfs/dbraw/zinc/84/46/48/1021844648.db2.gz XHOPFWIIKWCSPQ-ZDUSSCGKSA-N 1 1 300.358 3.802 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCOCC(F)(F)F)cc1 ZINC000919770150 1021892398 /nfs/dbraw/zinc/89/23/98/1021892398.db2.gz NLFHFCKGDHIFOP-UHFFFAOYSA-N 1 1 318.383 3.544 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000851716458 1021973036 /nfs/dbraw/zinc/97/30/36/1021973036.db2.gz MXNCHKQUUFTSRK-NHCUHLMSSA-N 1 1 322.452 3.511 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cc1C ZINC000920304931 1022100382 /nfs/dbraw/zinc/10/03/82/1022100382.db2.gz GOTLLNRFUYFUDG-OXJNMPFZSA-N 1 1 311.425 3.971 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2cccs2)c1 ZINC000756378937 1022167519 /nfs/dbraw/zinc/16/75/19/1022167519.db2.gz KMVIHPGVXVIBFZ-VXGBXAGGSA-N 1 1 319.426 3.522 20 10 DHCDMO CN(C)c1ccc(CNc2[nH+]c3ccc(F)cc3n2C)cc1F ZINC000766521770 1022174479 /nfs/dbraw/zinc/17/44/79/1022174479.db2.gz UJTUMZZSZFLWGG-UHFFFAOYSA-N 1 1 316.355 3.530 20 10 DHCDMO C[C@@]12COC[C@H]1C[N@@H+](Cc1cc3oc4ccccc4c3cc1O)C2 ZINC000853565733 1022293579 /nfs/dbraw/zinc/29/35/79/1022293579.db2.gz JKCUOXVKCTUULR-JLTOFOAXSA-N 1 1 323.392 3.760 20 10 DHCDMO COc1cc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c(O)cc1C ZINC000853632401 1022302044 /nfs/dbraw/zinc/30/20/44/1022302044.db2.gz FSJSZZHPMBNKFD-IBGZPJMESA-N 1 1 324.424 3.831 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000854225731 1022435240 /nfs/dbraw/zinc/43/52/40/1022435240.db2.gz GCOCCWAAYUCARQ-IAGOWNOFSA-N 1 1 300.377 3.842 20 10 DHCDMO CC(C)C[N@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(F)cc1 ZINC000179576586 1022481492 /nfs/dbraw/zinc/48/14/92/1022481492.db2.gz MEWIAGXROOVSDE-LJQANCHMSA-N 1 1 317.404 3.723 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310081248 1022550644 /nfs/dbraw/zinc/55/06/44/1022550644.db2.gz JLBRBZKNMDZVKV-UWJYYQICSA-N 1 1 324.468 3.955 20 10 DHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000112961873 1022573860 /nfs/dbraw/zinc/57/38/60/1022573860.db2.gz UUHIEPGSANXURH-HNNXBMFYSA-N 1 1 305.462 3.857 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 ZINC000180001395 1022607910 /nfs/dbraw/zinc/60/79/10/1022607910.db2.gz BIDORXZSNRTQOK-HZPDHXFCSA-N 1 1 320.452 3.618 20 10 DHCDMO CC(C)c1ccc[nH+]c1NCc1ccc(N2CCOCC2)cc1 ZINC000767290221 1022682416 /nfs/dbraw/zinc/68/24/16/1022682416.db2.gz HJFHVYAJVIGGEL-UHFFFAOYSA-N 1 1 311.429 3.654 20 10 DHCDMO Cc1nc(CC[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)cs1 ZINC000767347733 1022692540 /nfs/dbraw/zinc/69/25/40/1022692540.db2.gz DAIWHNGSWUKYKL-UHFFFAOYSA-N 1 1 315.486 3.725 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)c(C)c3)C2)c1O ZINC000180414500 1022724038 /nfs/dbraw/zinc/72/40/38/1022724038.db2.gz ZWTLXWGUMIQNLW-SFHVURJKSA-N 1 1 315.388 3.722 20 10 DHCDMO C[N@H+](Cc1csc(-c2ccco2)n1)Cc1ccccc1O ZINC000114721369 1022913322 /nfs/dbraw/zinc/91/33/22/1022913322.db2.gz VGSUZZRGYJXYIC-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO C[N@@H+](Cc1csc(-c2ccco2)n1)Cc1ccccc1O ZINC000114721369 1022913330 /nfs/dbraw/zinc/91/33/30/1022913330.db2.gz VGSUZZRGYJXYIC-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cc(C)ccc1O ZINC000768206983 1022915348 /nfs/dbraw/zinc/91/53/48/1022915348.db2.gz NQOYXMWHDQSERM-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCc3sccc3[C@H]2C)c1O ZINC000768211026 1022926232 /nfs/dbraw/zinc/92/62/32/1022926232.db2.gz WTMUYIABGUQVEH-GFCCVEGCSA-N 1 1 303.427 3.972 20 10 DHCDMO CCOc1ccc(C[N@@H+](Cc2ccc(C)o2)C2CC2)c(O)c1 ZINC000768264389 1022936117 /nfs/dbraw/zinc/93/61/17/1022936117.db2.gz NECQMBVRDXSWRQ-UHFFFAOYSA-N 1 1 301.386 3.857 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c1O ZINC000768319571 1022950218 /nfs/dbraw/zinc/95/02/18/1022950218.db2.gz QWECFPBCDVXNJX-GOSISDBHSA-N 1 1 311.425 3.998 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(O)c1 ZINC000768365180 1022952370 /nfs/dbraw/zinc/95/23/70/1022952370.db2.gz QRTFUKCKCLRKPL-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCCC3)on1 ZINC000768439344 1022968006 /nfs/dbraw/zinc/96/80/06/1022968006.db2.gz KJXKIODIDXZJCB-QGZVFWFLSA-N 1 1 312.413 3.905 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCCC3)no1 ZINC000768442405 1022968040 /nfs/dbraw/zinc/96/80/40/1022968040.db2.gz UWSRTGKWXBWJMB-GOSISDBHSA-N 1 1 312.413 3.905 20 10 DHCDMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768464741 1022972876 /nfs/dbraw/zinc/97/28/76/1022972876.db2.gz TVBUPNFPPVOXCN-QAPCUYQASA-N 1 1 319.445 3.609 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c(O)cc1C ZINC000768465274 1022973803 /nfs/dbraw/zinc/97/38/03/1022973803.db2.gz FGNMEQJTUILWOZ-INIZCTEOSA-N 1 1 301.361 3.795 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(O)cc1C ZINC000768464200 1022974445 /nfs/dbraw/zinc/97/44/45/1022974445.db2.gz OEIDBSPSRZAOLT-OAHLLOKOSA-N 1 1 315.388 3.838 20 10 DHCDMO CC[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCOC1 ZINC000768520651 1022979322 /nfs/dbraw/zinc/97/93/22/1022979322.db2.gz GXKVBLMFNZCMAL-INIZCTEOSA-N 1 1 311.425 3.918 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)CCc2cccs2)c1O ZINC000768761603 1023014315 /nfs/dbraw/zinc/01/43/15/1023014315.db2.gz ZPXOXZDMJNIWOO-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO CC[N@@H+](Cc1c(O)cccc1OC)[C@H](C)c1cccc(O)c1 ZINC000768872169 1023043673 /nfs/dbraw/zinc/04/36/73/1023043673.db2.gz FBAOJPFMGUBSIY-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCCOCC2)cc1 ZINC000768891735 1023049378 /nfs/dbraw/zinc/04/93/78/1023049378.db2.gz WTCOKRSHGLKRSQ-UHFFFAOYSA-N 1 1 324.468 3.935 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC000768913743 1023056371 /nfs/dbraw/zinc/05/63/71/1023056371.db2.gz RRJUDGHKXRLONK-JZXOWHBKSA-N 1 1 302.462 3.538 20 10 DHCDMO C[N@H+](Cc1c(O)cccc1Cl)C[C@@H]1OCCc2ccccc21 ZINC000769021355 1023072097 /nfs/dbraw/zinc/07/20/97/1023072097.db2.gz HFYHCXOHLJUVGO-SFHVURJKSA-N 1 1 317.816 3.791 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H](C)O1 ZINC000769103836 1023091058 /nfs/dbraw/zinc/09/10/58/1023091058.db2.gz CNOCGQKZJUFWPL-VQIMIIECSA-N 1 1 302.462 3.676 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1 ZINC000769327459 1023123153 /nfs/dbraw/zinc/12/31/53/1023123153.db2.gz BOWHMFBTLDVXQH-NRFANRHFSA-N 1 1 324.468 3.934 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC000769338063 1023126962 /nfs/dbraw/zinc/12/69/62/1023126962.db2.gz KKUATQNHCXDJMH-HNNXBMFYSA-N 1 1 315.388 3.920 20 10 DHCDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769354000 1023132373 /nfs/dbraw/zinc/13/23/73/1023132373.db2.gz YSDCNCBVMQQFRX-QGZVFWFLSA-N 1 1 322.452 3.643 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000769378165 1023135580 /nfs/dbraw/zinc/13/55/80/1023135580.db2.gz ADNGLHJOTWPWHE-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO C[C@@H]([NH2+]CCCOC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000194026569 1023146832 /nfs/dbraw/zinc/14/68/32/1023146832.db2.gz NMFHAEBCTJQBFP-SSDOTTSWSA-N 1 1 314.159 3.979 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H]2CC[C@H](SCC)C2)c(O)c1 ZINC000769551084 1023177692 /nfs/dbraw/zinc/17/76/92/1023177692.db2.gz UZESNOCXNZRITD-ZBFHGGJFSA-N 1 1 309.475 3.897 20 10 DHCDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000770748714 1023347530 /nfs/dbraw/zinc/34/75/30/1023347530.db2.gz UOWZZAUWNDSSQL-LLVKDONJSA-N 1 1 321.218 3.709 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2c(F)cncc2F)cc1Cl ZINC000825893147 1033126063 /nfs/dbraw/zinc/12/60/63/1033126063.db2.gz QDPIZXYKXWGFPL-VIFPVBQESA-N 1 1 312.747 3.878 20 10 DHCDMO Cc1cccc(O)c1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000876724940 1033128551 /nfs/dbraw/zinc/12/85/51/1033128551.db2.gz KDZIVNPRYSUZGN-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000876724940 1033128560 /nfs/dbraw/zinc/12/85/60/1033128560.db2.gz KDZIVNPRYSUZGN-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO CC(C)C[C@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876726225 1033129565 /nfs/dbraw/zinc/12/95/65/1033129565.db2.gz WMLPXSREZZKXIB-GOSISDBHSA-N 1 1 316.489 3.516 20 10 DHCDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c(O)c1 ZINC000876804190 1033146710 /nfs/dbraw/zinc/14/67/10/1033146710.db2.gz NJHKSAXROSNMEX-WBVHZDCISA-N 1 1 317.454 3.850 20 10 DHCDMO COc1cc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)c(O)cc1C ZINC000785516302 1023587904 /nfs/dbraw/zinc/58/79/04/1023587904.db2.gz HKJRMTIUNANFLV-UHFFFAOYSA-N 1 1 319.445 3.633 20 10 DHCDMO CC[C@H]([NH2+]CCc1nc(C)c(C)s1)c1ccc(F)cc1O ZINC000796801176 1023856669 /nfs/dbraw/zinc/85/66/69/1023856669.db2.gz YNHBNAJVHBRUNZ-AWEZNQCLSA-N 1 1 308.422 3.888 20 10 DHCDMO CC(C)OCCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788502921 1023895914 /nfs/dbraw/zinc/89/59/14/1023895914.db2.gz LIZVUAAAECJPRW-NSHDSACASA-N 1 1 305.340 3.877 20 10 DHCDMO CC(C)OCCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788502916 1023896717 /nfs/dbraw/zinc/89/67/17/1023896717.db2.gz LIZVUAAAECJPRW-LLVKDONJSA-N 1 1 305.340 3.877 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1cnn(C)c1 ZINC000788615106 1023913803 /nfs/dbraw/zinc/91/38/03/1023913803.db2.gz VAUFGRDIAMLESF-UWVGGRQHSA-N 1 1 313.323 3.556 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](C)N1CCCC[C@H]1C)c1ccc(F)cc1O ZINC000796693473 1023931803 /nfs/dbraw/zinc/93/18/03/1023931803.db2.gz JFBNEBBBHPZDOC-KEYYUXOJSA-N 1 1 308.441 3.835 20 10 DHCDMO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)c(O)c1 ZINC000788818715 1023941064 /nfs/dbraw/zinc/94/10/64/1023941064.db2.gz QTURFDGNOUATAL-AWEZNQCLSA-N 1 1 309.413 3.779 20 10 DHCDMO CSC1(C[N@@H+](Cc2ccco2)Cc2ccccc2O)CC1 ZINC000788841670 1023942718 /nfs/dbraw/zinc/94/27/18/1023942718.db2.gz WHKBQHWFOYGOOZ-UHFFFAOYSA-N 1 1 303.427 3.883 20 10 DHCDMO CC(C)Oc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882901128 1024164933 /nfs/dbraw/zinc/16/49/33/1024164933.db2.gz ADGYIIRXRZELKZ-UHFFFAOYSA-N 1 1 307.340 3.747 20 10 DHCDMO Cc1csc(CCCC[NH2+]Cc2cc(F)cc(F)c2O)n1 ZINC000882962488 1024189138 /nfs/dbraw/zinc/18/91/38/1024189138.db2.gz URRUUXJWTDKQNX-UHFFFAOYSA-N 1 1 312.385 3.548 20 10 DHCDMO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2cc(F)cc(F)c2O)CCO1 ZINC000883084381 1024237839 /nfs/dbraw/zinc/23/78/39/1024237839.db2.gz PUNMKNQLBBJKBU-GDBMZVCRSA-N 1 1 313.388 3.744 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000883088821 1024237928 /nfs/dbraw/zinc/23/79/28/1024237928.db2.gz RBCCIJJWYJYHNV-WBVHZDCISA-N 1 1 319.351 3.680 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCOc2c(F)cccc21 ZINC000883084556 1024238045 /nfs/dbraw/zinc/23/80/45/1024238045.db2.gz VFCJOPMPHAICFX-HNNXBMFYSA-N 1 1 323.314 3.813 20 10 DHCDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(N)cc2)cc1 ZINC000269123300 1024244884 /nfs/dbraw/zinc/24/48/84/1024244884.db2.gz KWFPYHMCYCOIAA-UHFFFAOYSA-N 1 1 311.429 3.753 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cccc(F)c1F ZINC000790958985 1024404317 /nfs/dbraw/zinc/40/43/17/1024404317.db2.gz SAUVTTFKPBZTMC-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCOC1CCCCC1 ZINC000790961818 1024407032 /nfs/dbraw/zinc/40/70/32/1024407032.db2.gz ACPHKXNUPQHUAT-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO Oc1cccc2c1CC[C@H]2[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790959050 1024407397 /nfs/dbraw/zinc/40/73/97/1024407397.db2.gz DMDGOSARWRSQCM-CYBMUJFWSA-N 1 1 307.752 3.667 20 10 DHCDMO CC(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790972106 1024419596 /nfs/dbraw/zinc/41/95/96/1024419596.db2.gz DDHAYMRHJXEPNX-MEDUHNTESA-N 1 1 315.816 3.726 20 10 DHCDMO COc1cccc(C2([NH2+]Cc3c(O)ccc(Cl)c3F)CC2)c1 ZINC000790976407 1024421647 /nfs/dbraw/zinc/42/16/47/1024421647.db2.gz BFWPLOGOXDJPFL-UHFFFAOYSA-N 1 1 321.779 3.972 20 10 DHCDMO COc1ccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c(C)c1 ZINC000790977068 1024421942 /nfs/dbraw/zinc/42/19/42/1024421942.db2.gz GACFSJXDRIEOTQ-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO COc1ccc2c(c1)CN(Cc1c(O)ccc(Cl)c1F)CC2 ZINC000792164583 1024638441 /nfs/dbraw/zinc/63/84/41/1024638441.db2.gz LXLDXECWQBBHOD-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)[C@@H](CCO)c1ccccc1 ZINC000792165852 1024641228 /nfs/dbraw/zinc/64/12/28/1024641228.db2.gz LQDCYPXYQNCBKM-HNNXBMFYSA-N 1 1 323.795 3.740 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@@H](CCO)c1ccccc1 ZINC000792165852 1024641234 /nfs/dbraw/zinc/64/12/34/1024641234.db2.gz LQDCYPXYQNCBKM-HNNXBMFYSA-N 1 1 323.795 3.740 20 10 DHCDMO CCc1ccc([C@@H]2C[N@@H+](Cc3cccc(C)c3O)CCO2)cc1 ZINC000792189986 1024645143 /nfs/dbraw/zinc/64/51/43/1024645143.db2.gz PPXXXADFVWXGGO-IBGZPJMESA-N 1 1 311.425 3.837 20 10 DHCDMO CCN(CC)c1ccc(CNC[C@@H](C)C[NH+]2CCCCC2)cc1 ZINC000321078255 1024705651 /nfs/dbraw/zinc/70/56/51/1024705651.db2.gz RCLWHRYENOUWET-GOSISDBHSA-N 1 1 317.521 3.744 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC(C)(C)OC[C@@H]3C)c2c1 ZINC000792724815 1024782875 /nfs/dbraw/zinc/78/28/75/1024782875.db2.gz ATVKXLQITJEKMC-ZDUSSCGKSA-N 1 1 315.413 3.553 20 10 DHCDMO CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])CC1 ZINC000321442630 1024902068 /nfs/dbraw/zinc/90/20/68/1024902068.db2.gz GGIYNMNSDQWKAM-HNNXBMFYSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@H]([NH2+]CCc1cccc2cccnc21)c1ccc(F)cc1O ZINC000321563799 1025007172 /nfs/dbraw/zinc/00/71/72/1025007172.db2.gz OGLDGFVGASINAQ-ZDUSSCGKSA-N 1 1 310.372 3.973 20 10 DHCDMO Oc1cc2c(cc1C[NH2+][C@H](c1ccco1)c1ccccc1)OCO2 ZINC000063255975 1025058542 /nfs/dbraw/zinc/05/85/42/1025058542.db2.gz QAVLJAWPHDFAEY-IBGZPJMESA-N 1 1 323.348 3.593 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1 ZINC000793576054 1025113684 /nfs/dbraw/zinc/11/36/84/1025113684.db2.gz XEPDYRQWNGXHDO-OAHLLOKOSA-N 1 1 322.456 3.912 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)cc1 ZINC000793610306 1025128828 /nfs/dbraw/zinc/12/88/28/1025128828.db2.gz STRFTKNFONXLLW-RTBURBONSA-N 1 1 302.462 3.676 20 10 DHCDMO CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000319118350 1025169092 /nfs/dbraw/zinc/16/90/92/1025169092.db2.gz NOIDGKPCWXWIJL-OAHLLOKOSA-N 1 1 300.446 3.926 20 10 DHCDMO CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc2ccccc2c1[O-] ZINC000319118350 1025169105 /nfs/dbraw/zinc/16/91/05/1025169105.db2.gz NOIDGKPCWXWIJL-OAHLLOKOSA-N 1 1 300.446 3.926 20 10 DHCDMO CC[C@@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000796954972 1025176011 /nfs/dbraw/zinc/17/60/11/1025176011.db2.gz TYKYIMVYWPLOKM-MJGOQNOKSA-N 1 1 317.404 3.870 20 10 DHCDMO COc1cc(C)cc(CNc2ccc3c(c2)[nH+]cn3C)c1OC ZINC000886037375 1025448640 /nfs/dbraw/zinc/44/86/40/1025448640.db2.gz IMCREAYKLKMCHQ-UHFFFAOYSA-N 1 1 311.385 3.511 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)o1 ZINC000137073913 1025496032 /nfs/dbraw/zinc/49/60/32/1025496032.db2.gz KXLCDKVXACUMQF-GOSISDBHSA-N 1 1 314.429 3.829 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc2c(c1)OCCO2 ZINC000886491977 1025649875 /nfs/dbraw/zinc/64/98/75/1025649875.db2.gz YQXLBNRORCYXBA-NEPJUHHUSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc2c(c1)OCO2 ZINC000886498651 1025655383 /nfs/dbraw/zinc/65/53/83/1025655383.db2.gz KOAKWWJLLWKFRG-GHMZBOCLSA-N 1 1 303.333 3.672 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000894016944 1025658718 /nfs/dbraw/zinc/65/87/18/1025658718.db2.gz JQTYFGMDVDYJAX-ZDUSSCGKSA-N 1 1 301.386 3.608 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894042373 1025668246 /nfs/dbraw/zinc/66/82/46/1025668246.db2.gz NEMAZGPKWDJIBP-GFCCVEGCSA-N 1 1 319.351 3.669 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894042373 1025668253 /nfs/dbraw/zinc/66/82/53/1025668253.db2.gz NEMAZGPKWDJIBP-GFCCVEGCSA-N 1 1 319.351 3.669 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1c(O)cccc1F ZINC000886519295 1025671599 /nfs/dbraw/zinc/67/15/99/1025671599.db2.gz RVEFIHJHOCZPNC-LBPRGKRZSA-N 1 1 316.376 3.566 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1c(O)cccc1F ZINC000886518769 1025671864 /nfs/dbraw/zinc/67/18/64/1025671864.db2.gz FTCYCJFJIIXNDW-NSHDSACASA-N 1 1 306.356 3.587 20 10 DHCDMO CCCCn1cc(C[NH2+][C@H](C)c2c(O)cccc2F)c(C)n1 ZINC000886561710 1025708255 /nfs/dbraw/zinc/70/82/55/1025708255.db2.gz HCLKOQPSPRMJHR-CYBMUJFWSA-N 1 1 305.397 3.687 20 10 DHCDMO COc1ccc(C2([NH2+][C@H](C)c3c(O)cccc3F)CC2)cc1 ZINC000886572070 1025713851 /nfs/dbraw/zinc/71/38/51/1025713851.db2.gz WFMVUUMNWWUVGZ-GFCCVEGCSA-N 1 1 301.361 3.880 20 10 DHCDMO COc1cccc(C2([NH2+][C@H](C)c3c(O)cccc3F)CC2)c1 ZINC000886576970 1025715355 /nfs/dbraw/zinc/71/53/55/1025715355.db2.gz UHEDIELNWISOEQ-GFCCVEGCSA-N 1 1 301.361 3.880 20 10 DHCDMO COCC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc(C)o1 ZINC000886586070 1025724717 /nfs/dbraw/zinc/72/47/17/1025724717.db2.gz KKAOEMKZIXVPEL-OCCSQVGLSA-N 1 1 307.365 3.861 20 10 DHCDMO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)CCO2 ZINC000886592201 1025727415 /nfs/dbraw/zinc/72/74/15/1025727415.db2.gz NFNBZTQKRBZASB-NHYWBVRUSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1c(O)cccc1F ZINC000886597086 1025729311 /nfs/dbraw/zinc/72/93/11/1025729311.db2.gz VXIPSANVUWPRDJ-YGRLFVJLSA-N 1 1 305.324 3.845 20 10 DHCDMO CC(C)n1ncc2c1C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)CC2 ZINC000886598519 1025731208 /nfs/dbraw/zinc/73/12/08/1025731208.db2.gz CKVKCNIQKVFJEU-JSGCOSHPSA-N 1 1 317.408 3.517 20 10 DHCDMO COC[C@H]([NH2+][C@H](C)c1c(O)cccc1F)c1cccc(OC)c1 ZINC000886636778 1025749202 /nfs/dbraw/zinc/74/92/02/1025749202.db2.gz UYPXBYJMKZEFFO-WBMJQRKESA-N 1 1 319.376 3.578 20 10 DHCDMO CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886637758 1025754075 /nfs/dbraw/zinc/75/40/75/1025754075.db2.gz DXFNIPMXLFHXOH-FASAQXTFSA-N 1 1 317.404 3.940 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H](C)c2ccc[nH]2)c1 ZINC001308359580 1025911094 /nfs/dbraw/zinc/91/10/94/1025911094.db2.gz YXRDQBADQOSJAV-JTQLQIEISA-N 1 1 309.207 3.642 20 10 DHCDMO COc1cncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000808736021 1026388005 /nfs/dbraw/zinc/38/80/05/1026388005.db2.gz GKGBMDHDNFZZSB-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO COc1cncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000808736021 1026388012 /nfs/dbraw/zinc/38/80/12/1026388012.db2.gz GKGBMDHDNFZZSB-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000809766994 1026605456 /nfs/dbraw/zinc/60/54/56/1026605456.db2.gz DBYHJCUAJQHGPV-GFCCVEGCSA-N 1 1 318.280 3.728 20 10 DHCDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1cc(OC)ccc1O ZINC000809780524 1026623050 /nfs/dbraw/zinc/62/30/50/1026623050.db2.gz AQCPBSMXBVHJEU-KRWDZBQOSA-N 1 1 315.413 3.993 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000809787248 1026625861 /nfs/dbraw/zinc/62/58/61/1026625861.db2.gz XDYUBWQDITVFEN-GFCCVEGCSA-N 1 1 310.235 3.777 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1O ZINC000811518440 1027020527 /nfs/dbraw/zinc/02/05/27/1027020527.db2.gz KMHUVLYLQLKKHI-WBVHZDCISA-N 1 1 321.848 3.888 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)[C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000811511907 1027027830 /nfs/dbraw/zinc/02/78/30/1027027830.db2.gz XGJRFWZTUVTSPD-OAHLLOKOSA-N 1 1 307.434 3.570 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1C ZINC000811513128 1027029076 /nfs/dbraw/zinc/02/90/76/1027029076.db2.gz WNZVJTNZOPFHFD-OAQYLSRUSA-N 1 1 323.436 3.979 20 10 DHCDMO COc1cc(C[N@@H+](C(C)C)[C@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000812291055 1027235788 /nfs/dbraw/zinc/23/57/88/1027235788.db2.gz JNOHJBUVDQASAP-HNNXBMFYSA-N 1 1 321.461 3.698 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CCC[C@H](CF)C2)c1O ZINC000711498516 1027628279 /nfs/dbraw/zinc/62/82/79/1027628279.db2.gz PFYUGATXROUEGS-LLVKDONJSA-N 1 1 316.214 3.645 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CC2CC(F)(F)C2)c1 ZINC000813780776 1027710708 /nfs/dbraw/zinc/71/07/08/1027710708.db2.gz HXPPZMYQVFQEFR-UHFFFAOYSA-N 1 1 320.177 3.598 20 10 DHCDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cc(F)ccc1O ZINC000778993837 1027730600 /nfs/dbraw/zinc/73/06/00/1027730600.db2.gz ATTDYLKFBGZVFO-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000778994172 1027730648 /nfs/dbraw/zinc/73/06/48/1027730648.db2.gz IFANHYOGCGOCPE-UHFFFAOYSA-N 1 1 323.371 3.697 20 10 DHCDMO C[C@@H](CN[C@@H](C)c1ccc(N2CCCCC2)cc1)C[NH+](C)C ZINC000813877965 1027747873 /nfs/dbraw/zinc/74/78/73/1027747873.db2.gz IVQLBKQOOSNYLP-IRXDYDNUSA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)CN(C)C ZINC000813877965 1027747893 /nfs/dbraw/zinc/74/78/93/1027747893.db2.gz IVQLBKQOOSNYLP-IRXDYDNUSA-N 1 1 303.494 3.525 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000779002752 1027749667 /nfs/dbraw/zinc/74/96/67/1027749667.db2.gz NUQBYWDSJGHHKI-IEBWSBKVSA-N 1 1 315.388 3.619 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000779002751 1027750302 /nfs/dbraw/zinc/75/03/02/1027750302.db2.gz NUQBYWDSJGHHKI-HKUYNNGSSA-N 1 1 315.388 3.619 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C[NH+](C)C ZINC000813879190 1027751456 /nfs/dbraw/zinc/75/14/56/1027751456.db2.gz SYENLHDPFJCATA-CVEARBPZSA-N 1 1 321.484 3.664 20 10 DHCDMO CCOC1(C)CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000814170499 1027924792 /nfs/dbraw/zinc/92/47/92/1027924792.db2.gz XGMQTJBLFQVMBN-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO COc1ccc([C@@H]([NH2+][C@H](C)c2ccc(F)cc2O)C2CC2)cn1 ZINC000528045459 1028071427 /nfs/dbraw/zinc/07/14/27/1028071427.db2.gz ZCWJJZYUHYOHPR-ZMZPIMSZSA-N 1 1 316.376 3.737 20 10 DHCDMO C[C@H](c1nccn1-c1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000367807283 1028241251 /nfs/dbraw/zinc/24/12/51/1028241251.db2.gz SGWXGSVWPPTYGK-OAHLLOKOSA-N 1 1 307.397 3.771 20 10 DHCDMO C[C@H](c1nccn1-c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000367807283 1028241264 /nfs/dbraw/zinc/24/12/64/1028241264.db2.gz SGWXGSVWPPTYGK-OAHLLOKOSA-N 1 1 307.397 3.771 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)ccc1N(C)C ZINC000815080546 1028353627 /nfs/dbraw/zinc/35/36/27/1028353627.db2.gz SMMYKPVECAGUPX-IEBWSBKVSA-N 1 1 316.489 3.700 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](c3ccco3)C2)c1O ZINC000368621912 1028385018 /nfs/dbraw/zinc/38/50/18/1028385018.db2.gz BLPDIJFWGHZRQG-LLVKDONJSA-N 1 1 307.777 3.637 20 10 DHCDMO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815578603 1028550636 /nfs/dbraw/zinc/55/06/36/1028550636.db2.gz RTVGKUMGBSLKFV-IINYFYTJSA-N 1 1 319.367 3.859 20 10 DHCDMO CCC[C@@](C)(O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815579686 1028552349 /nfs/dbraw/zinc/55/23/49/1028552349.db2.gz SHOQTFANWFTKDS-IINYFYTJSA-N 1 1 305.340 3.613 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815587368 1028556098 /nfs/dbraw/zinc/55/60/98/1028556098.db2.gz IFFOTXYEEIIMAT-HZMBPMFUSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCSC1)c1cccc(C(F)(F)F)c1O ZINC000815586103 1028556924 /nfs/dbraw/zinc/55/69/24/1028556924.db2.gz ZITPMQBDOVNKHL-UWVGGRQHSA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815597240 1028561036 /nfs/dbraw/zinc/56/10/36/1028561036.db2.gz QNQCWAGCODKERD-WDEREUQCSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(O)c1)c1cccc(C(F)(F)F)c1O ZINC000815573617 1028567997 /nfs/dbraw/zinc/56/79/97/1028567997.db2.gz OPXYCJDVNILMKF-SNVBAGLBSA-N 1 1 311.303 3.967 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC=CO1)c1cccc(C(F)(F)F)c1O ZINC000815618208 1028572554 /nfs/dbraw/zinc/57/25/54/1028572554.db2.gz GTKUOQDBGMDUAD-QWRGUYRKSA-N 1 1 301.308 3.754 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCOC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625617 1028576930 /nfs/dbraw/zinc/57/69/30/1028576930.db2.gz ICPFPSPSSQCKRT-GRYCIOLGSA-N 1 1 317.351 3.734 20 10 DHCDMO CO[C@@](C)(C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815627667 1028579827 /nfs/dbraw/zinc/57/98/27/1028579827.db2.gz GHODWJVSPPVSPZ-BONVTDFDSA-N 1 1 317.351 3.877 20 10 DHCDMO CO[C@](C)(C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815627668 1028580282 /nfs/dbraw/zinc/58/02/82/1028580282.db2.gz GHODWJVSPPVSPZ-MEBBXXQBSA-N 1 1 317.351 3.877 20 10 DHCDMO CO[C@@](C)(C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815627666 1028580475 /nfs/dbraw/zinc/58/04/75/1028580475.db2.gz GHODWJVSPPVSPZ-BMIGLBTASA-N 1 1 317.351 3.877 20 10 DHCDMO Cc1cc(Br)cc([C@@H](C)[NH2+]CC(C)(F)F)c1O ZINC000815645047 1028588877 /nfs/dbraw/zinc/58/88/77/1028588877.db2.gz SXMLALOTFHTBRQ-MRVPVSSYSA-N 1 1 308.166 3.769 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000371326622 1028689098 /nfs/dbraw/zinc/68/90/98/1028689098.db2.gz JORIOCGVDQNCKM-MOPGFXCFSA-N 1 1 314.473 3.535 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](c3ccncn3)C2)cc1 ZINC000371411185 1028704731 /nfs/dbraw/zinc/70/47/31/1028704731.db2.gz MEGCOABJZMWLPC-SFHVURJKSA-N 1 1 324.472 3.702 20 10 DHCDMO CO[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816537726 1028925467 /nfs/dbraw/zinc/92/54/67/1028925467.db2.gz PSQOMGQJQMFNOA-INIZCTEOSA-N 1 1 309.768 3.662 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000816539203 1028925503 /nfs/dbraw/zinc/92/55/03/1028925503.db2.gz WIVOJRWPJZLKLP-UHFFFAOYSA-N 1 1 301.695 3.753 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(F)cc1F ZINC000816543630 1028927032 /nfs/dbraw/zinc/92/70/32/1028927032.db2.gz ILEVBRJMVYYRIE-UHFFFAOYSA-N 1 1 301.695 3.753 20 10 DHCDMO Cc1nc(C)c(CC[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000816549034 1028930440 /nfs/dbraw/zinc/93/04/40/1028930440.db2.gz ASKPLMCEFSHUQD-UHFFFAOYSA-N 1 1 314.813 3.590 20 10 DHCDMO CS[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816549959 1028930492 /nfs/dbraw/zinc/93/04/92/1028930492.db2.gz DGSWWTAEBKUFJK-MNOVXSKESA-N 1 1 303.830 3.949 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)ccc2ccccc21 ZINC000816521705 1028931854 /nfs/dbraw/zinc/93/18/54/1028931854.db2.gz XBSYGDLHACIQTL-AEFFLSMTSA-N 1 1 311.425 3.794 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000816559919 1028945694 /nfs/dbraw/zinc/94/56/94/1028945694.db2.gz YXVOGRCUDRLLCL-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)ccc2ccccc21 ZINC000816574981 1028953658 /nfs/dbraw/zinc/95/36/58/1028953658.db2.gz YMQMAUJFEUDHGQ-GOSISDBHSA-N 1 1 311.425 3.936 20 10 DHCDMO Cc1ccc([C@@H](O)[C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816608506 1028961935 /nfs/dbraw/zinc/96/19/35/1028961935.db2.gz BERJNVGVXXIQRX-DIFFPNOSSA-N 1 1 323.795 3.705 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000816611676 1028963581 /nfs/dbraw/zinc/96/35/81/1028963581.db2.gz VKHHUWYQNJAEHV-UHFFFAOYSA-N 1 1 306.768 3.744 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000816611676 1028963595 /nfs/dbraw/zinc/96/35/95/1028963595.db2.gz VKHHUWYQNJAEHV-UHFFFAOYSA-N 1 1 306.768 3.744 20 10 DHCDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCCO1 ZINC000816675829 1028987285 /nfs/dbraw/zinc/98/72/85/1028987285.db2.gz MKIHBMAIRIOKHH-HXUWFJFHSA-N 1 1 316.489 3.924 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc2ccncc21)C1CC(OC(C)(C)C)C1 ZINC000817372111 1029140523 /nfs/dbraw/zinc/14/05/23/1029140523.db2.gz GKFMVUDYCLYLGS-UHFFFAOYSA-N 1 1 314.429 3.718 20 10 DHCDMO Cc1cc(F)ccc1[C@@H](C)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940008 1029281636 /nfs/dbraw/zinc/28/16/36/1029281636.db2.gz DTOJPNWGEQWTLM-KUHUBIRLSA-N 1 1 315.436 3.551 20 10 DHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817938476 1029282954 /nfs/dbraw/zinc/28/29/54/1029282954.db2.gz LDEDVBCNBZKDLJ-RTBURBONSA-N 1 1 315.436 3.632 20 10 DHCDMO Cc1ccc(C)c([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938403 1029283373 /nfs/dbraw/zinc/28/33/73/1029283373.db2.gz JVXQTPJLAZEBSH-UZLBHIALSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1csc(Cl)c1 ZINC000817940744 1029284826 /nfs/dbraw/zinc/28/48/26/1029284826.db2.gz HPEHQGPMOKYBKI-XHDPSFHLSA-N 1 1 323.893 3.818 20 10 DHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(C2CC2)c1 ZINC000817943833 1029288477 /nfs/dbraw/zinc/28/84/77/1029288477.db2.gz VTWCVFTZOYJZRV-YCRPNKLZSA-N 1 1 323.484 3.981 20 10 DHCDMO CCC[NH2+]CC[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963926 1029299778 /nfs/dbraw/zinc/29/97/78/1029299778.db2.gz YLUMCELBKBNGHA-LBPRGKRZSA-N 1 1 305.249 3.739 20 10 DHCDMO C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2[O-])cc1 ZINC000817962824 1029302800 /nfs/dbraw/zinc/30/28/00/1029302800.db2.gz LEPRITLMQXQYNM-RYUDHWBXSA-N 1 1 304.821 3.916 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970185 1029310001 /nfs/dbraw/zinc/31/00/01/1029310001.db2.gz NNUYGKQKUGTAFG-OBJOEFQTSA-N 1 1 316.367 3.722 20 10 DHCDMO CCN[C@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817972931 1029312280 /nfs/dbraw/zinc/31/22/80/1029312280.db2.gz QCWDXWJBNQWZJN-APWZRJJASA-N 1 1 312.457 3.654 20 10 DHCDMO C[C@@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817983004 1029320670 /nfs/dbraw/zinc/32/06/70/1029320670.db2.gz XMWVYAHBHCRTFI-NOZJJQNGSA-N 1 1 317.260 3.867 20 10 DHCDMO C[C@@H](N[C@@H]1CCCC[C@H]1[NH3+])c1ccc(N2CCCCC2)cc1 ZINC000818619006 1029422209 /nfs/dbraw/zinc/42/22/09/1029422209.db2.gz XGNYYZSIIAWCOG-ATZDWAIDSA-N 1 1 301.478 3.597 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(N2CCCCC2)cc1 ZINC000818619006 1029422217 /nfs/dbraw/zinc/42/22/17/1029422217.db2.gz XGNYYZSIIAWCOG-ATZDWAIDSA-N 1 1 301.478 3.597 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1O ZINC000290257191 1029969915 /nfs/dbraw/zinc/96/99/15/1029969915.db2.gz WGFQNZHWTYYOTA-BETUJISGSA-N 1 1 317.351 3.954 20 10 DHCDMO Cc1ncc([C@@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)s1 ZINC000865701390 1029981510 /nfs/dbraw/zinc/98/15/10/1029981510.db2.gz FCXMQLCYZHQSBD-SSDOTTSWSA-N 1 1 300.786 3.800 20 10 DHCDMO CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000290445941 1030051158 /nfs/dbraw/zinc/05/11/58/1030051158.db2.gz MBRCUTWJIPKRKN-UHFFFAOYSA-N 1 1 321.852 3.717 20 10 DHCDMO CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(Cl)c1[O-] ZINC000290445941 1030051171 /nfs/dbraw/zinc/05/11/71/1030051171.db2.gz MBRCUTWJIPKRKN-UHFFFAOYSA-N 1 1 321.852 3.717 20 10 DHCDMO Clc1cccc2c1[C@H]([NH2+]Cc1ccc3c(c1)CCO3)COC2 ZINC000924899729 1030223577 /nfs/dbraw/zinc/22/35/77/1030223577.db2.gz GWHXWVGJCRKNDQ-MRXNPFEDSA-N 1 1 315.800 3.636 20 10 DHCDMO C[C@@H]1COCC[N@@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823408731 1030281557 /nfs/dbraw/zinc/28/15/57/1030281557.db2.gz PUBAWJWTDFVHIX-OAHLLOKOSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@@H]1COCC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823408731 1030281567 /nfs/dbraw/zinc/28/15/67/1030281567.db2.gz PUBAWJWTDFVHIX-OAHLLOKOSA-N 1 1 316.470 3.605 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000291038267 1030305391 /nfs/dbraw/zinc/30/53/91/1030305391.db2.gz YXZJLHVQCCMWLH-CVEARBPZSA-N 1 1 307.821 3.579 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(N)ccn1)c1ccc(N2CCCCC2)cc1 ZINC000925772590 1030489887 /nfs/dbraw/zinc/48/98/87/1030489887.db2.gz UTKMBAQNTSLELU-OAHLLOKOSA-N 1 1 310.445 3.505 20 10 DHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000824474299 1030561563 /nfs/dbraw/zinc/56/15/63/1030561563.db2.gz MPGSXEOXAOMIFS-AWEZNQCLSA-N 1 1 321.218 3.820 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000824474299 1030561570 /nfs/dbraw/zinc/56/15/70/1030561570.db2.gz MPGSXEOXAOMIFS-AWEZNQCLSA-N 1 1 321.218 3.820 20 10 DHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000824555328 1030580023 /nfs/dbraw/zinc/58/00/23/1030580023.db2.gz FIRHCZDXMRPXRE-SNVBAGLBSA-N 1 1 310.191 3.941 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)no1 ZINC000824575696 1030586278 /nfs/dbraw/zinc/58/62/78/1030586278.db2.gz NDQGDZPSHYIYKC-HNNXBMFYSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)c(C)cc2O)no1 ZINC000824575696 1030586290 /nfs/dbraw/zinc/58/62/90/1030586290.db2.gz NDQGDZPSHYIYKC-HNNXBMFYSA-N 1 1 306.793 3.988 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](c3ccsc3)C1)CCC2 ZINC000122186295 1030591196 /nfs/dbraw/zinc/59/11/96/1030591196.db2.gz WFNKCVNMNULGGI-SFHVURJKSA-N 1 1 315.438 3.516 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000824632663 1030597698 /nfs/dbraw/zinc/59/76/98/1030597698.db2.gz PECNYYBMTZXQMC-HNNXBMFYSA-N 1 1 323.845 3.989 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824697030 1030603851 /nfs/dbraw/zinc/60/38/51/1030603851.db2.gz YANNKMKNHXJYID-UXLLHSPISA-N 1 1 309.837 3.561 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000824815584 1030647295 /nfs/dbraw/zinc/64/72/95/1030647295.db2.gz UGQAJOSFRGDURJ-APWZRJJASA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H]2CCCc3c2cnn3C)cc1Cl ZINC000824905909 1030665200 /nfs/dbraw/zinc/66/52/00/1030665200.db2.gz IKBOHXPNTIOSNZ-OAHLLOKOSA-N 1 1 319.836 3.597 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cnc(C3CC3)o2)cc1F ZINC000825172215 1030737057 /nfs/dbraw/zinc/73/70/57/1030737057.db2.gz LJGVRNOEIAMNES-UHFFFAOYSA-N 1 1 317.408 3.827 20 10 DHCDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825451727 1030813830 /nfs/dbraw/zinc/81/38/30/1030813830.db2.gz ZHBIVJOXTXHKIO-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO COc1cc(C[N@@H+]2CCC[C@@H](OC)CC2)c(O)c(C(C)(C)C)c1 ZINC000825490293 1030826505 /nfs/dbraw/zinc/82/65/05/1030826505.db2.gz WEQRMXBBMSBNEK-OAHLLOKOSA-N 1 1 321.461 3.699 20 10 DHCDMO Cc1c(F)cc(F)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001143769850 1030952448 /nfs/dbraw/zinc/95/24/48/1030952448.db2.gz UZUYKLNMTILXNP-UHFFFAOYSA-N 1 1 304.384 3.971 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1ccc(Cl)cc1O ZINC000926961261 1031018061 /nfs/dbraw/zinc/01/80/61/1031018061.db2.gz XUSUQPUKYPQRKA-NOZJJQNGSA-N 1 1 324.774 3.579 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1cnn(C)c1)C(C)C)c1ccc(F)cc1O ZINC000927067261 1031064755 /nfs/dbraw/zinc/06/47/55/1031064755.db2.gz FDNHETHZCCJPBV-DOTOQJQBSA-N 1 1 305.397 3.703 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)Cc1ccccc1[N+](=O)[O-] ZINC000179315668 1031079434 /nfs/dbraw/zinc/07/94/34/1031079434.db2.gz SMVWLKTXPBFHOF-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO COc1cccc(C[N@@H+](C)CCc2ccc(Cl)cc2)c1O ZINC000123622931 1031218155 /nfs/dbraw/zinc/21/81/55/1031218155.db2.gz NNEAEXGJGDLZPU-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@H]1CCc3cc(Cl)ccc3C1)CC2 ZINC001171135791 1031225524 /nfs/dbraw/zinc/22/55/24/1031225524.db2.gz OYFPHKNXWSOJKL-KRWDZBQOSA-N 1 1 313.828 3.961 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2cc[nH]c2n1 ZINC001144179460 1031303387 /nfs/dbraw/zinc/30/33/87/1031303387.db2.gz GJSHBPRNNJGKAM-UHFFFAOYSA-N 1 1 320.440 3.795 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872030479 1031415026 /nfs/dbraw/zinc/41/50/26/1031415026.db2.gz GDBPXQNQZJRHFZ-NSHDSACASA-N 1 1 316.332 3.520 20 10 DHCDMO CCc1onc(C)c1C[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC000929225472 1031472161 /nfs/dbraw/zinc/47/21/61/1031472161.db2.gz STHJKQMBKXLNJO-UHFFFAOYSA-N 1 1 301.434 3.634 20 10 DHCDMO CCc1cccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872259836 1031565744 /nfs/dbraw/zinc/56/57/44/1031565744.db2.gz LDQQXPXQGIGMLQ-SFHVURJKSA-N 1 1 303.446 3.878 20 10 DHCDMO C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293753121 1031603502 /nfs/dbraw/zinc/60/35/02/1031603502.db2.gz YHUAVAATXUUPTP-MRVPVSSYSA-N 1 1 300.786 3.535 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](C(F)F)CC2)cc1C(C)C ZINC000872679343 1031643601 /nfs/dbraw/zinc/64/36/01/1031643601.db2.gz WESCLNABJDWIJD-MRXNPFEDSA-N 1 1 313.388 3.680 20 10 DHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc(C)c(C)cc3O)C2)n1 ZINC000872807328 1031664831 /nfs/dbraw/zinc/66/48/31/1031664831.db2.gz NKOOWWIOSAWQFV-CQSZACIVSA-N 1 1 302.443 3.763 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)O[C@H](C)C2)c1 ZINC000872817450 1031666310 /nfs/dbraw/zinc/66/63/10/1031666310.db2.gz ZTVUEIROEZNXMT-OCCSQVGLSA-N 1 1 317.351 3.551 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@](C)(c3cccc(F)c3)C2)c1O ZINC000845999492 1031801342 /nfs/dbraw/zinc/80/13/42/1031801342.db2.gz AKVCTKGZCPVTFX-LJQANCHMSA-N 1 1 315.388 3.704 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccc(Cl)cc1O ZINC000846186855 1031919715 /nfs/dbraw/zinc/91/97/15/1031919715.db2.gz GKCJPCANNWZXMQ-DIFFPNOSSA-N 1 1 309.837 3.901 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCC(C)(C)C1 ZINC000877492129 1033322067 /nfs/dbraw/zinc/32/20/67/1033322067.db2.gz SFYUHHKBFSDWJT-SFHVURJKSA-N 1 1 316.489 3.658 20 10 DHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2C)c1C ZINC000877664150 1033403536 /nfs/dbraw/zinc/40/35/36/1033403536.db2.gz LUSDWJOWRFSCRD-UHFFFAOYSA-N 1 1 314.477 3.526 20 10 DHCDMO Oc1ccc(F)cc1C[NH+]1CC(Cc2c(F)cccc2Cl)C1 ZINC001206180309 1033460740 /nfs/dbraw/zinc/46/07/40/1033460740.db2.gz JPDGUGGGGFRLMO-UHFFFAOYSA-N 1 1 323.770 3.998 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCCC(F)(F)CC2)cc1F ZINC000862465963 1033863980 /nfs/dbraw/zinc/86/39/80/1033863980.db2.gz AIABOFNIBVBGAO-UHFFFAOYSA-N 1 1 304.331 3.652 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCCC(F)(F)CC2)cc1F ZINC000862465963 1033863989 /nfs/dbraw/zinc/86/39/89/1033863989.db2.gz AIABOFNIBVBGAO-UHFFFAOYSA-N 1 1 304.331 3.652 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)c1O ZINC000862485205 1033866886 /nfs/dbraw/zinc/86/68/86/1033866886.db2.gz JUKQXAILHZGHDD-HOCLYGCPSA-N 1 1 319.445 3.500 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccccc3O)C2)cc1F ZINC000862540172 1033880489 /nfs/dbraw/zinc/88/04/89/1033880489.db2.gz APPRPHWNUIQHLN-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO C/C=C\C[C@@H]1CCC[N@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000862550478 1033886313 /nfs/dbraw/zinc/88/63/13/1033886313.db2.gz LVNMLDIQNDMNSQ-ZRUQZJFASA-N 1 1 305.418 3.588 20 10 DHCDMO Cc1ccccc1Cc1noc(C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879648403 1034069930 /nfs/dbraw/zinc/06/99/30/1034069930.db2.gz NIIAXYRDBDZESQ-CQSZACIVSA-N 1 1 323.396 3.525 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2cccs2)o1)c1ccccc1O ZINC000879650072 1034072285 /nfs/dbraw/zinc/07/22/85/1034072285.db2.gz ZSYMABIJUHPJDO-MNOVXSKESA-N 1 1 315.398 3.916 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000826120468 1034119741 /nfs/dbraw/zinc/11/97/41/1034119741.db2.gz DQFDUNOOXGACKG-WBVHZDCISA-N 1 1 317.816 3.662 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCOCC1CCC1)Cc1ccco1 ZINC000842152968 1034179276 /nfs/dbraw/zinc/17/92/76/1034179276.db2.gz LDJZCBPXCOZLHS-UHFFFAOYSA-N 1 1 315.413 3.804 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@@H](C)[C@@H]3C)cc2)CC1 ZINC000842163101 1034219557 /nfs/dbraw/zinc/21/95/57/1034219557.db2.gz JZXSWYSVEPEGLB-BBWFWOEESA-N 1 1 316.489 3.778 20 10 DHCDMO CC(C)[C@@H](CO)[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C(C)C ZINC001202513129 1034318889 /nfs/dbraw/zinc/31/88/89/1034318889.db2.gz JPRPPTMMKRRKFQ-MLGOLLRUSA-N 1 1 317.832 3.563 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3cccs3)C1)CCC2 ZINC000128444160 1034344709 /nfs/dbraw/zinc/34/47/09/1034344709.db2.gz OFSWPVOAXVPUBI-QGZVFWFLSA-N 1 1 315.438 3.516 20 10 DHCDMO Cc1nc(C(F)(F)F)c(C[N@H+](C)Cc2ccccc2O)s1 ZINC000183611799 1034404528 /nfs/dbraw/zinc/40/45/28/1034404528.db2.gz UYKIBGFGVIHZMC-UHFFFAOYSA-N 1 1 316.348 3.808 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2cccnc2)c1O ZINC000184744990 1034498479 /nfs/dbraw/zinc/49/84/79/1034498479.db2.gz MPNCOCLQVYEHEL-NSHDSACASA-N 1 1 306.793 3.642 20 10 DHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1F ZINC000185382979 1034546064 /nfs/dbraw/zinc/54/60/64/1034546064.db2.gz SFLHOUWKKGVXMJ-NSHDSACASA-N 1 1 307.340 3.920 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794835638 1034594765 /nfs/dbraw/zinc/59/47/65/1034594765.db2.gz RFSNDJUJOPHPEI-MWLCHTKSSA-N 1 1 318.244 3.901 20 10 DHCDMO CC[C@@H](CCO)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192944999 1034823181 /nfs/dbraw/zinc/82/31/81/1034823181.db2.gz XCUVPNHRRJBNDK-ZJUUUORDSA-N 1 1 306.233 3.758 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC000093838254 1035335520 /nfs/dbraw/zinc/33/55/20/1035335520.db2.gz IVSKAPCDEKZWME-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CCCOc1ccc(CNCC[NH+]2CCC(C)CC2)cc1C ZINC001177261936 1035361224 /nfs/dbraw/zinc/36/12/24/1035361224.db2.gz LJBBGEVDNXIVKM-UHFFFAOYSA-N 1 1 304.478 3.605 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC001177278136 1035362734 /nfs/dbraw/zinc/36/27/34/1035362734.db2.gz RZUAPJAGRCYLCF-UONOGXRCSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC001177278136 1035362736 /nfs/dbraw/zinc/36/27/36/1035362736.db2.gz RZUAPJAGRCYLCF-UONOGXRCSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(O)c(CNC[C@]2([NH+](C)C)CCC[C@@H](C)C2)c(Cl)c1 ZINC001177441434 1035372705 /nfs/dbraw/zinc/37/27/05/1035372705.db2.gz ATUXQOSQDJXROU-ACJLOTCBSA-N 1 1 324.896 3.954 20 10 DHCDMO CCN(C)c1ccc(C[N@H+](Cc2ccccc2)C[C@H](C)O)cc1 ZINC000773752135 1035437469 /nfs/dbraw/zinc/43/74/69/1035437469.db2.gz IBRMAXYHIAZOFP-KRWDZBQOSA-N 1 1 312.457 3.526 20 10 DHCDMO CCN(C)c1ccc(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1 ZINC000773754007 1035438070 /nfs/dbraw/zinc/43/80/70/1035438070.db2.gz JDWNSMTVWIWVNQ-UXHICEINSA-N 1 1 315.505 3.590 20 10 DHCDMO CO[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)Cc1ccccc1 ZINC001178763048 1035446516 /nfs/dbraw/zinc/44/65/16/1035446516.db2.gz YQPJLSAUOLYWOI-ZDUSSCGKSA-N 1 1 323.795 3.532 20 10 DHCDMO CCN(CC)c1ccc(CN[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1F ZINC001179139435 1035466141 /nfs/dbraw/zinc/46/61/41/1035466141.db2.gz HFLBZZFQPHLVBW-MRXNPFEDSA-N 1 1 321.484 3.634 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2CCN(C(C)(C)C)C2)cc1F ZINC001179139435 1035466144 /nfs/dbraw/zinc/46/61/44/1035466144.db2.gz HFLBZZFQPHLVBW-MRXNPFEDSA-N 1 1 321.484 3.634 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C1(C)C ZINC001179898461 1035523354 /nfs/dbraw/zinc/52/33/54/1035523354.db2.gz OAPBQKCYBYLPQE-JKSUJKDBSA-N 1 1 311.853 3.989 20 10 DHCDMO CO[C@]1(C)C[C@@H]([N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)C1(C)C ZINC001179958189 1035558127 /nfs/dbraw/zinc/55/81/27/1035558127.db2.gz WRPUVZPIROPCEN-WDJFIJIBSA-N 1 1 316.489 3.901 20 10 DHCDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042933 1035571567 /nfs/dbraw/zinc/57/15/67/1035571567.db2.gz MLJGNIROTSASLE-XJKCOSOUSA-N 1 1 324.415 3.508 20 10 DHCDMO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180097118 1035577141 /nfs/dbraw/zinc/57/71/41/1035577141.db2.gz BDNIAPMXXMYMCO-ZDUSSCGKSA-N 1 1 316.395 3.978 20 10 DHCDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180097118 1035577156 /nfs/dbraw/zinc/57/71/56/1035577156.db2.gz BDNIAPMXXMYMCO-ZDUSSCGKSA-N 1 1 316.395 3.978 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)c(O)c1 ZINC001180149089 1035610589 /nfs/dbraw/zinc/61/05/89/1035610589.db2.gz UOAQEJJUAQKDJT-JXFKEZNVSA-N 1 1 311.425 3.971 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C(=O)OC)[C@H](C)CC ZINC001193840254 1035735335 /nfs/dbraw/zinc/73/53/35/1035735335.db2.gz YAEAEGWPTSHGPC-PBHICJAKSA-N 1 1 307.434 3.582 20 10 DHCDMO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c(O)c1 ZINC001204280604 1035759263 /nfs/dbraw/zinc/75/92/63/1035759263.db2.gz LJZUSAGZEPHZNK-INIZCTEOSA-N 1 1 305.324 3.713 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c(O)c1 ZINC001181212486 1035867612 /nfs/dbraw/zinc/86/76/12/1035867612.db2.gz FHLDMZFFLGKPPV-LJQANCHMSA-N 1 1 315.388 3.780 20 10 DHCDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(F)cc(C(C)=O)c1O ZINC000773963131 1036076659 /nfs/dbraw/zinc/07/66/59/1036076659.db2.gz JJYFYHJRFLTNNL-GOSISDBHSA-N 1 1 323.408 3.515 20 10 DHCDMO COc1ccc(OCC[N@@H+](C)Cc2cccc(Cl)c2[O-])cc1 ZINC000775646165 1036176977 /nfs/dbraw/zinc/17/69/77/1036176977.db2.gz HLFDORDMUDHGBP-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774168269 1036210124 /nfs/dbraw/zinc/21/01/24/1036210124.db2.gz ZOKAZCUQMFGYHC-VHSXEESVSA-N 1 1 315.244 3.586 20 10 DHCDMO C[C@@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774211545 1036233466 /nfs/dbraw/zinc/23/34/66/1036233466.db2.gz UELDVFKILQVOSA-WDEREUQCSA-N 1 1 317.260 3.834 20 10 DHCDMO CCC(CC)[N@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CC1 ZINC000775649934 1036231753 /nfs/dbraw/zinc/23/17/53/1036231753.db2.gz VAEVBQXDNJCLME-UHFFFAOYSA-N 1 1 315.505 3.591 20 10 DHCDMO CCC(CC)[N@@H+](Cc1ccc(N2CCN(C)CC2)cc1)C1CC1 ZINC000775649934 1036231770 /nfs/dbraw/zinc/23/17/70/1036231770.db2.gz VAEVBQXDNJCLME-UHFFFAOYSA-N 1 1 315.505 3.591 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@H](O)C1(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774360998 1036298389 /nfs/dbraw/zinc/29/83/89/1036298389.db2.gz WJWNYCIHACPYBV-PAWXDDDFSA-N 1 1 304.217 3.509 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@H]2CCC[C@@H](C)C2)cc1 ZINC001195790685 1036347388 /nfs/dbraw/zinc/34/73/88/1036347388.db2.gz VKIRIRFCRGYNHI-SJORKVTESA-N 1 1 304.478 3.890 20 10 DHCDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)cc(O)c1O ZINC001204346726 1036388040 /nfs/dbraw/zinc/38/80/40/1036388040.db2.gz XDVLVXWIIKZPFL-NSHDSACASA-N 1 1 321.804 3.953 20 10 DHCDMO CCOC(=O)CC[N@@H+](Cc1cc(C(C)C)ccc1O)C(C)C ZINC001182624902 1036401348 /nfs/dbraw/zinc/40/13/48/1036401348.db2.gz IMPPUACTXIXQNJ-UHFFFAOYSA-N 1 1 307.434 3.679 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)c1 ZINC000775681872 1036412676 /nfs/dbraw/zinc/41/26/76/1036412676.db2.gz ULHUJGDGRPTZJZ-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](CCc2ccc(F)cc2)C2CC2)c1 ZINC000775702565 1036483191 /nfs/dbraw/zinc/48/31/91/1036483191.db2.gz YKTZHYPXTJADKN-UHFFFAOYSA-N 1 1 315.388 3.747 20 10 DHCDMO CCC[N@@H+](Cc1cccc(C)c1O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000775715824 1036534473 /nfs/dbraw/zinc/53/44/73/1036534473.db2.gz LVLIZCDEVBUWAA-JQHSSLGASA-N 1 1 303.446 3.726 20 10 DHCDMO CCC[N@@H+](Cc1cccc(C)c1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000775715823 1036534803 /nfs/dbraw/zinc/53/48/03/1036534803.db2.gz LVLIZCDEVBUWAA-CGTJXYLNSA-N 1 1 303.446 3.726 20 10 DHCDMO OCCCCCC[N@@H+](Cc1ccccc1)Cc1ccccc1O ZINC001203561050 1036547918 /nfs/dbraw/zinc/54/79/18/1036547918.db2.gz KVIQLKKXJIQXBT-UHFFFAOYSA-N 1 1 313.441 3.947 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](Cc3ccccc3)[C@H]2C)c1 ZINC000775724571 1036564488 /nfs/dbraw/zinc/56/44/88/1036564488.db2.gz MBWNZPSZVFSXEB-NVXWUHKLSA-N 1 1 311.425 3.854 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)c1 ZINC000775727012 1036572716 /nfs/dbraw/zinc/57/27/16/1036572716.db2.gz DYSSNWJNUGZTFO-XJKSGUPXSA-N 1 1 301.386 3.967 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)cc1F ZINC001183673014 1036643786 /nfs/dbraw/zinc/64/37/86/1036643786.db2.gz ORDGYBFAXOOXPQ-CQSZACIVSA-N 1 1 322.321 3.805 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)cc1F ZINC001183673014 1036643795 /nfs/dbraw/zinc/64/37/95/1036643795.db2.gz ORDGYBFAXOOXPQ-CQSZACIVSA-N 1 1 322.321 3.805 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]2CCCC[C@H]12 ZINC000915208379 1036708644 /nfs/dbraw/zinc/70/86/44/1036708644.db2.gz GCBDKQPHDXYMLU-BPLDGKMQSA-N 1 1 303.402 3.522 20 10 DHCDMO CSc1ccccc1C[C@@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183919989 1036710602 /nfs/dbraw/zinc/71/06/02/1036710602.db2.gz RYELMRFUZJQRIY-GFCCVEGCSA-N 1 1 305.418 3.974 20 10 DHCDMO COc1ccc(N(CCCn2cc[nH+]c2C)CC(C)C)cc1 ZINC000762925094 1037073025 /nfs/dbraw/zinc/07/30/25/1037073025.db2.gz CFQPXMJBRALBKU-UHFFFAOYSA-N 1 1 301.434 3.753 20 10 DHCDMO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902199 1037192310 /nfs/dbraw/zinc/19/23/10/1037192310.db2.gz HLSYJRPCVFOZKF-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902199 1037192314 /nfs/dbraw/zinc/19/23/14/1037192314.db2.gz HLSYJRPCVFOZKF-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903244 1037192664 /nfs/dbraw/zinc/19/26/64/1037192664.db2.gz JRXPOZSAYJJBMR-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903244 1037192674 /nfs/dbraw/zinc/19/26/74/1037192674.db2.gz JRXPOZSAYJJBMR-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCO1 ZINC000152475386 1037240943 /nfs/dbraw/zinc/24/09/43/1037240943.db2.gz RJPZIJNXCFXRTJ-INIZCTEOSA-N 1 1 315.413 3.555 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000776013177 1037299489 /nfs/dbraw/zinc/29/94/89/1037299489.db2.gz LAINGGNPSGNZGW-WFASDCNBSA-N 1 1 300.368 3.915 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@H](O)CC2CCCC2)C2CC2)cc1 ZINC001190437046 1038318439 /nfs/dbraw/zinc/31/84/39/1038318439.db2.gz RKAXYYGRIJATIC-HXUWFJFHSA-N 1 1 316.489 3.658 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487046 1038553230 /nfs/dbraw/zinc/55/32/30/1038553230.db2.gz GYLJACKXCOJFIO-FMKPAKJESA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487046 1038553240 /nfs/dbraw/zinc/55/32/40/1038553240.db2.gz GYLJACKXCOJFIO-FMKPAKJESA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccccc1O ZINC000775487346 1038556306 /nfs/dbraw/zinc/55/63/06/1038556306.db2.gz LYQPETDPFYDVAY-MJGOQNOKSA-N 1 1 321.424 3.956 20 10 DHCDMO CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491790 1038567631 /nfs/dbraw/zinc/56/76/31/1038567631.db2.gz JUMZOESCHPTYQJ-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491790 1038567639 /nfs/dbraw/zinc/56/76/39/1038567639.db2.gz JUMZOESCHPTYQJ-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000775501979 1038587197 /nfs/dbraw/zinc/58/71/97/1038587197.db2.gz NOGLXIYSRNOPDP-INIZCTEOSA-N 1 1 310.869 3.818 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1cccc(Br)c1)CC2 ZINC001203768466 1038705464 /nfs/dbraw/zinc/70/54/64/1038705464.db2.gz VGAWNQCKYHURGM-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO C[C@H]([NH2+]CCCn1cnc2ccccc21)c1ccc(F)cc1O ZINC000170788934 1038980437 /nfs/dbraw/zinc/98/04/37/1038980437.db2.gz UBZGLDRKFRLVME-ZDUSSCGKSA-N 1 1 313.376 3.622 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C ZINC000761225748 1040809675 /nfs/dbraw/zinc/80/96/75/1040809675.db2.gz LJSDGWCQCSOKHP-OAHLLOKOSA-N 1 1 320.452 3.530 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1 ZINC000761226275 1040816323 /nfs/dbraw/zinc/81/63/23/1040816323.db2.gz NRXSMWVYHMTCQO-OAQYLSRUSA-N 1 1 324.468 3.526 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000273414828 130118538 /nfs/dbraw/zinc/11/85/38/130118538.db2.gz QOXRQYYZCOFPQI-ABAIWWIYSA-N 1 1 308.422 3.546 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1ccc(F)cc1O ZINC000286220637 131224800 /nfs/dbraw/zinc/22/48/00/131224800.db2.gz SHYJBNYAJZLTLJ-XJNFMUPTSA-N 1 1 305.393 3.530 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000297581081 132024046 /nfs/dbraw/zinc/02/40/46/132024046.db2.gz HDAMJPXCSCCIBR-GOSISDBHSA-N 1 1 310.441 3.621 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cn1 ZINC000185397821 333208253 /nfs/dbraw/zinc/20/82/53/333208253.db2.gz RIECYQSAHCNULB-LBPRGKRZSA-N 1 1 304.365 3.566 20 10 DHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)[nH]1 ZINC000277405161 334088194 /nfs/dbraw/zinc/08/81/94/334088194.db2.gz ZDZLYPVFKYSHNM-GXSJLCMTSA-N 1 1 322.840 3.836 20 10 DHCDMO C[C@@H]1[N@@H+](Cc2c(O)ccc3ccccc32)CCC12CCOCC2 ZINC000375240869 337006527 /nfs/dbraw/zinc/00/65/27/337006527.db2.gz YLBAYRJYZMSTKQ-HNNXBMFYSA-N 1 1 311.425 3.936 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1O ZINC000375531175 337012992 /nfs/dbraw/zinc/01/29/92/337012992.db2.gz ZPMLVTZMZIMWRM-ZHALLVOQSA-N 1 1 303.446 3.606 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)c1 ZINC000377624216 337056699 /nfs/dbraw/zinc/05/66/99/337056699.db2.gz KLRJKGFPUHMXEH-QWQRMKEZSA-N 1 1 312.413 3.940 20 10 DHCDMO Oc1c(F)cccc1C[NH2+]Cc1ccc(-c2ccncc2)cc1 ZINC000378495752 337074414 /nfs/dbraw/zinc/07/44/14/337074414.db2.gz MMAVGDVZYMRXLM-UHFFFAOYSA-N 1 1 308.356 3.883 20 10 DHCDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccccc1O)CCC2 ZINC000179582112 337170226 /nfs/dbraw/zinc/17/02/26/337170226.db2.gz UDRAOQMHYITYAP-AWEZNQCLSA-N 1 1 302.443 3.921 20 10 DHCDMO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)cs1 ZINC000189933533 337283889 /nfs/dbraw/zinc/28/38/89/337283889.db2.gz WWKTXJYUNULUIH-KRWDZBQOSA-N 1 1 301.459 3.855 20 10 DHCDMO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cs1 ZINC000189933533 337283890 /nfs/dbraw/zinc/28/38/90/337283890.db2.gz WWKTXJYUNULUIH-KRWDZBQOSA-N 1 1 301.459 3.855 20 10 DHCDMO CC(C)COC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccco1 ZINC000180561455 519757480 /nfs/dbraw/zinc/75/74/80/519757480.db2.gz VJURYQPEEGJMAM-HNNXBMFYSA-N 1 1 307.365 3.628 20 10 DHCDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2cccc(OC)c2O)c1 ZINC000124240107 524119387 /nfs/dbraw/zinc/11/93/87/524119387.db2.gz CZVZOAAQHRPAOV-KRWDZBQOSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000180677800 524379490 /nfs/dbraw/zinc/37/94/90/524379490.db2.gz BHGISZDIULMCBF-FPTDNZKUSA-N 1 1 317.454 3.631 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c1O ZINC000180677823 524379770 /nfs/dbraw/zinc/37/97/70/524379770.db2.gz BHGISZDIULMCBF-PEBXRYMYSA-N 1 1 317.454 3.631 20 10 DHCDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)cc1O ZINC000368482633 525591371 /nfs/dbraw/zinc/59/13/71/525591371.db2.gz NVBWUJYGJREPPQ-IEVXNVSRSA-N 1 1 305.324 3.843 20 10 DHCDMO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286301679 535808785 /nfs/dbraw/zinc/80/87/85/535808785.db2.gz WRWOPRPENIBIJQ-IAGOWNOFSA-N 1 1 303.377 3.696 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(F)cc1O ZINC000287357693 535932230 /nfs/dbraw/zinc/93/22/30/535932230.db2.gz HCEMMLPNWKIKLR-DOTOQJQBSA-N 1 1 307.409 3.921 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](C)[C@H](F)C3)c2c1 ZINC000777965700 1032058182 /nfs/dbraw/zinc/05/81/82/1032058182.db2.gz FGCASYDLSNBMMI-YVEFUNNKSA-N 1 1 303.377 3.734 20 10 DHCDMO CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001279393584 1013275016 /nfs/dbraw/zinc/27/50/16/1013275016.db2.gz XQQDUXYKVHBMEY-HXUWFJFHSA-N 1 1 316.489 3.607 20 10 DHCDMO CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001279393584 1013275024 /nfs/dbraw/zinc/27/50/24/1013275024.db2.gz XQQDUXYKVHBMEY-HXUWFJFHSA-N 1 1 316.489 3.607 20 10 DHCDMO Cc1cccc(OCC[N@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000748099227 1013305299 /nfs/dbraw/zinc/30/52/99/1013305299.db2.gz ITRDTJBKUOMRSD-UHFFFAOYSA-N 1 1 311.425 3.700 20 10 DHCDMO CCCCOC(=O)[C@@H](C)[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC001167353751 1014032379 /nfs/dbraw/zinc/03/23/79/1014032379.db2.gz NWTDTESJRWCAOA-OAHLLOKOSA-N 1 1 319.445 3.869 20 10 DHCDMO C[N@@H+](CCC1CCOCC1)Cc1cc2c(cc1O)CCCC2 ZINC000160393295 1014043185 /nfs/dbraw/zinc/04/31/85/1014043185.db2.gz NDDZOWNUGLPTON-UHFFFAOYSA-N 1 1 303.446 3.520 20 10 DHCDMO C[C@H]1C(=O)CC[N@@H+](Cc2c(O)cccc2Cl)C12CCCC2 ZINC001140342371 1014639823 /nfs/dbraw/zinc/63/98/23/1014639823.db2.gz GSZHOKVGTLRAKY-LBPRGKRZSA-N 1 1 307.821 3.769 20 10 DHCDMO CC[C@@H]([NH2+]CCOc1ncccc1Cl)c1ccc(F)cc1O ZINC000796834893 1015104691 /nfs/dbraw/zinc/10/46/91/1015104691.db2.gz NUQMVJVEJOVECB-CQSZACIVSA-N 1 1 324.783 3.699 20 10 DHCDMO CCC1([NH+]2CCCCC2)CCN(Cc2ccccc2O)CC1 ZINC000895554506 1015202277 /nfs/dbraw/zinc/20/22/77/1015202277.db2.gz QWPZPAHRTFMERI-UHFFFAOYSA-N 1 1 302.462 3.623 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CC[C@H](c3nccs3)C2)cc1 ZINC000895580525 1015215573 /nfs/dbraw/zinc/21/55/73/1015215573.db2.gz BLOKHZOLUPQEBV-QGZUEGPWSA-N 1 1 313.470 3.712 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1O ZINC000895787990 1015303278 /nfs/dbraw/zinc/30/32/78/1015303278.db2.gz ALDARCASJHGHIY-WFASDCNBSA-N 1 1 315.335 3.565 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccs2)c(O)c1OC ZINC000891639907 1015476319 /nfs/dbraw/zinc/47/63/19/1015476319.db2.gz JUWDOXGNVDCOBC-NSHDSACASA-N 1 1 307.415 3.664 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c(O)c1 ZINC000896225271 1015510300 /nfs/dbraw/zinc/51/03/00/1015510300.db2.gz WYKFYYIPANBCPZ-ZDUSSCGKSA-N 1 1 303.299 3.567 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000896638419 1015693965 /nfs/dbraw/zinc/69/39/65/1015693965.db2.gz PPHFCGYUJJMUIZ-UHFFFAOYSA-N 1 1 305.324 3.501 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000896641977 1015695178 /nfs/dbraw/zinc/69/51/78/1015695178.db2.gz VRDXVNOMLRCBSB-UHFFFAOYSA-N 1 1 314.404 3.811 20 10 DHCDMO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1ccc(F)cc1O ZINC000796838518 1016022600 /nfs/dbraw/zinc/02/26/00/1016022600.db2.gz IHPFYFYWJASWKE-XOKHGSTOSA-N 1 1 309.425 3.903 20 10 DHCDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)[nH]1 ZINC000277324760 1016204591 /nfs/dbraw/zinc/20/45/91/1016204591.db2.gz TZYBGCRVOQRAFP-HBNTYKKESA-N 1 1 306.385 3.575 20 10 DHCDMO COc1ccc(OCCC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185127138 1016596727 /nfs/dbraw/zinc/59/67/27/1016596727.db2.gz WPJQMHAIVNROKB-ZDUSSCGKSA-N 1 1 319.376 3.660 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000185457091 1016934965 /nfs/dbraw/zinc/93/49/65/1016934965.db2.gz JUIRPHPCWBHHFZ-GOEBONIOSA-N 1 1 314.404 3.851 20 10 DHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)Oc1ccccc1F ZINC000185576218 1017020478 /nfs/dbraw/zinc/02/04/78/1017020478.db2.gz QYMMLBZGARQAMM-VXGBXAGGSA-N 1 1 307.340 3.789 20 10 DHCDMO CCc1ncc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000929185679 1032474625 /nfs/dbraw/zinc/47/46/25/1032474625.db2.gz XRJCAMDLGLBDKQ-UHFFFAOYSA-N 1 1 313.445 3.859 20 10 DHCDMO CCc1ncc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000929185679 1032474629 /nfs/dbraw/zinc/47/46/29/1032474629.db2.gz XRJCAMDLGLBDKQ-UHFFFAOYSA-N 1 1 313.445 3.859 20 10 DHCDMO Cc1cc([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)[nH]n1 ZINC000282815863 1032496493 /nfs/dbraw/zinc/49/64/93/1032496493.db2.gz AGTABWASJAXBCM-INIZCTEOSA-N 1 1 321.424 3.957 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+](Cc3c(O)ccc4ccccc43)C2)n[nH]1 ZINC000282815863 1032496496 /nfs/dbraw/zinc/49/64/96/1032496496.db2.gz AGTABWASJAXBCM-INIZCTEOSA-N 1 1 321.424 3.957 20 10 DHCDMO Cc1cc([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n[nH]1 ZINC000282815863 1032496500 /nfs/dbraw/zinc/49/65/00/1032496500.db2.gz AGTABWASJAXBCM-INIZCTEOSA-N 1 1 321.424 3.957 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@@H](CN[C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074815 1032548087 /nfs/dbraw/zinc/54/80/87/1032548087.db2.gz HZEDNPLVTICRFU-MSOLQXFVSA-N 1 1 317.521 3.771 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074815 1032548089 /nfs/dbraw/zinc/54/80/89/1032548089.db2.gz HZEDNPLVTICRFU-MSOLQXFVSA-N 1 1 317.521 3.771 20 10 DHCDMO CCCNc1cc[nH+]c(NCc2cc3ccccc3cc2O)n1 ZINC001171398698 1032582460 /nfs/dbraw/zinc/58/24/60/1032582460.db2.gz WDOMHVSWIDCJBS-UHFFFAOYSA-N 1 1 308.385 3.769 20 10 DHCDMO CCc1ccc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)o1 ZINC000160185792 1011954180 /nfs/dbraw/zinc/95/41/80/1011954180.db2.gz MTTSVJHTFHKSMQ-QGZVFWFLSA-N 1 1 315.413 3.729 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)c(C)o1 ZINC000160193019 1011986764 /nfs/dbraw/zinc/98/67/64/1011986764.db2.gz OMRMVLLRHFXBOJ-SFHVURJKSA-N 1 1 315.413 3.783 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](C[C@@H]3CCOC3)C1)CCC2 ZINC000773260613 1032663806 /nfs/dbraw/zinc/66/38/06/1032663806.db2.gz YLSXOGYRNSIUGQ-HOTGVXAUSA-N 1 1 315.457 3.520 20 10 DHCDMO Cc1csc(C[C@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)n1 ZINC000897299341 1017343955 /nfs/dbraw/zinc/34/39/55/1017343955.db2.gz ZKVWIFYAOZEYSO-CQSZACIVSA-N 1 1 302.443 3.530 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CCCOC3)C2)c(Cl)c1 ZINC000840915519 1017466226 /nfs/dbraw/zinc/46/62/26/1017466226.db2.gz CLLABNAXTRKAIQ-KRWDZBQOSA-N 1 1 309.837 3.747 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c(Cl)c1 ZINC000840915520 1017467765 /nfs/dbraw/zinc/46/77/65/1017467765.db2.gz CLLABNAXTRKAIQ-QGZVFWFLSA-N 1 1 309.837 3.747 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)cc1F ZINC000120510598 1017756453 /nfs/dbraw/zinc/75/64/53/1017756453.db2.gz GRJURZNOZKVGLM-UHFFFAOYSA-N 1 1 303.377 3.789 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccc(F)cc1O ZINC000278160897 1018235963 /nfs/dbraw/zinc/23/59/63/1018235963.db2.gz AKSFWSLHXPFOMX-LBPRGKRZSA-N 1 1 300.377 3.656 20 10 DHCDMO Cc1cc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414288 1018468976 /nfs/dbraw/zinc/46/89/76/1018468976.db2.gz UWGNBDZJMYBSKG-CTNGQTDRSA-N 1 1 323.484 3.811 20 10 DHCDMO Cc1cc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414288 1018468982 /nfs/dbraw/zinc/46/89/82/1018468982.db2.gz UWGNBDZJMYBSKG-CTNGQTDRSA-N 1 1 323.484 3.811 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278347331 1018596909 /nfs/dbraw/zinc/59/69/09/1018596909.db2.gz YPMLDMGKNHNRPJ-NXEZZACHSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000715719890 1018957234 /nfs/dbraw/zinc/95/72/34/1018957234.db2.gz VOAOOJGOXKQTGD-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000715719890 1018957242 /nfs/dbraw/zinc/95/72/42/1018957242.db2.gz VOAOOJGOXKQTGD-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO Cc1noc(C)c1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000052916852 1019053802 /nfs/dbraw/zinc/05/38/02/1019053802.db2.gz LAQCXCTUYCOZNH-UHFFFAOYSA-N 1 1 313.445 3.914 20 10 DHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC[C@]3(CCOC3)C2)c1O ZINC001143104358 1019377186 /nfs/dbraw/zinc/37/71/86/1019377186.db2.gz SDLBOPLRYNEHCX-IBGZPJMESA-N 1 1 303.446 3.692 20 10 DHCDMO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000170789262 1019434426 /nfs/dbraw/zinc/43/44/26/1019434426.db2.gz AKMDHHOTHDOSQR-RYUDHWBXSA-N 1 1 319.376 3.960 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(F)cc1O ZINC000170788964 1019435042 /nfs/dbraw/zinc/43/50/42/1019435042.db2.gz RJZXDMLIMOUFGK-SNVBAGLBSA-N 1 1 311.303 3.984 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000170789541 1019438395 /nfs/dbraw/zinc/43/83/95/1019438395.db2.gz JBASYHLQBAKUDM-MNOVXSKESA-N 1 1 304.321 3.851 20 10 DHCDMO CCC[N@@H+](CC(=O)Nc1cccc(C)c1)Cc1ccccc1O ZINC000727831058 1019817621 /nfs/dbraw/zinc/81/76/21/1019817621.db2.gz FVRBBYJEMPWZDH-UHFFFAOYSA-N 1 1 312.413 3.551 20 10 DHCDMO Cc1cc(CN2CCC[N@H+](C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000727823086 1019821509 /nfs/dbraw/zinc/82/15/09/1019821509.db2.gz AANMZZAHEWECFU-UHFFFAOYSA-N 1 1 318.505 3.914 20 10 DHCDMO Cc1cc(C[N@H+]2CCCN(C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000727823086 1019821521 /nfs/dbraw/zinc/82/15/21/1019821521.db2.gz AANMZZAHEWECFU-UHFFFAOYSA-N 1 1 318.505 3.914 20 10 DHCDMO Cc1cc(C[N@@H+]2CCCN(C(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000727823086 1019821532 /nfs/dbraw/zinc/82/15/32/1019821532.db2.gz AANMZZAHEWECFU-UHFFFAOYSA-N 1 1 318.505 3.914 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000730818746 1020030110 /nfs/dbraw/zinc/03/01/10/1020030110.db2.gz CLZDYYUMPIDATD-UHFFFAOYSA-N 1 1 321.424 3.991 20 10 DHCDMO c1cnc([C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)nc1 ZINC000922582891 1020142369 /nfs/dbraw/zinc/14/23/69/1020142369.db2.gz OQVGAZSPKRANBU-IBGZPJMESA-N 1 1 322.456 3.708 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@H](C)O1 ZINC000732184676 1020208700 /nfs/dbraw/zinc/20/87/00/1020208700.db2.gz CVYLSJNXLGARSK-HOCLYGCPSA-N 1 1 305.462 3.997 20 10 DHCDMO c1c(C[NH2+]Cc2ccc3c(c2)CCCO3)noc1-c1ccccc1 ZINC000921652623 1020317389 /nfs/dbraw/zinc/31/73/89/1020317389.db2.gz ZVABYFKYIHUDFN-UHFFFAOYSA-N 1 1 320.392 3.956 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922882087 1020327704 /nfs/dbraw/zinc/32/77/04/1020327704.db2.gz NSTAYECGJRAQQH-ZDUSSCGKSA-N 1 1 306.768 3.747 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nnc(C)s1 ZINC000282412774 1020369955 /nfs/dbraw/zinc/36/99/55/1020369955.db2.gz ISBQGDABJDCFGM-LBPRGKRZSA-N 1 1 305.447 3.915 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nnc(C)s1 ZINC000282412774 1020369968 /nfs/dbraw/zinc/36/99/68/1020369968.db2.gz ISBQGDABJDCFGM-LBPRGKRZSA-N 1 1 305.447 3.915 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cnn(CC2CCC2)c1 ZINC000903404157 1020405997 /nfs/dbraw/zinc/40/59/97/1020405997.db2.gz ITZDRNGZXHNRSG-OLZOCXBDSA-N 1 1 317.408 3.940 20 10 DHCDMO CC(C)C[C@@H]1COCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000733790217 1020445810 /nfs/dbraw/zinc/44/58/10/1020445810.db2.gz HMQBKGKWVSHHAX-MRXNPFEDSA-N 1 1 321.461 3.642 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490704 1032916513 /nfs/dbraw/zinc/91/65/13/1032916513.db2.gz MHSJNFYLBHJNGX-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490704 1032916520 /nfs/dbraw/zinc/91/65/20/1032916520.db2.gz MHSJNFYLBHJNGX-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cccc(Cl)c1[O-] ZINC000858490189 1032918862 /nfs/dbraw/zinc/91/88/62/1032918862.db2.gz CTVWVHZYGQTULU-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490326 1032918934 /nfs/dbraw/zinc/91/89/34/1032918934.db2.gz GFWNYCYCWRQUJS-HZPDHXFCSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490326 1032918943 /nfs/dbraw/zinc/91/89/43/1032918943.db2.gz GFWNYCYCWRQUJS-HZPDHXFCSA-N 1 1 312.457 3.928 20 10 DHCDMO Cc1cc(C[N@H+]2CCCOC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000735297682 1020716091 /nfs/dbraw/zinc/71/60/91/1020716091.db2.gz KUOBXFSJTSOYTL-UHFFFAOYSA-N 1 1 305.462 3.999 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCS[C@H](C)[C@@H]3C)c2c1 ZINC000735666156 1020760425 /nfs/dbraw/zinc/76/04/25/1020760425.db2.gz CKTTUUVPZARGPG-QWHCGFSZSA-N 1 1 317.454 3.880 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nc2c(s1)CCCC2 ZINC000736355130 1020811059 /nfs/dbraw/zinc/81/10/59/1020811059.db2.gz DQXZFLHMNODSFC-LBPRGKRZSA-N 1 1 314.454 3.808 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2ccn(C)n2)c(C)n1-c1ccccc1 ZINC000858542187 1032938679 /nfs/dbraw/zinc/93/86/79/1032938679.db2.gz IWUIHPVGNJUMBA-HNNXBMFYSA-N 1 1 308.429 3.678 20 10 DHCDMO CCN(CC)c1ccc(CN[C@@H](C)C[NH+]2CCCCC2)cc1F ZINC000740001238 1020923410 /nfs/dbraw/zinc/92/34/10/1020923410.db2.gz IJBXOHIGKRVGHK-INIZCTEOSA-N 1 1 321.484 3.636 20 10 DHCDMO C[C@H]([NH2+][C@H]1CO[C@@H](C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000858547053 1032941729 /nfs/dbraw/zinc/94/17/29/1032941729.db2.gz HYDXSNQTFNUPEY-SVIKCVJRSA-N 1 1 316.228 3.917 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](N(C)C)[C@@H]2C)ccc1N1CCCCC1 ZINC001171942401 1032946447 /nfs/dbraw/zinc/94/64/47/1032946447.db2.gz IKHOENBYLOZJTQ-PXNSSMCTSA-N 1 1 315.505 3.510 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@H](N(C)C)[C@@H]2C)ccc1N1CCCCC1 ZINC001171942401 1032946460 /nfs/dbraw/zinc/94/64/60/1032946460.db2.gz IKHOENBYLOZJTQ-PXNSSMCTSA-N 1 1 315.505 3.510 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cn3ccccc3n2)cc1 ZINC000741678494 1021041336 /nfs/dbraw/zinc/04/13/36/1021041336.db2.gz RIKOPJSVSNBJLP-UHFFFAOYSA-N 1 1 322.456 3.813 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cn3ccccc3n2)cc1 ZINC000741678494 1021041338 /nfs/dbraw/zinc/04/13/38/1021041338.db2.gz RIKOPJSVSNBJLP-UHFFFAOYSA-N 1 1 322.456 3.813 20 10 DHCDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000917428766 1021266482 /nfs/dbraw/zinc/26/64/82/1021266482.db2.gz XKNSMJPPPRAJBV-OLZOCXBDSA-N 1 1 315.413 3.626 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)CCC3)n1 ZINC000178232706 1021322566 /nfs/dbraw/zinc/32/25/66/1021322566.db2.gz SPPPLANKKUHXRL-LJQANCHMSA-N 1 1 308.425 3.921 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC001140924048 1021501237 /nfs/dbraw/zinc/50/12/37/1021501237.db2.gz BRTKMDSQRXKMRX-NSHDSACASA-N 1 1 306.759 3.790 20 10 DHCDMO Cc1n[nH]c(C)c1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000154715007 1021508902 /nfs/dbraw/zinc/50/89/02/1021508902.db2.gz XGDQABFMTZQJKJ-UHFFFAOYSA-N 1 1 311.385 3.528 20 10 DHCDMO Cc1n[nH]c(C)c1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000154715007 1021508910 /nfs/dbraw/zinc/50/89/10/1021508910.db2.gz XGDQABFMTZQJKJ-UHFFFAOYSA-N 1 1 311.385 3.528 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)c2nccn2C)cc1 ZINC000850410456 1021517915 /nfs/dbraw/zinc/51/79/15/1021517915.db2.gz MJZLPIFRIKGHEI-INIZCTEOSA-N 1 1 314.477 3.897 20 10 DHCDMO CC[C@H]([NH2+]Cc1c(OC)cccc1OC)c1ccc(F)cc1O ZINC000850504643 1021565417 /nfs/dbraw/zinc/56/54/17/1021565417.db2.gz BVGMESCDYGBDBA-HNNXBMFYSA-N 1 1 319.376 3.789 20 10 DHCDMO COc1ccnc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)c1F ZINC000850536415 1021590733 /nfs/dbraw/zinc/59/07/33/1021590733.db2.gz KEKGJHGPHZBQJS-SNVBAGLBSA-N 1 1 324.783 3.748 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(F)cc1O ZINC000850541906 1021595748 /nfs/dbraw/zinc/59/57/48/1021595748.db2.gz DNFGJNKQXOCYCK-DLBZAZTESA-N 1 1 301.361 3.965 20 10 DHCDMO C[C@H](C(=O)Nc1ccccc1Cl)[N@@H+](C)Cc1ccccc1O ZINC000109772975 1021746344 /nfs/dbraw/zinc/74/63/44/1021746344.db2.gz QKGKTVPTMOURMJ-GFCCVEGCSA-N 1 1 318.804 3.505 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1nccn1C ZINC000182910011 1021857079 /nfs/dbraw/zinc/85/70/79/1021857079.db2.gz RKYKOYZLXWPPPM-MRXNPFEDSA-N 1 1 312.461 3.507 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC(=O)OC(C)(C)C)cc1 ZINC000919807151 1021909198 /nfs/dbraw/zinc/90/91/98/1021909198.db2.gz WXGRRNVYORWEIL-UHFFFAOYSA-N 1 1 320.477 3.696 20 10 DHCDMO CCc1cc(C[N@H+]2CCO[C@@H](CC)C2)c(O)c(C(C)(C)C)c1 ZINC000919939926 1021975777 /nfs/dbraw/zinc/97/57/77/1021975777.db2.gz KPMOQGNHUUYEOJ-INIZCTEOSA-N 1 1 305.462 3.863 20 10 DHCDMO Oc1ccccc1CN1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000183293182 1022086348 /nfs/dbraw/zinc/08/63/48/1022086348.db2.gz USYHUAFLYHGKMN-UHFFFAOYSA-N 1 1 324.468 3.533 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCN(CCCc2ccccc2)CC1 ZINC000183293182 1022086366 /nfs/dbraw/zinc/08/63/66/1022086366.db2.gz USYHUAFLYHGKMN-UHFFFAOYSA-N 1 1 324.468 3.533 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCCN(CCCc2ccccc2)CC1 ZINC000183293182 1022086383 /nfs/dbraw/zinc/08/63/83/1022086383.db2.gz USYHUAFLYHGKMN-UHFFFAOYSA-N 1 1 324.468 3.533 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2cc(C)on2)cc1 ZINC000920258217 1022090901 /nfs/dbraw/zinc/09/09/01/1022090901.db2.gz HGYJPYUIBQYZCO-UHFFFAOYSA-N 1 1 301.434 3.899 20 10 DHCDMO CCN(C)c1ccc([C@H](C)N[C@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000766472727 1022123146 /nfs/dbraw/zinc/12/31/46/1022123146.db2.gz BCSPGSXRKCRPGA-IEZWGBDMSA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)c1cccc(NC(=O)C[N@H+](C)Cc2ccccc2O)c1 ZINC000111235115 1022252297 /nfs/dbraw/zinc/25/22/97/1022252297.db2.gz BYYYSPAWMSQEDB-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO CC(C)c1cccc(NC(=O)C[N@@H+](C)Cc2ccccc2O)c1 ZINC000111235115 1022252300 /nfs/dbraw/zinc/25/23/00/1022252300.db2.gz BYYYSPAWMSQEDB-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO C[N@H+](Cc1cc(-c2cccs2)on1)Cc1ccccc1O ZINC000111235905 1022252597 /nfs/dbraw/zinc/25/25/97/1022252597.db2.gz LGPCPOSHSRZRSM-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO C[N@@H+](Cc1cc(-c2cccs2)on1)Cc1ccccc1O ZINC000111235905 1022252607 /nfs/dbraw/zinc/25/26/07/1022252607.db2.gz LGPCPOSHSRZRSM-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CSc3ccccc3C2)cc1 ZINC001172210182 1033042237 /nfs/dbraw/zinc/04/22/37/1033042237.db2.gz VSUBTCUBXBFPOQ-SFHVURJKSA-N 1 1 312.482 3.901 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000266141109 1022288273 /nfs/dbraw/zinc/28/82/73/1022288273.db2.gz HGBPGAUPBHPVKQ-CTXDPNEZSA-N 1 1 315.505 3.638 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc1 ZINC000266141109 1022288283 /nfs/dbraw/zinc/28/82/83/1022288283.db2.gz HGBPGAUPBHPVKQ-CTXDPNEZSA-N 1 1 315.505 3.638 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)cc1C ZINC000853613703 1022299477 /nfs/dbraw/zinc/29/94/77/1022299477.db2.gz IHPIARZMMJXRRM-GXTWGEPZSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)cc1C ZINC000853613703 1022299484 /nfs/dbraw/zinc/29/94/84/1022299484.db2.gz IHPIARZMMJXRRM-GXTWGEPZSA-N 1 1 317.351 3.551 20 10 DHCDMO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000853630175 1022300963 /nfs/dbraw/zinc/30/09/63/1022300963.db2.gz DCJHGVXJQDUIIS-AWEZNQCLSA-N 1 1 320.392 3.896 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@](C)(C(F)F)O1 ZINC000853631257 1022301030 /nfs/dbraw/zinc/30/10/30/1022301030.db2.gz UQQOLVZOYMFBEF-KPZWWZAWSA-N 1 1 321.367 3.790 20 10 DHCDMO C[C@H]([NH2+]CCOc1cccc(F)c1)c1cc(F)cc(F)c1O ZINC000756447811 1022382514 /nfs/dbraw/zinc/38/25/14/1022382514.db2.gz YRCHCGMCPNLINZ-JTQLQIEISA-N 1 1 311.303 3.539 20 10 DHCDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2ccccc2O)c1 ZINC000179554042 1022470492 /nfs/dbraw/zinc/47/04/92/1022470492.db2.gz YTTWYBZWEAYYKD-KRWDZBQOSA-N 1 1 313.397 3.747 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000179583261 1022475705 /nfs/dbraw/zinc/47/57/05/1022475705.db2.gz DVYXCMGTPRWJAI-IBGZPJMESA-N 1 1 324.468 3.736 20 10 DHCDMO CC[N@H+](Cc1ccccc1O)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000179583261 1022475711 /nfs/dbraw/zinc/47/57/11/1022475711.db2.gz DVYXCMGTPRWJAI-IBGZPJMESA-N 1 1 324.468 3.736 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000179672249 1022499800 /nfs/dbraw/zinc/49/98/00/1022499800.db2.gz OQETYPHCCZGEAL-QGZVFWFLSA-N 1 1 315.438 3.691 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000272900419 1022517711 /nfs/dbraw/zinc/51/77/11/1022517711.db2.gz UZWNTZWZAQVWAO-ZIFCJYIRSA-N 1 1 324.468 3.953 20 10 DHCDMO C[C@H]([NH2+]CCOc1ccc(F)c(F)c1)c1ccc(F)cc1O ZINC000186000816 1022541968 /nfs/dbraw/zinc/54/19/68/1022541968.db2.gz ULATUUKOSWWLIY-JTQLQIEISA-N 1 1 311.303 3.539 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000776770419 1022558156 /nfs/dbraw/zinc/55/81/56/1022558156.db2.gz APVRDSCIQRISSH-KRWDZBQOSA-N 1 1 303.446 3.609 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@H](C3CC3)C1)oc1ccccc12 ZINC000776772736 1022560585 /nfs/dbraw/zinc/56/05/85/1022560585.db2.gz PQHNYUVCADIRQT-FQEVSTJZSA-N 1 1 323.392 3.902 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCc3ccccc3[C@@H]2C)cc1OC ZINC000180076135 1022624939 /nfs/dbraw/zinc/62/49/39/1022624939.db2.gz RLQYEIUWUMYMDQ-ZDUSSCGKSA-N 1 1 313.397 3.529 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(C(C)C)CC2)cc1 ZINC000180406459 1022714445 /nfs/dbraw/zinc/71/44/45/1022714445.db2.gz AGOAWNWUMMTFIR-INIZCTEOSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccccn1)c1cccc(C(F)(F)F)c1O ZINC000798179649 1022855774 /nfs/dbraw/zinc/85/57/74/1022855774.db2.gz INYVQSRXTMOCQB-LLVKDONJSA-N 1 1 310.319 3.699 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1CCCO1)c1cccc(C(F)(F)F)c1O ZINC000798181149 1022875625 /nfs/dbraw/zinc/87/56/25/1022875625.db2.gz HCRPFDUKXDBVOB-GHMZBOCLSA-N 1 1 303.324 3.631 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000768137080 1022904641 /nfs/dbraw/zinc/90/46/41/1022904641.db2.gz FZGNKIKGWKMAAL-QGZVFWFLSA-N 1 1 312.413 3.913 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2CCN(CC)CC2)cc1F ZINC000768233100 1022931417 /nfs/dbraw/zinc/93/14/17/1022931417.db2.gz KVDJCQDSNKQGQP-UHFFFAOYSA-N 1 1 321.484 3.588 20 10 DHCDMO CCN(CC)c1ccc(CN(C)C2CC[NH+](CC)CC2)cc1F ZINC000768233100 1022931419 /nfs/dbraw/zinc/93/14/19/1022931419.db2.gz KVDJCQDSNKQGQP-UHFFFAOYSA-N 1 1 321.484 3.588 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCN(Cc3ccccc3C)CC2)c1 ZINC000768251562 1022932367 /nfs/dbraw/zinc/93/23/67/1022932367.db2.gz ORVXZGOIBBDPEX-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@H+](Cc3ccccc3C)CC2)c1 ZINC000768251562 1022932382 /nfs/dbraw/zinc/93/23/82/1022932382.db2.gz ORVXZGOIBBDPEX-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[N@@H+](Cc3ccccc3C)CC2)c1 ZINC000768251562 1022932395 /nfs/dbraw/zinc/93/23/95/1022932395.db2.gz ORVXZGOIBBDPEX-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000768257533 1022932843 /nfs/dbraw/zinc/93/28/43/1022932843.db2.gz KYXUMABIRLBQCL-UHFFFAOYSA-N 1 1 310.441 3.931 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c(O)c1 ZINC000768261662 1022935308 /nfs/dbraw/zinc/93/53/08/1022935308.db2.gz FUPVPIOIXYXZHM-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO COc1ccsc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768258196 1022936984 /nfs/dbraw/zinc/93/69/84/1022936984.db2.gz TUJNAOKNSJDWPP-UHFFFAOYSA-N 1 1 316.470 3.987 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccccc1F)C(C)C ZINC000768335556 1022946570 /nfs/dbraw/zinc/94/65/70/1022946570.db2.gz XKRGTDKJMNYEMW-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO c1cc(N2CCOCC2)ccc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000768339713 1022948790 /nfs/dbraw/zinc/94/87/90/1022948790.db2.gz YDZHWVYGLSPRBF-UHFFFAOYSA-N 1 1 314.473 3.820 20 10 DHCDMO COc1cc(C[N@H+]2CCCc3sccc3C2)c(O)cc1C ZINC000768450151 1022967567 /nfs/dbraw/zinc/96/75/67/1022967567.db2.gz IJSQUBCDURAKES-UHFFFAOYSA-N 1 1 303.427 3.719 20 10 DHCDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768447391 1022968202 /nfs/dbraw/zinc/96/82/02/1022968202.db2.gz OSGNHUGWNUXBRO-UKRRQHHQSA-N 1 1 307.434 3.810 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H](C3CCOCC3)C1)CCCC2 ZINC000768465450 1022974309 /nfs/dbraw/zinc/97/43/09/1022974309.db2.gz NANYXFLDCRVINW-GOSISDBHSA-N 1 1 315.457 3.520 20 10 DHCDMO C[N@@H+](CCc1cccc(Br)c1)Cc1ccccc1O ZINC000768505241 1022976634 /nfs/dbraw/zinc/97/66/34/1022976634.db2.gz NQZKHEZXYLDMPH-UHFFFAOYSA-N 1 1 320.230 3.829 20 10 DHCDMO C[C@H](C1CC1)[N@@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000768532871 1022983136 /nfs/dbraw/zinc/98/31/36/1022983136.db2.gz PNBOAMUTNPTZGR-SNVBAGLBSA-N 1 1 310.235 3.918 20 10 DHCDMO COC[C@@H]1CCCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000768539885 1022985399 /nfs/dbraw/zinc/98/53/99/1022985399.db2.gz DDLZNLDRWNHKAZ-LJQANCHMSA-N 1 1 316.489 3.925 20 10 DHCDMO C[N@@H+](Cc1cccc(OC(C)(C)C)n1)Cc1ccccc1O ZINC000768728766 1023016364 /nfs/dbraw/zinc/01/63/64/1023016364.db2.gz VKQLDTGQAAVPEC-UHFFFAOYSA-N 1 1 300.402 3.597 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)c(F)c2)on1 ZINC000768879143 1023046481 /nfs/dbraw/zinc/04/64/81/1023046481.db2.gz SKRMSAXSDTWYNT-INIZCTEOSA-N 1 1 303.381 3.525 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(F)c2)on1 ZINC000768879143 1023046489 /nfs/dbraw/zinc/04/64/89/1023046489.db2.gz SKRMSAXSDTWYNT-INIZCTEOSA-N 1 1 303.381 3.525 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC000768913745 1023055349 /nfs/dbraw/zinc/05/53/49/1023055349.db2.gz RRJUDGHKXRLONK-SOLBZPMBSA-N 1 1 302.462 3.538 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000768989801 1023066385 /nfs/dbraw/zinc/06/63/85/1023066385.db2.gz BMEOSMCVRZZGCR-INIZCTEOSA-N 1 1 315.388 3.747 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C[C@H]2CCOC2)C2CC2)cc1C(C)C ZINC000123776769 1023067029 /nfs/dbraw/zinc/06/70/29/1023067029.db2.gz SUWOUUDLYAUACA-OAHLLOKOSA-N 1 1 303.446 3.825 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccc(C)s3)CC2)cc1 ZINC000768997162 1023075815 /nfs/dbraw/zinc/07/58/15/1023075815.db2.gz AJLKWOAYNDMOKS-UHFFFAOYSA-N 1 1 316.470 3.777 20 10 DHCDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769164360 1023095366 /nfs/dbraw/zinc/09/53/66/1023095366.db2.gz IVKYKHMTDAAHHD-LJQANCHMSA-N 1 1 316.489 3.924 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315682 1023119165 /nfs/dbraw/zinc/11/91/65/1023119165.db2.gz KQWRTJVWFXOBHJ-GOSISDBHSA-N 1 1 316.489 3.789 20 10 DHCDMO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769311204 1023119283 /nfs/dbraw/zinc/11/92/83/1023119283.db2.gz ZQJZTBKKOYPINN-JXFKEZNVSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000769405754 1023143606 /nfs/dbraw/zinc/14/36/06/1023143606.db2.gz XRCFAQCWAARXFX-UHFFFAOYSA-N 1 1 315.388 3.747 20 10 DHCDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769426330 1023146516 /nfs/dbraw/zinc/14/65/16/1023146516.db2.gz PZSBEDQFPFRWHD-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@](C)(c3ccccc3)C2)c1O ZINC000769424583 1023146640 /nfs/dbraw/zinc/14/66/40/1023146640.db2.gz LSIFGQSUGFMYAT-HXUWFJFHSA-N 1 1 311.425 3.955 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CC[C@](C)(O)C2)cc1 ZINC000769541499 1023167044 /nfs/dbraw/zinc/16/70/44/1023167044.db2.gz CCTQFIQIFCGTKK-NRFANRHFSA-N 1 1 324.468 3.670 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1F ZINC000769509382 1023170131 /nfs/dbraw/zinc/17/01/31/1023170131.db2.gz XGBZPSDXCDJMEA-QGZVFWFLSA-N 1 1 302.368 3.978 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1F ZINC000769509382 1023170134 /nfs/dbraw/zinc/17/01/34/1023170134.db2.gz XGBZPSDXCDJMEA-QGZVFWFLSA-N 1 1 302.368 3.978 20 10 DHCDMO CCC[N@H+](C)C[C@@H]1CCN(Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507871 1023170894 /nfs/dbraw/zinc/17/08/94/1023170894.db2.gz POEFTRWAYJNEHE-IBGZPJMESA-N 1 1 317.521 3.697 20 10 DHCDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507871 1023170895 /nfs/dbraw/zinc/17/08/95/1023170895.db2.gz POEFTRWAYJNEHE-IBGZPJMESA-N 1 1 317.521 3.697 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)cc1 ZINC000769519231 1023172326 /nfs/dbraw/zinc/17/23/26/1023172326.db2.gz LWPCOUUYEVVULC-LJQANCHMSA-N 1 1 316.489 3.781 20 10 DHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C12CCC2 ZINC000770354548 1023303926 /nfs/dbraw/zinc/30/39/26/1023303926.db2.gz YANOPWMZCDYFTE-MSOLQXFVSA-N 1 1 302.462 3.532 20 10 DHCDMO CC[C@@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccc(F)cc1O ZINC000796667437 1023330085 /nfs/dbraw/zinc/33/00/85/1023330085.db2.gz VDISDLYQINXUOF-MRXNPFEDSA-N 1 1 308.441 3.837 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000771935161 1023489678 /nfs/dbraw/zinc/48/96/78/1023489678.db2.gz LXLGHIQURAPRND-UHFFFAOYSA-N 1 1 315.436 3.590 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1cc(F)cc(F)c1O ZINC000785570862 1023595912 /nfs/dbraw/zinc/59/59/12/1023595912.db2.gz VKQZLFRDWYFUJX-PSLIRLAXSA-N 1 1 323.314 3.984 20 10 DHCDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876790857 1033144567 /nfs/dbraw/zinc/14/45/67/1033144567.db2.gz DHXPSMXPNCYOOP-INIZCTEOSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000785990254 1023649363 /nfs/dbraw/zinc/64/93/63/1023649363.db2.gz ZYVZEUSUWVPKRL-MBOZVWFJSA-N 1 1 316.489 3.658 20 10 DHCDMO Oc1ccccc1C[N@@H+](CC[C@@H]1CCCO1)Cc1ccco1 ZINC000787261984 1023776857 /nfs/dbraw/zinc/77/68/57/1023776857.db2.gz YDNABYUSESVSDH-INIZCTEOSA-N 1 1 301.386 3.557 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]CCCN2CCC(C)CC2)c(O)c1 ZINC000788507184 1023896105 /nfs/dbraw/zinc/89/61/05/1023896105.db2.gz YIUPLPLONPGOOQ-QGZVFWFLSA-N 1 1 304.478 3.782 20 10 DHCDMO CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788504152 1023896240 /nfs/dbraw/zinc/89/62/40/1023896240.db2.gz BKSUFHVXANCENJ-GFCCVEGCSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CCOCC1 ZINC000788629722 1023916881 /nfs/dbraw/zinc/91/68/81/1023916881.db2.gz CYVNWAJIUFPUBU-MNOVXSKESA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788691359 1023920235 /nfs/dbraw/zinc/92/02/35/1023920235.db2.gz MPBRTUGLPONZHA-OUAUKWLOSA-N 1 1 303.324 3.629 20 10 DHCDMO C[C@H]([NH2+]CCOC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000788707460 1023924268 /nfs/dbraw/zinc/92/42/68/1023924268.db2.gz YMQQCDAGQHVODJ-JTQLQIEISA-N 1 1 305.340 3.877 20 10 DHCDMO C[C@H]([NH2+]Cc1cccnc1F)c1cccc(C(F)(F)F)c1O ZINC000788805950 1023936397 /nfs/dbraw/zinc/93/63/97/1023936397.db2.gz MMTJPIXOYADRDO-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO COc1ccc([C@H]([NH2+]Cc2cc(F)cc(F)c2O)C2CC2)cc1 ZINC000882881339 1024157329 /nfs/dbraw/zinc/15/73/29/1024157329.db2.gz IXWMFBYYQVELQP-QGZVFWFLSA-N 1 1 319.351 3.920 20 10 DHCDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC000882881629 1024158381 /nfs/dbraw/zinc/15/83/81/1024158381.db2.gz WFEHGRWREPBPQK-NSHDSACASA-N 1 1 307.340 3.920 20 10 DHCDMO CCC[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccccc1O ZINC000789727884 1024158684 /nfs/dbraw/zinc/15/86/84/1024158684.db2.gz JLWYXLAXXQGNAI-UHFFFAOYSA-N 1 1 311.385 3.788 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nc3ccccc3o2)cc1 ZINC000876944530 1033190251 /nfs/dbraw/zinc/19/02/51/1033190251.db2.gz NUXLPLQLXRVUSD-UHFFFAOYSA-N 1 1 309.413 3.964 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1)OCO2 ZINC000026237668 1024176919 /nfs/dbraw/zinc/17/69/19/1024176919.db2.gz CVKSXJNUXNATMF-OAHLLOKOSA-N 1 1 315.344 3.597 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccccc1OC1CCC1 ZINC000883011844 1024210717 /nfs/dbraw/zinc/21/07/17/1024210717.db2.gz LAGFCFYJEQQCKO-UHFFFAOYSA-N 1 1 319.351 3.892 20 10 DHCDMO CC(C)[C@H](O)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883180039 1024270672 /nfs/dbraw/zinc/27/06/72/1024270672.db2.gz QVZHZUVROAPACA-IRXDYDNUSA-N 1 1 321.367 3.518 20 10 DHCDMO CCN(C)c1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790961316 1024407433 /nfs/dbraw/zinc/40/74/33/1024407433.db2.gz RFUQLGPVOOIVAT-UHFFFAOYSA-N 1 1 322.811 3.931 20 10 DHCDMO COC1CCC(CC[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC000790986167 1024411291 /nfs/dbraw/zinc/41/12/91/1024411291.db2.gz IBYZWPOMRYXZMH-UHFFFAOYSA-N 1 1 315.816 3.870 20 10 DHCDMO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790972105 1024419976 /nfs/dbraw/zinc/41/99/76/1024419976.db2.gz DDHAYMRHJXEPNX-BZNIZROVSA-N 1 1 315.816 3.726 20 10 DHCDMO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790980683 1024423513 /nfs/dbraw/zinc/42/35/13/1024423513.db2.gz PQZVJCMYTRVPND-QMTHXVAHSA-N 1 1 315.816 3.868 20 10 DHCDMO COc1cc(O)c(C[N@@H+](Cc2cccs2)C(C)C)cc1OC ZINC000271055294 1024452267 /nfs/dbraw/zinc/45/22/67/1024452267.db2.gz ABOLCYXDRQEBOL-UHFFFAOYSA-N 1 1 321.442 3.882 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCc3sccc3[C@@H]2C)cc1OC ZINC000271114131 1024456968 /nfs/dbraw/zinc/45/69/68/1024456968.db2.gz VRFKMSRTCVBSNN-NSHDSACASA-N 1 1 319.426 3.590 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCc2c(F)cccc21 ZINC001202611811 1024602544 /nfs/dbraw/zinc/60/25/44/1024602544.db2.gz MWOCQCUVGOJNSL-MRXNPFEDSA-N 1 1 307.315 3.977 20 10 DHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3cccc(C)c3O)CCO2)cc1 ZINC000792189988 1024645784 /nfs/dbraw/zinc/64/57/84/1024645784.db2.gz PPXXXADFVWXGGO-LJQANCHMSA-N 1 1 311.425 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ccnn2C(C)C)cc1 ZINC000792772727 1024795012 /nfs/dbraw/zinc/79/50/12/1024795012.db2.gz AMNHKAHUUHKSMA-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccnn2C(C)C)cc1 ZINC000792772727 1024795016 /nfs/dbraw/zinc/79/50/16/1024795016.db2.gz AMNHKAHUUHKSMA-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc3ccccc3c2[O-])CC1 ZINC000321442633 1024902710 /nfs/dbraw/zinc/90/27/10/1024902710.db2.gz GGIYNMNSDQWKAM-OAHLLOKOSA-N 1 1 312.457 3.928 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000793231292 1024945571 /nfs/dbraw/zinc/94/55/71/1024945571.db2.gz MBJZJWZEFUKNNL-PWSUYJOCSA-N 1 1 303.324 3.564 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172551 1025008006 /nfs/dbraw/zinc/00/80/06/1025008006.db2.gz MNVOLRLYCCQEOP-SMDDNHRTSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172551 1025008018 /nfs/dbraw/zinc/00/80/18/1025008018.db2.gz MNVOLRLYCCQEOP-SMDDNHRTSA-N 1 1 310.235 3.919 20 10 DHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000793369504 1025008234 /nfs/dbraw/zinc/00/82/34/1025008234.db2.gz IYMUFVSCPJPUEA-SFHVURJKSA-N 1 1 316.489 3.781 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)cc1 ZINC000793610305 1025128092 /nfs/dbraw/zinc/12/80/92/1025128092.db2.gz STRFTKNFONXLLW-RBUKOAKNSA-N 1 1 302.462 3.676 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1C[C@@]12CCOC2)C1CCCC1 ZINC000886008525 1025436427 /nfs/dbraw/zinc/43/64/27/1025436427.db2.gz OPNDKYWPYOMSHL-QFBILLFUSA-N 1 1 301.430 3.563 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)c1OC ZINC001143536703 1025554500 /nfs/dbraw/zinc/55/45/00/1025554500.db2.gz FIUFLJDYMOMSMV-UHFFFAOYSA-N 1 1 316.420 3.922 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccc2c(c1)OCCO2 ZINC000886491980 1025649815 /nfs/dbraw/zinc/64/98/15/1025649815.db2.gz YQXLBNRORCYXBA-VXGBXAGGSA-N 1 1 317.360 3.714 20 10 DHCDMO Cc1ccnc(N)c1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000894017997 1025651796 /nfs/dbraw/zinc/65/17/96/1025651796.db2.gz WIZCVRUAEIKXSK-UHFFFAOYSA-N 1 1 311.429 3.623 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1c(O)cccc1F ZINC000886501793 1025657015 /nfs/dbraw/zinc/65/70/15/1025657015.db2.gz ZJFKQIAPKOMWOK-HUUCEWRRSA-N 1 1 314.404 3.708 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)c1c(O)cccc1F ZINC000886540314 1025687167 /nfs/dbraw/zinc/68/71/67/1025687167.db2.gz CMWCWAWXDYFDIL-SQWLQELKSA-N 1 1 317.404 3.737 20 10 DHCDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1c(O)cccc1F ZINC000886542894 1025691420 /nfs/dbraw/zinc/69/14/20/1025691420.db2.gz HLJMRDRTJOQSAG-ZBQZNYHESA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@H]([NH2+]C[C@H](O)c1ccccc1Cl)c1c(O)cccc1F ZINC000886549475 1025695014 /nfs/dbraw/zinc/69/50/14/1025695014.db2.gz IRWZAJJSDQFOGU-BONVTDFDSA-N 1 1 309.768 3.569 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c([O-])cccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000886588728 1025726155 /nfs/dbraw/zinc/72/61/55/1025726155.db2.gz XXONVWGFNGYVCD-QLFBSQMISA-N 1 1 320.452 3.835 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2c(O)cccc2F)nc1 ZINC000886641132 1025752723 /nfs/dbraw/zinc/75/27/23/1025752723.db2.gz AHCXMARXIDGBCE-ZDUSSCGKSA-N 1 1 302.393 3.863 20 10 DHCDMO C[C@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886646279 1025756366 /nfs/dbraw/zinc/75/63/66/1025756366.db2.gz DMZSHCTVGARWCP-BBRMVZONSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886646281 1025758789 /nfs/dbraw/zinc/75/87/89/1025758789.db2.gz DMZSHCTVGARWCP-CZUORRHYSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000806180921 1025835379 /nfs/dbraw/zinc/83/53/79/1025835379.db2.gz SXWLVZYNWMQNBK-YPMHNXCESA-N 1 1 323.795 3.611 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(C)c2O)o1 ZINC000137069671 1025879160 /nfs/dbraw/zinc/87/91/60/1025879160.db2.gz JMCQCTFMJXEWGQ-INIZCTEOSA-N 1 1 301.386 3.777 20 10 DHCDMO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H]1CCOC(C)(C)C1 ZINC000289669645 1026122452 /nfs/dbraw/zinc/12/24/52/1026122452.db2.gz FVKPTJIGQYMERW-HNNXBMFYSA-N 1 1 323.408 3.513 20 10 DHCDMO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)[C@H]1CCOC(C)(C)C1 ZINC000289669645 1026122455 /nfs/dbraw/zinc/12/24/55/1026122455.db2.gz FVKPTJIGQYMERW-HNNXBMFYSA-N 1 1 323.408 3.513 20 10 DHCDMO CCN(CC)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000289806164 1026181652 /nfs/dbraw/zinc/18/16/52/1026181652.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO CCN(CC)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000289806164 1026181659 /nfs/dbraw/zinc/18/16/59/1026181659.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000289806164 1026181663 /nfs/dbraw/zinc/18/16/63/1026181663.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000289806164 1026181673 /nfs/dbraw/zinc/18/16/73/1026181673.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO CCN(CC)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000289806164 1026181678 /nfs/dbraw/zinc/18/16/78/1026181678.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO CCN(CC)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000289806164 1026181685 /nfs/dbraw/zinc/18/16/85/1026181685.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 1 1 315.505 3.590 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2c(O)ccc3ccncc32)no1 ZINC000747448122 1026184810 /nfs/dbraw/zinc/18/48/10/1026184810.db2.gz BNTGMVGRUVBJRV-QGZVFWFLSA-N 1 1 309.369 3.574 20 10 DHCDMO C[C@@H]1[C@@H](N2CCCC2)CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000808190856 1026222804 /nfs/dbraw/zinc/22/28/04/1026222804.db2.gz KHRUJEJBKZXHMG-BEFAXECRSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1c(O)ccc2ccccc21 ZINC000808190856 1026222814 /nfs/dbraw/zinc/22/28/14/1026222814.db2.gz KHRUJEJBKZXHMG-BEFAXECRSA-N 1 1 310.441 3.604 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808712732 1026361753 /nfs/dbraw/zinc/36/17/53/1026361753.db2.gz AYVQHWJGHVKSOK-BDAKNGLRSA-N 1 1 311.838 3.926 20 10 DHCDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000809643431 1026581411 /nfs/dbraw/zinc/58/14/11/1026581411.db2.gz QTZHPXAGYKRDGM-IBGZPJMESA-N 1 1 313.441 3.782 20 10 DHCDMO CC[N@H+](Cc1ccncc1)Cc1cccc(Br)c1O ZINC000809727379 1026594586 /nfs/dbraw/zinc/59/45/86/1026594586.db2.gz YCAHQOZEOAFALF-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO CC[N@@H+](Cc1ccncc1)Cc1cccc(Br)c1O ZINC000809727379 1026594590 /nfs/dbraw/zinc/59/45/90/1026594590.db2.gz YCAHQOZEOAFALF-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO Oc1c(Br)cccc1C[NH+]1CCC2(CCC2)CC1 ZINC000809706875 1026600012 /nfs/dbraw/zinc/60/00/12/1026600012.db2.gz MSQSXHKHMKBQKP-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000809767270 1026605242 /nfs/dbraw/zinc/60/52/42/1026605242.db2.gz IFOMWPOCJHNJKA-IBGZPJMESA-N 1 1 304.478 3.516 20 10 DHCDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1cccc(OC)c1O ZINC000809783452 1026624342 /nfs/dbraw/zinc/62/43/42/1026624342.db2.gz DCSQZGOGIPGERX-KRWDZBQOSA-N 1 1 315.413 3.993 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC000769426204 1026867178 /nfs/dbraw/zinc/86/71/78/1026867178.db2.gz NKUVEDIGEWFQJX-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cc(Cl)ccc1O)C2 ZINC000769426204 1026867185 /nfs/dbraw/zinc/86/71/85/1026867185.db2.gz NKUVEDIGEWFQJX-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C4CC4)C3)cc2)CC1 ZINC000828563492 1026963148 /nfs/dbraw/zinc/96/31/48/1026963148.db2.gz DURCEOCUFZBPPS-SFHVURJKSA-N 1 1 314.473 3.534 20 10 DHCDMO Cc1ccc(O)c(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000811508246 1027025117 /nfs/dbraw/zinc/02/51/17/1027025117.db2.gz IFMOTCSSEOHZDD-GOSISDBHSA-N 1 1 308.425 3.685 20 10 DHCDMO CC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCOC(C)(C)C1 ZINC000811510992 1027026845 /nfs/dbraw/zinc/02/68/45/1027026845.db2.gz BRNXCYNMPDSFDC-LLVKDONJSA-N 1 1 315.816 3.964 20 10 DHCDMO CC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCOC(C)(C)C1 ZINC000811510992 1027026849 /nfs/dbraw/zinc/02/68/49/1027026849.db2.gz BRNXCYNMPDSFDC-LLVKDONJSA-N 1 1 315.816 3.964 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000811513652 1027028265 /nfs/dbraw/zinc/02/82/65/1027028265.db2.gz LUERBGNZBPAYJA-HNNXBMFYSA-N 1 1 322.246 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000811513652 1027028269 /nfs/dbraw/zinc/02/82/69/1027028269.db2.gz LUERBGNZBPAYJA-HNNXBMFYSA-N 1 1 322.246 3.919 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000811513574 1027028853 /nfs/dbraw/zinc/02/88/53/1027028853.db2.gz KMBBPXNAZBWVOS-OAHLLOKOSA-N 1 1 322.246 3.919 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCC1(F)F ZINC000811779783 1027081964 /nfs/dbraw/zinc/08/19/64/1027081964.db2.gz SQXKGQCCTBWNEQ-NSHDSACASA-N 1 1 313.388 3.872 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@@](C)(F)C3)cc2)CC1 ZINC000295301655 1027187097 /nfs/dbraw/zinc/18/70/97/1027187097.db2.gz FHYBRKMPXYLPAU-LJQANCHMSA-N 1 1 320.452 3.626 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1cncn1C)Cc1ccccc1O ZINC000272011388 1027203431 /nfs/dbraw/zinc/20/34/31/1027203431.db2.gz JXSAHZIEIBFCPP-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000295341118 1027209585 /nfs/dbraw/zinc/20/95/85/1027209585.db2.gz MRVCPAPYQVWCDC-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000295341118 1027209602 /nfs/dbraw/zinc/20/96/02/1027209602.db2.gz MRVCPAPYQVWCDC-UHFFFAOYSA-N 1 1 313.800 3.577 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1F ZINC000295348185 1027215166 /nfs/dbraw/zinc/21/51/66/1027215166.db2.gz YSKWGYLLVUDRFM-BBRMVZONSA-N 1 1 316.424 3.664 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccc(F)cc1O ZINC000812734317 1027378698 /nfs/dbraw/zinc/37/86/98/1027378698.db2.gz GZNSRSZLBVLHCA-INIZCTEOSA-N 1 1 313.376 3.659 20 10 DHCDMO COCC1(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCC1 ZINC000812821481 1027414431 /nfs/dbraw/zinc/41/44/31/1027414431.db2.gz GFJOQTGLIIAIEP-UHFFFAOYSA-N 1 1 316.489 3.925 20 10 DHCDMO C[N@@H+](CCc1cscn1)Cc1ccc(N2CCCCC2)cc1 ZINC000296205087 1027572434 /nfs/dbraw/zinc/57/24/34/1027572434.db2.gz CHGSMWKQWREKKU-UHFFFAOYSA-N 1 1 315.486 3.808 20 10 DHCDMO COc1cc(Br)cc(C[N@H+]2CCCC[C@H]2C)c1O ZINC000158924173 1027669856 /nfs/dbraw/zinc/66/98/56/1027669856.db2.gz NQFCDDKLKXZKCZ-SNVBAGLBSA-N 1 1 314.223 3.538 20 10 DHCDMO CC[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(OC)CC3)cc2)C1 ZINC000296764970 1027730113 /nfs/dbraw/zinc/73/01/13/1027730113.db2.gz LZACQAQWJAMLQE-MRXNPFEDSA-N 1 1 302.462 3.534 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000778999469 1027744621 /nfs/dbraw/zinc/74/46/21/1027744621.db2.gz NAFMFXJRDVHSRR-GOSISDBHSA-N 1 1 315.388 3.713 20 10 DHCDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)c1 ZINC000779021168 1027869607 /nfs/dbraw/zinc/86/96/07/1027869607.db2.gz XOGQEJHXKJPFHC-SFHVURJKSA-N 1 1 314.404 3.934 20 10 DHCDMO CCOc1ccc(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)c(O)c1 ZINC000814177756 1027913430 /nfs/dbraw/zinc/91/34/30/1027913430.db2.gz NXKZMPSQZZEPSR-AWEZNQCLSA-N 1 1 313.397 3.574 20 10 DHCDMO Cc1ncccc1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000527986232 1028047487 /nfs/dbraw/zinc/04/74/87/1028047487.db2.gz KHZOBTFOJXGVKD-NSHDSACASA-N 1 1 310.319 3.965 20 10 DHCDMO CC(C)[C@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000814630841 1028131192 /nfs/dbraw/zinc/13/11/92/1028131192.db2.gz ZESAXOBYEOKLPF-OXJNMPFZSA-N 1 1 313.441 3.972 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000367378815 1028176630 /nfs/dbraw/zinc/17/66/30/1028176630.db2.gz VDFCVDUQJHECLZ-KDOFPFPSSA-N 1 1 313.397 3.535 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000367378815 1028176642 /nfs/dbraw/zinc/17/66/42/1028176642.db2.gz VDFCVDUQJHECLZ-KDOFPFPSSA-N 1 1 313.397 3.535 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(N2CCCCC2)cc1 ZINC000368001188 1028271556 /nfs/dbraw/zinc/27/15/56/1028271556.db2.gz XGHOLQJLLIIMRL-WBVHZDCISA-N 1 1 324.472 3.608 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(N2CCCCC2)cc1 ZINC000368001187 1028274072 /nfs/dbraw/zinc/27/40/72/1028274072.db2.gz XGHOLQJLLIIMRL-RDJZCZTQSA-N 1 1 324.472 3.608 20 10 DHCDMO COc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000368329296 1028339005 /nfs/dbraw/zinc/33/90/05/1028339005.db2.gz RYLRGTBPKKCYAC-XHDPSFHLSA-N 1 1 317.360 3.714 20 10 DHCDMO Cc1cc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)ccc1N(C)C ZINC000815062440 1028346818 /nfs/dbraw/zinc/34/68/18/1028346818.db2.gz UFKNDCHPEFFCPU-INIZCTEOSA-N 1 1 312.457 3.830 20 10 DHCDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815095046 1028376382 /nfs/dbraw/zinc/37/63/82/1028376382.db2.gz RBHWNHWDWJLMDB-QGZVFWFLSA-N 1 1 304.478 3.700 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2cnc(C(C)C)nc2)ccc1N(C)C ZINC000815107195 1028379169 /nfs/dbraw/zinc/37/91/69/1028379169.db2.gz IFZXQTJDCDHVGX-UHFFFAOYSA-N 1 1 312.461 3.606 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2cnc(C(C)C)nc2)cc1 ZINC000815107902 1028379393 /nfs/dbraw/zinc/37/93/93/1028379393.db2.gz OLRWECAPJNLUEV-UHFFFAOYSA-N 1 1 312.461 3.688 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c1O ZINC000779150594 1028438335 /nfs/dbraw/zinc/43/83/35/1028438335.db2.gz RUKWQZSQZVVDBE-NOZJJQNGSA-N 1 1 316.214 3.643 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c1O ZINC000779150594 1028438344 /nfs/dbraw/zinc/43/83/44/1028438344.db2.gz RUKWQZSQZVVDBE-NOZJJQNGSA-N 1 1 316.214 3.643 20 10 DHCDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000779149181 1028439939 /nfs/dbraw/zinc/43/99/39/1028439939.db2.gz BPTUQMSVPOUFMS-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCCC[C@@H]1O ZINC000779154447 1028458055 /nfs/dbraw/zinc/45/80/55/1028458055.db2.gz SQIYBTPOSNMPKJ-ICSRJNTNSA-N 1 1 316.489 3.660 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000369596838 1028505755 /nfs/dbraw/zinc/50/57/55/1028505755.db2.gz LDBIVVAXUVZWMU-BFYDXBDKSA-N 1 1 309.837 3.561 20 10 DHCDMO C[C@H]([NH2+]CCN1CCCCC1)c1cccc(C(F)(F)F)c1O ZINC000815556853 1028542556 /nfs/dbraw/zinc/54/25/56/1028542556.db2.gz GNWKUBWMSCHIDX-LBPRGKRZSA-N 1 1 316.367 3.548 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)N(C)C1CC1 ZINC000815576132 1028549554 /nfs/dbraw/zinc/54/95/54/1028549554.db2.gz KFSLHLXGQQKWTQ-MNOVXSKESA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)[C@H]1CCCOC1 ZINC000815614214 1028570289 /nfs/dbraw/zinc/57/02/89/1028570289.db2.gz JHABICMMLIQEEI-WOPDTQHZSA-N 1 1 317.351 3.877 20 10 DHCDMO CO[C@H](C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C1CC1 ZINC000815651204 1028594956 /nfs/dbraw/zinc/59/49/56/1028594956.db2.gz NGTULINVHISLIO-XLKFXECMSA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1ccc(N2CCCCC2)cc1 ZINC000370662698 1028632489 /nfs/dbraw/zinc/63/24/89/1028632489.db2.gz NNQFTVAVLZOLIR-QAPCUYQASA-N 1 1 324.472 3.608 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000748051383 1028768441 /nfs/dbraw/zinc/76/84/41/1028768441.db2.gz SSILZLCTFCTKAD-GOSISDBHSA-N 1 1 313.372 3.853 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@H](n2nc(C)cc2C)C1 ZINC000372597184 1028873643 /nfs/dbraw/zinc/87/36/43/1028873643.db2.gz XUJIVPPEFIDESN-WMZOPIPTSA-N 1 1 313.445 3.994 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816478145 1028888334 /nfs/dbraw/zinc/88/83/34/1028888334.db2.gz VVLREGPZDQNRBG-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816478145 1028888353 /nfs/dbraw/zinc/88/83/53/1028888353.db2.gz VVLREGPZDQNRBG-UHFFFAOYSA-N 1 1 322.811 3.883 20 10 DHCDMO Cc1sccc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000816481541 1028895201 /nfs/dbraw/zinc/89/52/01/1028895201.db2.gz ZUKFHYHRJULVDM-KRWDZBQOSA-N 1 1 317.454 3.943 20 10 DHCDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)n1 ZINC000816491528 1028896388 /nfs/dbraw/zinc/89/63/88/1028896388.db2.gz PDGZPJFROQWRBB-INIZCTEOSA-N 1 1 323.396 3.616 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@H]1CCCc2cccnc21 ZINC000372765003 1028896626 /nfs/dbraw/zinc/89/66/26/1028896626.db2.gz MCJICYFYHAVRHB-KRWDZBQOSA-N 1 1 312.413 3.695 20 10 DHCDMO OCC[N@@H+](CCc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816510660 1028911437 /nfs/dbraw/zinc/91/14/37/1028911437.db2.gz BUMDHOSVQDKHAD-UHFFFAOYSA-N 1 1 321.420 3.582 20 10 DHCDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc2ccccc2c1O ZINC000816516265 1028917677 /nfs/dbraw/zinc/91/76/77/1028917677.db2.gz ZKKQPXIABMISGU-UHFFFAOYSA-N 1 1 315.413 3.709 20 10 DHCDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000816549479 1028930514 /nfs/dbraw/zinc/93/05/14/1028930514.db2.gz PBBDKZNBMVNSKF-SNVBAGLBSA-N 1 1 311.788 3.813 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1cc(F)ccc1F ZINC000816555916 1028940836 /nfs/dbraw/zinc/94/08/36/1028940836.db2.gz UEQZVNUBYUPICO-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816559659 1028946055 /nfs/dbraw/zinc/94/60/55/1028946055.db2.gz QURPPPZNGPWRTH-IAQYHMDHSA-N 1 1 315.816 3.868 20 10 DHCDMO Oc1c(C[N@H+]2CCOCC3(CCCC3)C2)ccc2ccccc21 ZINC000816574152 1028952565 /nfs/dbraw/zinc/95/25/65/1028952565.db2.gz YQAULLQMNJTIIM-UHFFFAOYSA-N 1 1 311.425 3.938 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)cc1F ZINC000816630676 1028983141 /nfs/dbraw/zinc/98/31/41/1028983141.db2.gz NSQXRRJSODULCN-SFHVURJKSA-N 1 1 320.452 3.551 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)c1O ZINC000190474006 1029006245 /nfs/dbraw/zinc/00/62/45/1029006245.db2.gz AWPRYEXCQAXPPZ-UHFFFAOYSA-N 1 1 319.445 3.633 20 10 DHCDMO Cc1nc2c(s1)CCC[C@@H]2C[NH2+]Cc1cccc(F)c1O ZINC000373506570 1029067349 /nfs/dbraw/zinc/06/73/49/1029067349.db2.gz FGBLWHVPKYAZPW-LLVKDONJSA-N 1 1 306.406 3.506 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c(O)c1 ZINC000817412161 1029151841 /nfs/dbraw/zinc/15/18/41/1029151841.db2.gz FBFDHWSHHVPUCO-GFCCVEGCSA-N 1 1 317.351 3.955 20 10 DHCDMO C[C@H]1CC[C@@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000190859643 1029185151 /nfs/dbraw/zinc/18/51/51/1029185151.db2.gz LURLKFMQEXLPTQ-YOEHRIQHSA-N 1 1 301.386 3.555 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000218476887 1029196589 /nfs/dbraw/zinc/19/65/89/1029196589.db2.gz XIOAUVFQNDUHCV-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO CC[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1[O-] ZINC000817587605 1029218152 /nfs/dbraw/zinc/21/81/52/1029218152.db2.gz ZKPXSOGUDSXMRW-XUJLQICISA-N 1 1 310.869 3.959 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC23CCOCC3)cc1 ZINC000374283080 1029273694 /nfs/dbraw/zinc/27/36/94/1029273694.db2.gz JCNKICCKLVYYPU-UHFFFAOYSA-N 1 1 302.462 3.678 20 10 DHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)cc1 ZINC000817937990 1029283634 /nfs/dbraw/zinc/28/36/34/1029283634.db2.gz AXJVOYQKTMBSSQ-UGSOOPFHSA-N 1 1 317.864 3.757 20 10 DHCDMO CC[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817940267 1029285422 /nfs/dbraw/zinc/28/54/22/1029285422.db2.gz FCYIJLZAFHMYEL-SJORKVTESA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(C2CC2)c1 ZINC000817943831 1029286584 /nfs/dbraw/zinc/28/65/84/1029286584.db2.gz VTWCVFTZOYJZRV-VFNWGFHPSA-N 1 1 323.484 3.981 20 10 DHCDMO C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817964778 1029301095 /nfs/dbraw/zinc/30/10/95/1029301095.db2.gz IHNYTJQMJNSEOA-PXNSSMCTSA-N 1 1 315.505 3.717 20 10 DHCDMO C[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817971644 1029312211 /nfs/dbraw/zinc/31/22/11/1029312211.db2.gz ONUDMFOJSGISKE-ZIFCJYIRSA-N 1 1 315.505 3.858 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977038 1029317857 /nfs/dbraw/zinc/31/78/57/1029317857.db2.gz ZQLMTHKNYCCYDW-SMDDNHRTSA-N 1 1 318.383 3.969 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cncn2C(C)C)cc1 ZINC000822443503 1030012205 /nfs/dbraw/zinc/01/22/05/1030012205.db2.gz VZQVFSYRWRJCDA-UHFFFAOYSA-N 1 1 314.477 3.942 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000822529555 1030045635 /nfs/dbraw/zinc/04/56/35/1030045635.db2.gz FOJNUTTXTWFFFO-QGZVFWFLSA-N 1 1 321.848 3.827 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc(OC)no2)cc1F ZINC000925014392 1030246033 /nfs/dbraw/zinc/24/60/33/1030246033.db2.gz QDYIHLDANHRHAC-LBPRGKRZSA-N 1 1 321.396 3.519 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000866404744 1030283142 /nfs/dbraw/zinc/28/31/42/1030283142.db2.gz QCXSBTMCWUKMKY-NJAPINKUSA-N 1 1 301.361 3.712 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccncc1F)C1CCCC1 ZINC000823447830 1030288558 /nfs/dbraw/zinc/28/85/58/1030288558.db2.gz NTXXWNWOLJLFBY-UHFFFAOYSA-N 1 1 300.377 3.871 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)[C@@H]2CCOC2)cc1 ZINC000823439131 1030289278 /nfs/dbraw/zinc/28/92/78/1030289278.db2.gz ZIESZGIKRCNAFG-QGZVFWFLSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@@H]([NH2+][C@H]1C[C@@H](C)O[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000866446313 1030300807 /nfs/dbraw/zinc/30/08/07/1030300807.db2.gz FKRYJWRFCIMGGT-DNJQJEMRSA-N 1 1 303.324 3.628 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000291038297 1030305008 /nfs/dbraw/zinc/30/50/08/1030305008.db2.gz YXZJLHVQCCMWLH-JKSUJKDBSA-N 1 1 307.821 3.579 20 10 DHCDMO C[C@H]([NH2+]CCSCCC(F)(F)F)c1ccc(F)cc1O ZINC000866543691 1030365272 /nfs/dbraw/zinc/36/52/72/1030365272.db2.gz ULMVCYUPYJZPRX-VIFPVBQESA-N 1 1 311.344 3.868 20 10 DHCDMO C[C@H](c1cc(Cl)ccc1O)[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925754190 1030482078 /nfs/dbraw/zinc/48/20/78/1030482078.db2.gz MEMYABUXKIHMCR-LLVKDONJSA-N 1 1 318.804 3.583 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(Br)cc2O)o1 ZINC000824515907 1030570338 /nfs/dbraw/zinc/57/03/38/1030570338.db2.gz PNWCOPGHWMOTDN-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000824555327 1030579581 /nfs/dbraw/zinc/57/95/81/1030579581.db2.gz FIRHCZDXMRPXRE-JTQLQIEISA-N 1 1 310.191 3.941 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)[C@@H](CO)c2ccccc2)c1O ZINC000824697096 1030604026 /nfs/dbraw/zinc/60/40/26/1030604026.db2.gz YUEZHTUDHNKSEU-INIZCTEOSA-N 1 1 305.805 3.519 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1 ZINC000824716438 1030618769 /nfs/dbraw/zinc/61/87/69/1030618769.db2.gz VCCGSLFWPGWNIQ-AQNXPRMDSA-N 1 1 316.489 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1 ZINC000824716439 1030619873 /nfs/dbraw/zinc/61/98/73/1030619873.db2.gz VCCGSLFWPGWNIQ-VAMGGRTRSA-N 1 1 316.489 3.658 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000824750602 1030635735 /nfs/dbraw/zinc/63/57/35/1030635735.db2.gz LTLZSEHYCXWYNL-LLVKDONJSA-N 1 1 313.800 3.624 20 10 DHCDMO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000824800527 1030642357 /nfs/dbraw/zinc/64/23/57/1030642357.db2.gz YZBVMRMGFFNDPO-NHYWBVRUSA-N 1 1 315.816 3.726 20 10 DHCDMO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000824798639 1030642482 /nfs/dbraw/zinc/64/24/82/1030642482.db2.gz GLHNUSCACIFZOW-MEDUHNTESA-N 1 1 315.816 3.726 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1C ZINC000824815420 1030648712 /nfs/dbraw/zinc/64/87/12/1030648712.db2.gz OLKQTNRAVDMYQN-YWZLYKJASA-N 1 1 311.425 3.916 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000825215387 1030747827 /nfs/dbraw/zinc/74/78/27/1030747827.db2.gz OKRVPLCQNXVHFH-KRWDZBQOSA-N 1 1 307.459 3.510 20 10 DHCDMO OCCC[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000825338066 1030781450 /nfs/dbraw/zinc/78/14/50/1030781450.db2.gz LAYVCCUMOIMASC-MRXNPFEDSA-N 1 1 311.425 3.654 20 10 DHCDMO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(F)cc1O ZINC000926917845 1030991072 /nfs/dbraw/zinc/99/10/72/1030991072.db2.gz DNBWENNSJXRQRG-JTQLQIEISA-N 1 1 306.406 3.717 20 10 DHCDMO CC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000844919027 1031401463 /nfs/dbraw/zinc/40/14/63/1031401463.db2.gz BHFRUELFAISKKJ-ZDUSSCGKSA-N 1 1 316.367 3.581 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2[nH]c(C)nc2C)cc1 ZINC000929185229 1031459293 /nfs/dbraw/zinc/45/92/93/1031459293.db2.gz QTNOGJHDOWKBAH-UHFFFAOYSA-N 1 1 300.450 3.505 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(O)cc1C(F)(F)F ZINC001144391715 1031514665 /nfs/dbraw/zinc/51/46/65/1031514665.db2.gz WPNNEGXTYXFXIX-UHFFFAOYSA-N 1 1 311.303 3.749 20 10 DHCDMO Cc1csc([C@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)n1 ZINC000293624247 1031543433 /nfs/dbraw/zinc/54/34/33/1031543433.db2.gz MSBRLJDUYQOBOR-MRVPVSSYSA-N 1 1 314.813 3.843 20 10 DHCDMO FC(F)[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000872254910 1031562202 /nfs/dbraw/zinc/56/22/02/1031562202.db2.gz MXYABISDLZHCKE-QGZVFWFLSA-N 1 1 324.415 3.533 20 10 DHCDMO CCCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000124085440 1031607110 /nfs/dbraw/zinc/60/71/10/1031607110.db2.gz DQBPJFRLRLZDIQ-UHFFFAOYSA-N 1 1 313.445 3.944 20 10 DHCDMO [O-]c1cc(F)c(Cl)cc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000293810613 1031635086 /nfs/dbraw/zinc/63/50/86/1031635086.db2.gz FDDVPCMAUCIFLS-UHFFFAOYSA-N 1 1 306.768 3.744 20 10 DHCDMO CC(=O)Nc1cccc2c1C[N@@H+](Cc1cc(C)cc(C)c1O)CC2 ZINC000872661604 1031639840 /nfs/dbraw/zinc/63/98/40/1031639840.db2.gz XTOPVYHGFDDXQA-UHFFFAOYSA-N 1 1 324.424 3.526 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)O[C@@H](C)C2)cc1C ZINC000872815974 1031666972 /nfs/dbraw/zinc/66/69/72/1031666972.db2.gz FFTSONKLSVZAAV-SWLSCSKDSA-N 1 1 317.351 3.551 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1CNc2ccccc21)c1ccc(F)cc1O ZINC000873237488 1031770724 /nfs/dbraw/zinc/77/07/24/1031770724.db2.gz PVFRLWYRKWBWIN-CHWSQXEVSA-N 1 1 300.377 3.781 20 10 DHCDMO COCCc1cc[nH+]c(N[C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000294088624 1031793177 /nfs/dbraw/zinc/79/31/77/1031793177.db2.gz IUICQYMGURDTNB-CQSZACIVSA-N 1 1 300.402 3.766 20 10 DHCDMO Cc1c(C[N@H+](CCCCCO)C(C)C)c2ccccc2n1C ZINC001138260219 1031805995 /nfs/dbraw/zinc/80/59/95/1031805995.db2.gz ZULPVOWDXSUVAE-UHFFFAOYSA-N 1 1 302.462 3.860 20 10 DHCDMO CN(C)c1ccc(/C=C\C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000897942040 1031890899 /nfs/dbraw/zinc/89/08/99/1031890899.db2.gz KBCBXIDSBMBRII-SREVYHEPSA-N 1 1 313.445 3.841 20 10 DHCDMO COc1cccc([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1O ZINC000846144698 1031906556 /nfs/dbraw/zinc/90/65/56/1031906556.db2.gz JTRGJTZIERVCHU-LBPRGKRZSA-N 1 1 323.396 3.503 20 10 DHCDMO COc1ccc([C@H]2CC[N@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001142527393 1031911083 /nfs/dbraw/zinc/91/10/83/1031911083.db2.gz SWPNYRUHFDQISX-ZDUSSCGKSA-N 1 1 319.351 3.669 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(F)c(F)cc3O)C2)cc1 ZINC001142527393 1031911086 /nfs/dbraw/zinc/91/10/86/1031911086.db2.gz SWPNYRUHFDQISX-ZDUSSCGKSA-N 1 1 319.351 3.669 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cs1 ZINC000294529968 1032046890 /nfs/dbraw/zinc/04/68/90/1032046890.db2.gz GZRXIDMQVQSUNM-UHFFFAOYSA-N 1 1 316.470 3.525 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c(O)c1 ZINC000877507954 1033330255 /nfs/dbraw/zinc/33/02/55/1033330255.db2.gz SXJUMAKPGMAVPD-UONOGXRCSA-N 1 1 300.229 3.716 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1ccc(C)cc1O ZINC000877544497 1033350424 /nfs/dbraw/zinc/35/04/24/1033350424.db2.gz XXSMPFFZDACGEK-UHFFFAOYSA-N 1 1 300.402 3.677 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](O)C[C@@H]1c1ccccc1 ZINC000877672366 1033405562 /nfs/dbraw/zinc/40/55/62/1033405562.db2.gz CPRHVIVTDVQTRU-IAGOWNOFSA-N 1 1 317.816 3.744 20 10 DHCDMO CCC1([NH+]2CCCC2)CCN(Cc2c(C)cccc2O)CC1 ZINC000877673610 1033407425 /nfs/dbraw/zinc/40/74/25/1033407425.db2.gz HLURHDTXRBUDAP-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO CCC1([NH+]2CCCC2)CCN(Cc2ccc(C)cc2O)CC1 ZINC000877673615 1033407850 /nfs/dbraw/zinc/40/78/50/1033407850.db2.gz HTUMESMOEZBOMP-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c(O)c1 ZINC000877811962 1033460738 /nfs/dbraw/zinc/46/07/38/1033460738.db2.gz DFXNRYFWRMYCPD-AWEZNQCLSA-N 1 1 303.324 3.565 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c1O ZINC000877812330 1033462608 /nfs/dbraw/zinc/46/26/08/1033462608.db2.gz MXPPLQCTRNSIFA-AWEZNQCLSA-N 1 1 303.324 3.565 20 10 DHCDMO CO[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001172939433 1033477865 /nfs/dbraw/zinc/47/78/65/1033477865.db2.gz POBZUQGDHVIDAI-RTBURBONSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[NH+](CC)C1CCC([N@H+](CC)Cc2ccccc2[O-])CC1 ZINC001173113374 1033548133 /nfs/dbraw/zinc/54/81/33/1033548133.db2.gz OMVUTVDVPMXJPZ-UHFFFAOYSA-N 1 1 304.478 3.867 20 10 DHCDMO CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccccc2[O-])CC1 ZINC001173113374 1033548139 /nfs/dbraw/zinc/54/81/39/1033548139.db2.gz OMVUTVDVPMXJPZ-UHFFFAOYSA-N 1 1 304.478 3.867 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CCCCC(=O)OC ZINC001173459628 1033754251 /nfs/dbraw/zinc/75/42/51/1033754251.db2.gz DGOCQXLDVXSEKX-INIZCTEOSA-N 1 1 320.477 3.696 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1F ZINC000862213294 1033779262 /nfs/dbraw/zinc/77/92/62/1033779262.db2.gz WQWFFLSAQOHQED-MRXNPFEDSA-N 1 1 305.372 3.696 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1F ZINC000862213294 1033779274 /nfs/dbraw/zinc/77/92/74/1033779274.db2.gz WQWFFLSAQOHQED-MRXNPFEDSA-N 1 1 305.372 3.696 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1F ZINC000862222389 1033784432 /nfs/dbraw/zinc/78/44/32/1033784432.db2.gz XWGNKVSYQXSNAU-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1F ZINC000862222389 1033784444 /nfs/dbraw/zinc/78/44/44/1033784444.db2.gz XWGNKVSYQXSNAU-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CC[N@H+](Cc1ccncc1)Cc1c(O)cccc1Br ZINC000862366043 1033832227 /nfs/dbraw/zinc/83/22/27/1033832227.db2.gz BHRQGGYSLWYHDA-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO CC[N@@H+](Cc1ccncc1)Cc1c(O)cccc1Br ZINC000862366043 1033832229 /nfs/dbraw/zinc/83/22/29/1033832229.db2.gz BHRQGGYSLWYHDA-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO OC[C@]12CCC[C@H]1C[N@@H+](Cc1cc(-c3ccccc3)ccc1O)C2 ZINC000862529299 1033873703 /nfs/dbraw/zinc/87/37/03/1033873703.db2.gz RJEYUTMNMWJGGG-PZJWPPBQSA-N 1 1 323.436 3.654 20 10 DHCDMO Oc1ccc(Br)cc1Nc1cc[nH+]c2ccccc12 ZINC001174038442 1034092081 /nfs/dbraw/zinc/09/20/81/1034092081.db2.gz LRFWAEIUZFOWDG-UHFFFAOYSA-N 1 1 315.170 3.868 20 10 DHCDMO Cc1cc(NCc2ccc(F)c(F)c2O)ccc1C[NH+](C)C ZINC000864039282 1034270750 /nfs/dbraw/zinc/27/07/50/1034270750.db2.gz SLWPVTQNLKWUAI-UHFFFAOYSA-N 1 1 306.356 3.653 20 10 DHCDMO CCOC(=O)c1ccc(C[N@@H+](CC)Cc2ccccc2O)cc1 ZINC001142599395 1034300411 /nfs/dbraw/zinc/30/04/11/1034300411.db2.gz HXDHHVJOJFMRQR-UHFFFAOYSA-N 1 1 313.397 3.591 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@](C)(O)CC2)c(O)c(C(C)(C)C)c1 ZINC000794671384 1034324436 /nfs/dbraw/zinc/32/44/36/1034324436.db2.gz GFDDCZPADPBUIC-LJQANCHMSA-N 1 1 305.462 3.735 20 10 DHCDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183679069 1034411540 /nfs/dbraw/zinc/41/15/40/1034411540.db2.gz JAULPZIXBVQXNG-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2[O-])C1 ZINC000185060002 1034525594 /nfs/dbraw/zinc/52/55/94/1034525594.db2.gz FUKVYYGBNQWMTE-QWRGUYRKSA-N 1 1 317.260 3.691 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(F)cc1O ZINC000185532188 1034555197 /nfs/dbraw/zinc/55/51/97/1034555197.db2.gz RHQYLOFGXFBOPO-DYVFJYSZSA-N 1 1 303.377 3.696 20 10 DHCDMO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185833569 1034576118 /nfs/dbraw/zinc/57/61/18/1034576118.db2.gz OWDWDEHYZVCBIE-IGCXYCKISA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185833552 1034576690 /nfs/dbraw/zinc/57/66/90/1034576690.db2.gz OWDWDEHYZVCBIE-DCGLDWPTSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518918 1034637386 /nfs/dbraw/zinc/63/73/86/1034637386.db2.gz FPQLFRJDJAAAKD-SOUVJXGZSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518918 1034637392 /nfs/dbraw/zinc/63/73/92/1034637392.db2.gz FPQLFRJDJAAAKD-SOUVJXGZSA-N 1 1 320.452 3.835 20 10 DHCDMO Cc1nnc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)s1 ZINC000773428492 1034712851 /nfs/dbraw/zinc/71/28/51/1034712851.db2.gz ZISKFSLSBFQYTO-UHFFFAOYSA-N 1 1 317.458 3.887 20 10 DHCDMO C=Cn1cc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000193578067 1034847610 /nfs/dbraw/zinc/84/76/10/1034847610.db2.gz UODSOBABPBDUCQ-UHFFFAOYSA-N 1 1 310.445 3.606 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCOC12CCCCC2 ZINC001179715786 1035494259 /nfs/dbraw/zinc/49/42/59/1035494259.db2.gz CRRPOZUUGFLUKS-AWEZNQCLSA-N 1 1 313.800 3.766 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)c1O ZINC001179854644 1035517680 /nfs/dbraw/zinc/51/76/80/1035517680.db2.gz HPNAAYVYFUSZIB-UHFFFAOYSA-N 1 1 306.409 3.994 20 10 DHCDMO CCc1cccc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)c1O ZINC001179854644 1035517689 /nfs/dbraw/zinc/51/76/89/1035517689.db2.gz HPNAAYVYFUSZIB-UHFFFAOYSA-N 1 1 306.409 3.994 20 10 DHCDMO CO[C@]1(C)C[C@H]([N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)C1(C)C ZINC001179958190 1035558379 /nfs/dbraw/zinc/55/83/79/1035558379.db2.gz WRPUVZPIROPCEN-YDFHMDALSA-N 1 1 316.489 3.901 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c(C)n1 ZINC000775572202 1035567579 /nfs/dbraw/zinc/56/75/79/1035567579.db2.gz PEWWEGJXGLHEOD-UHFFFAOYSA-N 1 1 309.457 3.929 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c(O)c1 ZINC001180149092 1035610287 /nfs/dbraw/zinc/61/02/87/1035610287.db2.gz UOAQEJJUAQKDJT-UZLBHIALSA-N 1 1 311.425 3.971 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](CC)C(=O)OCC ZINC001193364507 1035619939 /nfs/dbraw/zinc/61/99/39/1035619939.db2.gz LZFXPQZKFIXTPV-KRWDZBQOSA-N 1 1 320.477 3.615 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](CC)C(=O)OCC ZINC001193364511 1035620640 /nfs/dbraw/zinc/62/06/40/1035620640.db2.gz LZFXPQZKFIXTPV-QGZVFWFLSA-N 1 1 320.477 3.615 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCOCC3(CCCC3)C2)cc1 ZINC000773851154 1035649879 /nfs/dbraw/zinc/64/98/79/1035649879.db2.gz VHMCMZJENWLPAI-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C(=O)OC)[C@@H](C)CC ZINC001193840262 1035736117 /nfs/dbraw/zinc/73/61/17/1035736117.db2.gz YAEAEGWPTSHGPC-YOEHRIQHSA-N 1 1 307.434 3.582 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774131710 1036187803 /nfs/dbraw/zinc/18/78/03/1036187803.db2.gz RJCSWJQZIOOOFI-OTYXRUKQSA-N 1 1 317.260 3.690 20 10 DHCDMO CC[C@H](O)CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774252234 1036257312 /nfs/dbraw/zinc/25/73/12/1036257312.db2.gz KIECACFFUXDIBV-UWVGGRQHSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@H]([NH2+]CC[C@H](C)[S@@](C)=O)c1cc(Cl)c(Cl)cc1O ZINC000774259049 1036264664 /nfs/dbraw/zinc/26/46/64/1036264664.db2.gz WGPDWBMSDVBHTI-OCCIGCLGSA-N 1 1 324.273 3.507 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774349877 1036313822 /nfs/dbraw/zinc/31/38/22/1036313822.db2.gz VZXNDMRWMYUCOV-UWVGGRQHSA-N 1 1 304.217 3.776 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2CCC3(CC3)CC2)c1 ZINC000774382875 1036311053 /nfs/dbraw/zinc/31/10/53/1036311053.db2.gz WDJYKSHLUWOCJM-GFCCVEGCSA-N 1 1 303.402 3.552 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774349889 1036314513 /nfs/dbraw/zinc/31/45/13/1036314513.db2.gz VZXNDMRWMYUCOV-ZJUUUORDSA-N 1 1 304.217 3.776 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000775680407 1036410187 /nfs/dbraw/zinc/41/01/87/1036410187.db2.gz BYHJYVKWAPAOKH-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccccc1OC ZINC001183443939 1036595321 /nfs/dbraw/zinc/59/53/21/1036595321.db2.gz LSFQXKCYWNWOTR-HNNXBMFYSA-N 1 1 307.340 3.920 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c1O ZINC000775738354 1036598260 /nfs/dbraw/zinc/59/82/60/1036598260.db2.gz BDRDKCLYSLYCJU-KBPBESRZSA-N 1 1 309.837 3.603 20 10 DHCDMO CC(C)(C)O[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)C12CCC2 ZINC001183920318 1036712792 /nfs/dbraw/zinc/71/27/92/1036712792.db2.gz WWPGFRNQEFXSEH-HZPDHXFCSA-N 1 1 307.409 3.747 20 10 DHCDMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000775764961 1036721894 /nfs/dbraw/zinc/72/18/94/1036721894.db2.gz MHFSQBBFRWMFTB-INIZCTEOSA-N 1 1 317.433 3.815 20 10 DHCDMO Oc1cc2c(cc1C[NH2+][C@@H](c1ccco1)c1ccccc1)OCO2 ZINC000238139154 1037040615 /nfs/dbraw/zinc/04/06/15/1037040615.db2.gz QAVLJAWPHDFAEY-LJQANCHMSA-N 1 1 323.348 3.593 20 10 DHCDMO Cc1nccn1CCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000762925585 1037073397 /nfs/dbraw/zinc/07/33/97/1037073397.db2.gz IJOOORYIHWXVOX-UHFFFAOYSA-N 1 1 313.445 3.732 20 10 DHCDMO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903240 1037193338 /nfs/dbraw/zinc/19/33/38/1037193338.db2.gz JRXPOZSAYJJBMR-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903240 1037193342 /nfs/dbraw/zinc/19/33/42/1037193342.db2.gz JRXPOZSAYJJBMR-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[NH+]2CCC(CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774911441 1037205558 /nfs/dbraw/zinc/20/55/58/1037205558.db2.gz GICOIOXFLWIXNJ-UHFFFAOYSA-N 1 1 322.405 3.567 20 10 DHCDMO CCN(CC)c1ccc(CNCC[NH+]2CCCCCC2)cc1F ZINC001199219820 1037221139 /nfs/dbraw/zinc/22/11/39/1037221139.db2.gz PWVSNQYHPABPRY-UHFFFAOYSA-N 1 1 321.484 3.638 20 10 DHCDMO CCC1CCC(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000775012845 1037384047 /nfs/dbraw/zinc/38/40/47/1037384047.db2.gz JNTROGFMNOBWQY-UHFFFAOYSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000775020561 1037425871 /nfs/dbraw/zinc/42/58/71/1037425871.db2.gz JSCHTLOTQWEVCP-OLZOCXBDSA-N 1 1 322.405 3.615 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775136871 1037685345 /nfs/dbraw/zinc/68/53/45/1037685345.db2.gz NIOQKZYQRXJJGL-MRVPVSSYSA-N 1 1 311.706 3.959 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775136871 1037685366 /nfs/dbraw/zinc/68/53/66/1037685366.db2.gz NIOQKZYQRXJJGL-MRVPVSSYSA-N 1 1 311.706 3.959 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2OC(F)F)cc1 ZINC000917030630 1038127067 /nfs/dbraw/zinc/12/70/67/1038127067.db2.gz KROAYTRMVKWFLJ-UHFFFAOYSA-N 1 1 320.383 3.986 20 10 DHCDMO COc1ccc(N2CCC[N@H+]([C@@H](C)c3ccccc3)CC2)cc1 ZINC000917089733 1038186613 /nfs/dbraw/zinc/18/66/13/1038186613.db2.gz JFBAAWZOSLFKOV-KRWDZBQOSA-N 1 1 310.441 3.969 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)c1 ZINC000775371081 1038283683 /nfs/dbraw/zinc/28/36/83/1038283683.db2.gz SQNCTYCWZAYGSM-NSHDSACASA-N 1 1 304.390 3.537 20 10 DHCDMO CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491789 1038567516 /nfs/dbraw/zinc/56/75/16/1038567516.db2.gz JUMZOESCHPTYQJ-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491789 1038567520 /nfs/dbraw/zinc/56/75/20/1038567520.db2.gz JUMZOESCHPTYQJ-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@H](Nc1cc[nH+]cc1Br)c1ccc(N(C)C)cc1 ZINC000775540477 1038690719 /nfs/dbraw/zinc/69/07/19/1038690719.db2.gz MGCOWHRDTLJENT-NSHDSACASA-N 1 1 320.234 3.505 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000760882437 1038960778 /nfs/dbraw/zinc/96/07/78/1038960778.db2.gz WUSIGGSHSDKSRL-FYBVGQRMSA-N 1 1 307.394 3.590 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000173011089 1040132978 /nfs/dbraw/zinc/13/29/78/1040132978.db2.gz OXEQLPPVIUZTCG-LLVKDONJSA-N 1 1 319.298 3.508 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000173011089 1040132983 /nfs/dbraw/zinc/13/29/83/1040132983.db2.gz OXEQLPPVIUZTCG-LLVKDONJSA-N 1 1 319.298 3.508 20 10 DHCDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1ccccc1O ZINC000272460570 130033218 /nfs/dbraw/zinc/03/32/18/130033218.db2.gz QPSLFBNAEKVPAC-KRWDZBQOSA-N 1 1 321.424 3.715 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3occc32)c1 ZINC000273437055 130122977 /nfs/dbraw/zinc/12/29/77/130122977.db2.gz XDTOITOLTNSCCF-NHYWBVRUSA-N 1 1 315.369 3.500 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(N(C)C)cc1 ZINC000274226807 130220428 /nfs/dbraw/zinc/22/04/28/130220428.db2.gz OXESCFHYWKBOGW-NHYWBVRUSA-N 1 1 304.463 3.714 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(F)cc1O ZINC000285484158 131173024 /nfs/dbraw/zinc/17/30/24/131173024.db2.gz BSXJSOFMUQRWNO-HNNXBMFYSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccccc1COC)c1ccc(F)cc1O ZINC000285811548 131203179 /nfs/dbraw/zinc/20/31/79/131203179.db2.gz VVOLXQPSEQYSJE-QGZVFWFLSA-N 1 1 303.377 3.919 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1ccc(F)cc1O ZINC000286220636 131224540 /nfs/dbraw/zinc/22/45/40/131224540.db2.gz SHYJBNYAJZLTLJ-WTTBNOFXSA-N 1 1 305.393 3.530 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000286892137 131254396 /nfs/dbraw/zinc/25/43/96/131254396.db2.gz DCSJTRCCGVPGKL-PXAZEXFGSA-N 1 1 320.383 3.624 20 10 DHCDMO CC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(Cl)c1[O-] ZINC000287704024 131295146 /nfs/dbraw/zinc/29/51/46/131295146.db2.gz NTBLPVWONPYLMA-MRXNPFEDSA-N 1 1 308.853 3.713 20 10 DHCDMO COc1ccc(O)c(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c1 ZINC000289389620 131381875 /nfs/dbraw/zinc/38/18/75/131381875.db2.gz DRVDHTVVVJLMOE-UHFFFAOYSA-N 1 1 313.397 3.519 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C1CC1 ZINC000297205853 132004008 /nfs/dbraw/zinc/00/40/08/132004008.db2.gz RTNCJGPZUIWXGG-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000295029772 335129763 /nfs/dbraw/zinc/12/97/63/335129763.db2.gz NTSZSHSICZKLEK-CMPLNLGQSA-N 1 1 303.324 3.564 20 10 DHCDMO C[C@H](CC[S@@](C)=O)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278799732 334101546 /nfs/dbraw/zinc/10/15/46/334101546.db2.gz RBPLPGYBBUURGW-BLBZPCKPSA-N 1 1 324.273 3.507 20 10 DHCDMO Cc1cc(C=C2CC[NH+](Cc3cccc(F)c3O)CC2)no1 ZINC000374897165 336999105 /nfs/dbraw/zinc/99/91/05/336999105.db2.gz POPRZYGYGKUERV-UHFFFAOYSA-N 1 1 302.349 3.507 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)no1 ZINC000375018896 337001677 /nfs/dbraw/zinc/00/16/77/337001677.db2.gz KCDDSDYPXZNIMH-HNNXBMFYSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)no1 ZINC000375018896 337001678 /nfs/dbraw/zinc/00/16/78/337001678.db2.gz KCDDSDYPXZNIMH-HNNXBMFYSA-N 1 1 306.793 3.988 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000375305992 337007560 /nfs/dbraw/zinc/00/75/60/337007560.db2.gz YPAAQMDULKSHAL-FQEVSTJZSA-N 1 1 314.473 3.679 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000375305996 337007603 /nfs/dbraw/zinc/00/76/03/337007603.db2.gz YPAAQMDULKSHAL-HXUWFJFHSA-N 1 1 314.473 3.679 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@H]2CCCc3cccnc32)c1O ZINC000377244482 337049218 /nfs/dbraw/zinc/04/92/18/337049218.db2.gz LQRSAIGCMFXNTP-INIZCTEOSA-N 1 1 312.413 3.695 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@@H](O)C[C@H]1c1cccc(F)c1 ZINC000377695791 337058698 /nfs/dbraw/zinc/05/86/98/337058698.db2.gz IJNLBZSDBITIPL-JQHSSLGASA-N 1 1 315.388 3.790 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000378637688 337077383 /nfs/dbraw/zinc/07/73/83/337077383.db2.gz ODZVTVJMTMIHIA-AWEZNQCLSA-N 1 1 302.805 3.505 20 10 DHCDMO [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000179963889 337172865 /nfs/dbraw/zinc/17/28/65/337172865.db2.gz MJJAVYQZDUEGFS-GFCCVEGCSA-N 1 1 308.834 3.882 20 10 DHCDMO CC[C@@H]([NH2+][C@H](c1nnc(C)[nH]1)c1ccccc1)c1ccccc1O ZINC000185210235 337203508 /nfs/dbraw/zinc/20/35/08/337203508.db2.gz DGHHCYUEFXBOBO-AEFFLSMTSA-N 1 1 322.412 3.649 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000191359097 337296237 /nfs/dbraw/zinc/29/62/37/337296237.db2.gz WKWWMAOQUZUAFS-NSHDSACASA-N 1 1 313.800 3.766 20 10 DHCDMO COc1cc(C[N@@H+](Cc2cc(C)ccc2O)C2CC2)ccc1O ZINC000191510130 522359716 /nfs/dbraw/zinc/35/97/16/522359716.db2.gz JTDHCQHJJHOMJS-UHFFFAOYSA-N 1 1 313.397 3.579 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cccs2)cc1OC ZINC000159874804 522772054 /nfs/dbraw/zinc/77/20/54/522772054.db2.gz UGPPFWLXQYWFJR-NSHDSACASA-N 1 1 307.415 3.664 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)c1 ZINC000180154057 524733951 /nfs/dbraw/zinc/73/39/51/524733951.db2.gz GMQJVKVEWLFQHT-LLVKDONJSA-N 1 1 306.431 3.667 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1C ZINC000128445454 525320866 /nfs/dbraw/zinc/32/08/66/525320866.db2.gz CQSCORPXTWXLNO-INIZCTEOSA-N 1 1 303.427 3.644 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000186820856 525363233 /nfs/dbraw/zinc/36/32/33/525363233.db2.gz BKQWAXRXVVTPJG-CYBMUJFWSA-N 1 1 318.417 3.855 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000180204347 526349415 /nfs/dbraw/zinc/34/94/15/526349415.db2.gz MZCJELAOVYPMKF-INIZCTEOSA-N 1 1 315.388 3.570 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](n2cccn2)C1 ZINC000102393257 526356546 /nfs/dbraw/zinc/35/65/46/526356546.db2.gz QUBXIHOFEANHFZ-MRXNPFEDSA-N 1 1 307.397 3.579 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)c1O ZINC000894461913 1013377783 /nfs/dbraw/zinc/37/77/83/1013377783.db2.gz LZHIOFVPBPABDI-RHSMWYFYSA-N 1 1 312.413 3.687 20 10 DHCDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461198 1013379238 /nfs/dbraw/zinc/37/92/38/1013379238.db2.gz CYURPFHMYNVYSC-BDJLRTHQSA-N 1 1 304.340 3.649 20 10 DHCDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461198 1013379254 /nfs/dbraw/zinc/37/92/54/1013379254.db2.gz CYURPFHMYNVYSC-BDJLRTHQSA-N 1 1 304.340 3.649 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000070976339 1014079707 /nfs/dbraw/zinc/07/97/07/1014079707.db2.gz FWHQBVAVKGMZGT-SFHVURJKSA-N 1 1 315.388 3.713 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000070976341 1014079913 /nfs/dbraw/zinc/07/99/13/1014079913.db2.gz FWHQBVAVKGMZGT-GOSISDBHSA-N 1 1 315.388 3.713 20 10 DHCDMO C[C@H]1CC([NH2+]Cc2ccccc2O)C[C@H](C)N1Cc1ccccc1 ZINC001168007553 1014434119 /nfs/dbraw/zinc/43/41/19/1014434119.db2.gz AWTPYQNQFJFCAT-IRXDYDNUSA-N 1 1 324.468 3.923 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(OC)nc2)cc1 ZINC000754643470 1014712385 /nfs/dbraw/zinc/71/23/85/1014712385.db2.gz ZLSNQPVVMLSVFF-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000895439017 1015152596 /nfs/dbraw/zinc/15/25/96/1015152596.db2.gz SGOGLALTDZKNLO-UHFFFAOYSA-N 1 1 324.396 3.582 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000895454658 1015165089 /nfs/dbraw/zinc/16/50/89/1015165089.db2.gz OFNVSVGBMUYDCM-KRWDZBQOSA-N 1 1 319.445 3.633 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895582354 1015217482 /nfs/dbraw/zinc/21/74/82/1015217482.db2.gz RMKRMQLMFSNBGX-SECBINFHSA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895582354 1015217490 /nfs/dbraw/zinc/21/74/90/1015217490.db2.gz RMKRMQLMFSNBGX-SECBINFHSA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895582355 1015218375 /nfs/dbraw/zinc/21/83/75/1015218375.db2.gz RMKRMQLMFSNBGX-VIFPVBQESA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895582355 1015218387 /nfs/dbraw/zinc/21/83/87/1015218387.db2.gz RMKRMQLMFSNBGX-VIFPVBQESA-N 1 1 312.797 3.631 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1 ZINC000895788140 1015302375 /nfs/dbraw/zinc/30/23/75/1015302375.db2.gz IOQMUBDLSPNFDD-WFASDCNBSA-N 1 1 315.335 3.565 20 10 DHCDMO Cc1csc(C[C@@H]2CCC[N@@H+](Cc3ccccc3O)C2)n1 ZINC000895824265 1015319828 /nfs/dbraw/zinc/31/98/28/1015319828.db2.gz YTXURCHXZMWJHB-AWEZNQCLSA-N 1 1 302.443 3.612 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2)c(O)c1OC ZINC000891541570 1015366820 /nfs/dbraw/zinc/36/68/20/1015366820.db2.gz BQJRQLXTDZKYFB-MRXNPFEDSA-N 1 1 313.397 3.747 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c(O)c1OC ZINC000891593684 1015421172 /nfs/dbraw/zinc/42/11/72/1015421172.db2.gz WTIBTGBMNRPELE-LBPRGKRZSA-N 1 1 319.376 3.742 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000896226129 1015510397 /nfs/dbraw/zinc/51/03/97/1015510397.db2.gz BFBLAVFMOJTROY-CYBMUJFWSA-N 1 1 303.299 3.567 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccccc1CC(F)(F)F ZINC000896638349 1015693720 /nfs/dbraw/zinc/69/37/20/1015693720.db2.gz AVFXGWXDTSBPJJ-UHFFFAOYSA-N 1 1 313.294 3.926 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccccc1OCC1CC1 ZINC000896639218 1015693780 /nfs/dbraw/zinc/69/37/80/1015693780.db2.gz BFZFGWPTWQLGPJ-UHFFFAOYSA-N 1 1 301.361 3.610 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000896638054 1015693953 /nfs/dbraw/zinc/69/39/53/1015693953.db2.gz OECKDQFSCMQKNZ-UHFFFAOYSA-N 1 1 307.409 3.891 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c1O ZINC000399575837 1016167761 /nfs/dbraw/zinc/16/77/61/1016167761.db2.gz HWNRMLLLBUYZHS-TUAOUCFPSA-N 1 1 312.251 3.939 20 10 DHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)[nH]1 ZINC000277324751 1016204152 /nfs/dbraw/zinc/20/41/52/1016204152.db2.gz TZYBGCRVOQRAFP-DCAQKATOSA-N 1 1 306.385 3.575 20 10 DHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)[nH]1 ZINC000277324748 1016204229 /nfs/dbraw/zinc/20/42/29/1016204229.db2.gz TZYBGCRVOQRAFP-AXFHLTTASA-N 1 1 306.385 3.575 20 10 DHCDMO CCN(C)c1nc(NCc2cc3ccccc3cc2O)[nH+]cc1C ZINC001171395830 1032578897 /nfs/dbraw/zinc/57/88/97/1032578897.db2.gz IFQYIZBYKIBQSZ-UHFFFAOYSA-N 1 1 322.412 3.712 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccsc1)C[C@@H]1CCCO1 ZINC000160204737 1012017616 /nfs/dbraw/zinc/01/76/16/1012017616.db2.gz APKQJPKOPYCWFL-INIZCTEOSA-N 1 1 303.427 3.635 20 10 DHCDMO Cc1ccc([C@@H](C)CC[N@H+]2CCCc3cc(O)c(O)cc3C2)o1 ZINC001208170611 1012320005 /nfs/dbraw/zinc/32/00/05/1012320005.db2.gz XVQYQOOGVYTTFS-ZDUSSCGKSA-N 1 1 315.413 3.941 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CCC[C@H]1C[NH3+] ZINC001205983213 1032638513 /nfs/dbraw/zinc/63/85/13/1032638513.db2.gz OJHLLEVWQDZKBR-QWRGUYRKSA-N 1 1 317.260 3.506 20 10 DHCDMO CC[C@@H]([NH2+]CCc1ccc(OC)cc1)c1ccc(F)cc1O ZINC000796662180 1017131089 /nfs/dbraw/zinc/13/10/89/1017131089.db2.gz AEOHFYPRKIIZKF-QGZVFWFLSA-N 1 1 303.377 3.823 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC2CCOCC2)cc1F ZINC000093284591 1017168898 /nfs/dbraw/zinc/16/88/98/1017168898.db2.gz RUORCAYOKKACCA-UHFFFAOYSA-N 1 1 308.441 3.530 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c(Cl)c1 ZINC000840921529 1017483059 /nfs/dbraw/zinc/48/30/59/1017483059.db2.gz VEVKZOLFICSJRA-UONOGXRCSA-N 1 1 309.837 3.603 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000186142729 1017931870 /nfs/dbraw/zinc/93/18/70/1017931870.db2.gz ZVZWISOMFRWSIT-GJZGRUSLSA-N 1 1 308.441 3.550 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000186142729 1017931880 /nfs/dbraw/zinc/93/18/80/1017931880.db2.gz ZVZWISOMFRWSIT-GJZGRUSLSA-N 1 1 308.441 3.550 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000186142729 1017931884 /nfs/dbraw/zinc/93/18/84/1017931884.db2.gz ZVZWISOMFRWSIT-GJZGRUSLSA-N 1 1 308.441 3.550 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@@H]1CCc3cc(F)c(F)cc3C1)CC2 ZINC001171497825 1032736960 /nfs/dbraw/zinc/73/69/60/1032736960.db2.gz WTQYSAXOWLQJOY-OAHLLOKOSA-N 1 1 315.363 3.586 20 10 DHCDMO Cc1ccccc1OC1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137831542 1018116423 /nfs/dbraw/zinc/11/64/23/1018116423.db2.gz DLOUVAMSPDBPST-UHFFFAOYSA-N 1 1 315.388 3.883 20 10 DHCDMO CCC[N@@H+](Cc1cccc2nsnc21)Cc1ccccc1O ZINC000766081703 1018186975 /nfs/dbraw/zinc/18/69/75/1018186975.db2.gz PGBIQBFZQVHQFE-UHFFFAOYSA-N 1 1 313.426 3.809 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)c1O ZINC000124941227 1018226213 /nfs/dbraw/zinc/22/62/13/1018226213.db2.gz NWVGNHIASRFCDM-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO CC[NH+](CC)CCN[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764541459 1018309681 /nfs/dbraw/zinc/30/96/81/1018309681.db2.gz MNQIXNDOYLHYHQ-QGZVFWFLSA-N 1 1 303.494 3.669 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NCCC[NH+]2CCCCC2)cc1 ZINC000764661081 1018340119 /nfs/dbraw/zinc/34/01/19/1018340119.db2.gz BFXTXUYNWYJECN-QGZVFWFLSA-N 1 1 303.494 3.669 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000764661081 1018340137 /nfs/dbraw/zinc/34/01/37/1018340137.db2.gz BFXTXUYNWYJECN-QGZVFWFLSA-N 1 1 303.494 3.669 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3c([O-])cccc3F)C2)cc1 ZINC001137839665 1018768804 /nfs/dbraw/zinc/76/88/04/1018768804.db2.gz GKBJGMZXVIAGIH-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc([C@H]2CC[N@H+](Cc3c(O)cccc3F)C2)cc1 ZINC001137839665 1018768819 /nfs/dbraw/zinc/76/88/19/1018768819.db2.gz GKBJGMZXVIAGIH-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3c(O)cccc3F)C2)cc1 ZINC001137839665 1018768835 /nfs/dbraw/zinc/76/88/35/1018768835.db2.gz GKBJGMZXVIAGIH-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO [O-]c1cccc(F)c1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001137841911 1018859939 /nfs/dbraw/zinc/85/99/39/1018859939.db2.gz ZJNBWMIVRHFYMO-HNNXBMFYSA-N 1 1 303.352 3.878 20 10 DHCDMO Oc1cccc(F)c1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001137841911 1018859958 /nfs/dbraw/zinc/85/99/58/1018859958.db2.gz ZJNBWMIVRHFYMO-HNNXBMFYSA-N 1 1 303.352 3.878 20 10 DHCDMO Oc1cccc(F)c1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001137841911 1018859968 /nfs/dbraw/zinc/85/99/68/1018859968.db2.gz ZJNBWMIVRHFYMO-HNNXBMFYSA-N 1 1 303.352 3.878 20 10 DHCDMO CCSCCC[NH2+]Cc1cc(C)cc(Br)c1O ZINC000800282686 1019101969 /nfs/dbraw/zinc/10/19/69/1019101969.db2.gz LWVNZWAQUCVSPP-UHFFFAOYSA-N 1 1 318.280 3.696 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccncc1)c1cc(Cl)c(Cl)cc1O ZINC000278768499 1019345725 /nfs/dbraw/zinc/34/57/25/1019345725.db2.gz PBPFFOXSWZHPIS-SNVBAGLBSA-N 1 1 311.212 3.987 20 10 DHCDMO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(F)cc1O ZINC000170788939 1019434095 /nfs/dbraw/zinc/43/40/95/1019434095.db2.gz JXLAFZGAPFFRSA-JTQLQIEISA-N 1 1 311.303 3.984 20 10 DHCDMO Cc1cc(C[NH2+]Cc2cn(C(C)C)nn2)c(C)n1-c1ccccc1 ZINC000858294361 1032834204 /nfs/dbraw/zinc/83/42/04/1032834204.db2.gz GLNTXALVYLDUKC-UHFFFAOYSA-N 1 1 323.444 3.556 20 10 DHCDMO c1ccc(C[N@@H+](Cc2ccc(N3CCOCC3)cc2)C2CC2)cc1 ZINC000125424773 1032840074 /nfs/dbraw/zinc/84/00/74/1032840074.db2.gz GWWIRSHRUIWXQM-UHFFFAOYSA-N 1 1 322.452 3.688 20 10 DHCDMO CN(CCC[NH+]1CCCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000727769574 1019774916 /nfs/dbraw/zinc/77/49/16/1019774916.db2.gz FYEBREZXGAEDHX-UHFFFAOYSA-N 1 1 315.505 3.595 20 10 DHCDMO Cc1cc(O)c(CN2CCC[N@H+](C(C)C)CC2)cc1C(C)C ZINC000727823932 1019824514 /nfs/dbraw/zinc/82/45/14/1019824514.db2.gz MUBVVJRBJQYVFJ-UHFFFAOYSA-N 1 1 304.478 3.740 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCN(C(C)C)CC2)cc1C(C)C ZINC000727823932 1019824529 /nfs/dbraw/zinc/82/45/29/1019824529.db2.gz MUBVVJRBJQYVFJ-UHFFFAOYSA-N 1 1 304.478 3.740 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCCN(C(C)C)CC2)cc1C(C)C ZINC000727823932 1019824577 /nfs/dbraw/zinc/82/45/77/1019824577.db2.gz MUBVVJRBJQYVFJ-UHFFFAOYSA-N 1 1 304.478 3.740 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000922217446 1019897114 /nfs/dbraw/zinc/89/71/14/1019897114.db2.gz QBRFTQHQJCSDSE-NSHDSACASA-N 1 1 304.390 3.537 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](N3CCCCC3)C2)cc1C(C)C ZINC000730804552 1020027630 /nfs/dbraw/zinc/02/76/30/1020027630.db2.gz IGSUXUKKXHATJZ-GOSISDBHSA-N 1 1 316.489 3.884 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@@H]([NH+]3CCCCC3)C2)cc1C(C)C ZINC000730804552 1020027638 /nfs/dbraw/zinc/02/76/38/1020027638.db2.gz IGSUXUKKXHATJZ-GOSISDBHSA-N 1 1 316.489 3.884 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000732182559 1020205488 /nfs/dbraw/zinc/20/54/88/1020205488.db2.gz UEHQXGKQBHKCOC-ZDUSSCGKSA-N 1 1 315.413 3.978 20 10 DHCDMO CCCC[N@@H+]1CCCC[C@@H]1CNCc1c(O)cccc1Cl ZINC000733327930 1020374207 /nfs/dbraw/zinc/37/42/07/1020374207.db2.gz HGSDGFZPZSVCLH-CQSZACIVSA-N 1 1 310.869 3.790 20 10 DHCDMO CCCC[N@H+]1CCCC[C@@H]1CNCc1c(O)cccc1Cl ZINC000733327930 1020374219 /nfs/dbraw/zinc/37/42/19/1020374219.db2.gz HGSDGFZPZSVCLH-CQSZACIVSA-N 1 1 310.869 3.790 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc(C)n(C)n2)cc1F ZINC000282451093 1020518809 /nfs/dbraw/zinc/51/88/09/1020518809.db2.gz ZTUSLSNBZBAFKE-CQSZACIVSA-N 1 1 318.440 3.565 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766046142 1020605849 /nfs/dbraw/zinc/60/58/49/1020605849.db2.gz XJNGEAZSNVTCGY-CRAIPNDOSA-N 1 1 305.510 3.770 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCS[C@@H](C)[C@@H]3C)c2c1 ZINC000735666157 1020760832 /nfs/dbraw/zinc/76/08/32/1020760832.db2.gz CKTTUUVPZARGPG-STQMWFEESA-N 1 1 317.454 3.880 20 10 DHCDMO CCC(F)(F)C[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000858507244 1032926245 /nfs/dbraw/zinc/92/62/45/1032926245.db2.gz NEFKSXXHCJKYSS-QMMMGPOBSA-N 1 1 308.166 3.851 20 10 DHCDMO CC[N@@H+](Cc1c(O)c(C(=O)OC)cc2ccccc21)C1CCC1 ZINC000738053687 1020860274 /nfs/dbraw/zinc/86/02/74/1020860274.db2.gz LOFJAXFCBGKJGO-UHFFFAOYSA-N 1 1 313.397 3.706 20 10 DHCDMO C[C@H]([NH2+][C@H]1CO[C@H](C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000858546711 1032940743 /nfs/dbraw/zinc/94/07/43/1032940743.db2.gz DJECSDMUMDXUAT-PXWWUCIGSA-N 1 1 315.335 3.629 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2C[C@@H](C)C[C@@H]2C)c1O ZINC000740859205 1020954340 /nfs/dbraw/zinc/95/43/40/1020954340.db2.gz JHRQIDJWSYWAEU-STQMWFEESA-N 1 1 313.397 3.562 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1O ZINC000278802248 1021016121 /nfs/dbraw/zinc/01/61/21/1021016121.db2.gz OQMKRWXXMVWNAU-JTQLQIEISA-N 1 1 319.298 3.508 20 10 DHCDMO C[C@H](NCC[N@@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274067 1021036131 /nfs/dbraw/zinc/03/61/31/1021036131.db2.gz SKOGRQWVUOSVNP-MSOLQXFVSA-N 1 1 315.505 3.812 20 10 DHCDMO C[C@H](NCC[N@H+]1CCC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000766274067 1021036134 /nfs/dbraw/zinc/03/61/34/1021036134.db2.gz SKOGRQWVUOSVNP-MSOLQXFVSA-N 1 1 315.505 3.812 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCN(C)[C@@H](C)C2)cc1 ZINC000742374847 1021114703 /nfs/dbraw/zinc/11/47/03/1021114703.db2.gz IBRRLGJRAYCAFI-HKUYNNGSSA-N 1 1 317.521 3.885 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H]3CCCC[C@@H]32)cc1C(C)C ZINC000917473489 1021271793 /nfs/dbraw/zinc/27/17/93/1021271793.db2.gz PWYUFVYPDXKFAE-PKOBYXMFSA-N 1 1 303.446 3.967 20 10 DHCDMO CC[C@H]1C[N@@H+](Cc2c(O)ccc3ccc(OC)cc32)CCS1 ZINC000743400698 1021282912 /nfs/dbraw/zinc/28/29/12/1021282912.db2.gz QUWQPTCRPGFOHU-HNNXBMFYSA-N 1 1 317.454 3.881 20 10 DHCDMO CCc1cnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000743847785 1021375001 /nfs/dbraw/zinc/37/50/01/1021375001.db2.gz IYWJBMKJIBNXHS-UHFFFAOYSA-N 1 1 300.402 3.887 20 10 DHCDMO CCC[N@@H+](Cc1noc2c1CCCC2)Cc1ccccc1O ZINC000108858608 1021379801 /nfs/dbraw/zinc/37/98/01/1021379801.db2.gz LDAPQQHDBHMOKE-UHFFFAOYSA-N 1 1 300.402 3.671 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000850408689 1021516066 /nfs/dbraw/zinc/51/60/66/1021516066.db2.gz CSKXHIUMKKUQAH-UXEPBGEESA-N 1 1 321.754 3.752 20 10 DHCDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc(OC)c1 ZINC000850513081 1021567684 /nfs/dbraw/zinc/56/76/84/1021567684.db2.gz DKHUVXIOBSPNDJ-YVEFUNNKSA-N 1 1 319.376 3.578 20 10 DHCDMO COCc1csc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)c1 ZINC000850531421 1021585659 /nfs/dbraw/zinc/58/56/59/1021585659.db2.gz DOOQHDCGJISUIV-VIFPVBQESA-N 1 1 313.369 3.729 20 10 DHCDMO CC[C@H]([NH2+]Cc1nccc(OC)c1F)c1ccc(N(C)C)cc1 ZINC000850536863 1021590265 /nfs/dbraw/zinc/59/02/65/1021590265.db2.gz KOFCVCDOZBJWFR-HNNXBMFYSA-N 1 1 317.408 3.536 20 10 DHCDMO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539325 1021592673 /nfs/dbraw/zinc/59/26/73/1021592673.db2.gz RXNCXVVEDRFPLQ-HOTGVXAUSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539325 1021592687 /nfs/dbraw/zinc/59/26/87/1021592687.db2.gz RXNCXVVEDRFPLQ-HOTGVXAUSA-N 1 1 302.462 3.758 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(F)cc1O ZINC000850541909 1021595234 /nfs/dbraw/zinc/59/52/34/1021595234.db2.gz DNFGJNKQXOCYCK-SJORKVTESA-N 1 1 301.361 3.965 20 10 DHCDMO C[C@H]([NH2+]C[C@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000850546375 1021597922 /nfs/dbraw/zinc/59/79/22/1021597922.db2.gz YPUWDCNKSDMEPG-GXSJLCMTSA-N 1 1 318.244 3.758 20 10 DHCDMO CC(C)[C@H](O)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000850554358 1021600708 /nfs/dbraw/zinc/60/07/08/1021600708.db2.gz JCKJGFZKXHXASW-BKTGTZMESA-N 1 1 317.404 3.940 20 10 DHCDMO CC[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1ccc(F)cc1O ZINC000850566808 1021611313 /nfs/dbraw/zinc/61/13/13/1021611313.db2.gz RBIVCZOLTIUQRR-CYBMUJFWSA-N 1 1 317.351 3.512 20 10 DHCDMO C[C@@H](C(=O)Nc1ccccc1Cl)[N@@H+](C)Cc1ccccc1O ZINC000109772972 1021746198 /nfs/dbraw/zinc/74/61/98/1021746198.db2.gz QKGKTVPTMOURMJ-LBPRGKRZSA-N 1 1 318.804 3.505 20 10 DHCDMO COc1ccc(-c2cnc(C[N@H+](C)Cc3ccccc3O)o2)cc1 ZINC000109769822 1021746410 /nfs/dbraw/zinc/74/64/10/1021746410.db2.gz HVKCLIYAHIYPGO-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO COc1ccc(-c2cnc(C[N@@H+](C)Cc3ccccc3O)o2)cc1 ZINC000109769822 1021746420 /nfs/dbraw/zinc/74/64/20/1021746420.db2.gz HVKCLIYAHIYPGO-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO C[N@@H+](CCC(=O)Nc1ccccc1Cl)Cc1ccccc1O ZINC000109773624 1021746841 /nfs/dbraw/zinc/74/68/41/1021746841.db2.gz WXLBRDCEORSFMK-UHFFFAOYSA-N 1 1 318.804 3.506 20 10 DHCDMO C[C@H](c1nnc(-c2cccs2)o1)[N@H+](C)Cc1ccccc1O ZINC000109769395 1021747194 /nfs/dbraw/zinc/74/71/94/1021747194.db2.gz JEOBSLRWGZMOMS-LLVKDONJSA-N 1 1 315.398 3.697 20 10 DHCDMO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+](C)Cc1ccccc1O ZINC000109769395 1021747208 /nfs/dbraw/zinc/74/72/08/1021747208.db2.gz JEOBSLRWGZMOMS-LLVKDONJSA-N 1 1 315.398 3.697 20 10 DHCDMO CN(C)c1ccc(C[NH2+]C[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000377757668 1021850639 /nfs/dbraw/zinc/85/06/39/1021850639.db2.gz AIZJDMGEGGNQFS-CTNGQTDRSA-N 1 1 323.484 3.535 20 10 DHCDMO COc1ccc(N2CCC[N@H+](CC=C(Cl)Cl)CC2)cc1 ZINC000851733147 1021975323 /nfs/dbraw/zinc/97/53/23/1021975323.db2.gz KYMYJGCEMPQHEV-UHFFFAOYSA-N 1 1 315.244 3.526 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CC=C(Cl)Cl)CC2)cc1 ZINC000851733147 1021975331 /nfs/dbraw/zinc/97/53/31/1021975331.db2.gz KYMYJGCEMPQHEV-UHFFFAOYSA-N 1 1 315.244 3.526 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)ccc1N(C)C ZINC000852083844 1022068666 /nfs/dbraw/zinc/06/86/66/1022068666.db2.gz MHVMSDNISFZKAG-SFHVURJKSA-N 1 1 309.457 3.836 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@@H]4CCCC[C@@H]43)cc2)CC1 ZINC000852219644 1022090337 /nfs/dbraw/zinc/09/03/37/1022090337.db2.gz RNDADMWCGUUTBN-PXNSSMCTSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822146 1033472652 /nfs/dbraw/zinc/47/26/52/1033472652.db2.gz PCFIHBJBCMOWMW-CYBMUJFWSA-N 1 1 323.742 3.507 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822146 1033472658 /nfs/dbraw/zinc/47/26/58/1033472658.db2.gz PCFIHBJBCMOWMW-CYBMUJFWSA-N 1 1 323.742 3.507 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2CC(=O)c2ccccc2)c1O ZINC000180459950 1022143136 /nfs/dbraw/zinc/14/31/36/1022143136.db2.gz XXXVPOUFJJHYMI-GOSISDBHSA-N 1 1 309.409 3.938 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240647 1022241035 /nfs/dbraw/zinc/24/10/35/1022241035.db2.gz QDXZMNFFNPOUGO-DZGCQCFKSA-N 1 1 322.880 3.818 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240647 1022241039 /nfs/dbraw/zinc/24/10/39/1022241039.db2.gz QDXZMNFFNPOUGO-DZGCQCFKSA-N 1 1 322.880 3.818 20 10 DHCDMO CC[C@H]1C[C@@H](C[N@@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC000780754120 1022246739 /nfs/dbraw/zinc/24/67/39/1022246739.db2.gz MUCHSJNWVBJDKO-HKUYNNGSSA-N 1 1 304.478 3.780 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCc1ccncc1)Cc1ccco1 ZINC000111232771 1022253611 /nfs/dbraw/zinc/25/36/11/1022253611.db2.gz ULWNSQKCTZYGPZ-UHFFFAOYSA-N 1 1 308.381 3.625 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1O ZINC000853629399 1022300337 /nfs/dbraw/zinc/30/03/37/1022300337.db2.gz JMIFRGMGJMMUGV-IBGZPJMESA-N 1 1 324.424 3.831 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1O ZINC000853628872 1022303150 /nfs/dbraw/zinc/30/31/50/1022303150.db2.gz DTUYQBAJBAKGTB-AWEZNQCLSA-N 1 1 313.397 3.665 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc(F)ccc1O ZINC000363863299 1022349062 /nfs/dbraw/zinc/34/90/62/1022349062.db2.gz BAOIXSAVDMCEAM-OQPBUACISA-N 1 1 309.287 3.594 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)CN1C[C@H](C)C[C@H](C)C1)c1ccc(F)cc1O ZINC000756454686 1022393483 /nfs/dbraw/zinc/39/34/83/1022393483.db2.gz NJLFJRKXWDXBFF-LJISPDSOSA-N 1 1 308.441 3.548 20 10 DHCDMO C[C@@H](COc1ccccc1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756497053 1022536422 /nfs/dbraw/zinc/53/64/22/1022536422.db2.gz ZZEDMYSTVPOZBL-RYUDHWBXSA-N 1 1 307.340 3.789 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(F)ccc3O)C2)cc1 ZINC000180027133 1022610812 /nfs/dbraw/zinc/61/08/12/1022610812.db2.gz OZLZYKMMOUHWGY-CQSZACIVSA-N 1 1 301.361 3.529 20 10 DHCDMO Cc1cccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)c1O ZINC000180243157 1022672865 /nfs/dbraw/zinc/67/28/65/1022672865.db2.gz DWYJICUHKCHPKA-LJQANCHMSA-N 1 1 311.425 3.573 20 10 DHCDMO Cc1cccc(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000310069283 1022808222 /nfs/dbraw/zinc/80/82/22/1022808222.db2.gz CSROKURIDULDEU-OAQYLSRUSA-N 1 1 324.468 3.702 20 10 DHCDMO Cc1cccc(C[NH2+]C[C@@]2(C)CCN(Cc3ccccc3)C2)c1O ZINC000310069283 1022808232 /nfs/dbraw/zinc/80/82/32/1022808232.db2.gz CSROKURIDULDEU-OAQYLSRUSA-N 1 1 324.468 3.702 20 10 DHCDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876523513 1033082348 /nfs/dbraw/zinc/08/23/48/1033082348.db2.gz YKOIVNVLAJHESV-MRXNPFEDSA-N 1 1 316.489 3.657 20 10 DHCDMO CC(C)[C@H](C)[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876523512 1033083790 /nfs/dbraw/zinc/08/37/90/1033083790.db2.gz YKOIVNVLAJHESV-INIZCTEOSA-N 1 1 316.489 3.657 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+](C)[C@H](C)C(C)C)c1 ZINC000781897223 1022846734 /nfs/dbraw/zinc/84/67/34/1022846734.db2.gz PYCVAMPRWIFBLM-LLVKDONJSA-N 1 1 300.240 3.939 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@H+](C)[C@H](C)C(C)C)c1 ZINC000781897223 1022846750 /nfs/dbraw/zinc/84/67/50/1022846750.db2.gz PYCVAMPRWIFBLM-LLVKDONJSA-N 1 1 300.240 3.939 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CCCO1)c1cccc(C(F)(F)F)c1O ZINC000798181154 1022875471 /nfs/dbraw/zinc/87/54/71/1022875471.db2.gz HCRPFDUKXDBVOB-WDEREUQCSA-N 1 1 303.324 3.631 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CCCCCC1 ZINC000876552922 1033088298 /nfs/dbraw/zinc/08/82/98/1033088298.db2.gz IFRINBGKNBIANC-UHFFFAOYSA-N 1 1 316.489 3.802 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(Cl)nn2)cc1 ZINC000876551802 1033090091 /nfs/dbraw/zinc/09/00/91/1033090091.db2.gz XCPRJTIGUXIREH-UHFFFAOYSA-N 1 1 318.852 3.608 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(Cl)nn2)cc1 ZINC000876551802 1033090107 /nfs/dbraw/zinc/09/01/07/1033090107.db2.gz XCPRJTIGUXIREH-UHFFFAOYSA-N 1 1 318.852 3.608 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)CCO2 ZINC000768134288 1022902152 /nfs/dbraw/zinc/90/21/52/1022902152.db2.gz RPSOOWFHHNIXNN-UHFFFAOYSA-N 1 1 310.441 3.710 20 10 DHCDMO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768171649 1022910240 /nfs/dbraw/zinc/91/02/40/1022910240.db2.gz FXMDYRJYLTUPOA-SJLPKXTDSA-N 1 1 302.462 3.676 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1c(O)cccc1Cl ZINC000768199072 1022914646 /nfs/dbraw/zinc/91/46/46/1022914646.db2.gz XOFPMYZCVAMYKK-UHFFFAOYSA-N 1 1 311.834 3.756 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnn3ccccc23)cc1 ZINC000768209033 1022915249 /nfs/dbraw/zinc/91/52/49/1022915249.db2.gz XKGPDKHMLGGCHN-UHFFFAOYSA-N 1 1 322.456 3.813 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](CCOC)Cc2cccs2)c1 ZINC000768197310 1022924937 /nfs/dbraw/zinc/92/49/37/1022924937.db2.gz JPUXKTXYTOIBFM-UHFFFAOYSA-N 1 1 321.442 3.501 20 10 DHCDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000768262169 1022935590 /nfs/dbraw/zinc/93/55/90/1022935590.db2.gz HHBYMUVQIZNGDG-NSHDSACASA-N 1 1 319.788 3.967 20 10 DHCDMO CCCCC[N@@H+](Cc1ccc(N2CCOCC2)cc1)C(C)C ZINC000768333610 1022947359 /nfs/dbraw/zinc/94/73/59/1022947359.db2.gz HHLHLULGDJGYJQ-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C2CC2)C2CCC(C)CC2)cc1OC ZINC000768438540 1022965728 /nfs/dbraw/zinc/96/57/28/1022965728.db2.gz BISBKVKWEVMXIE-UHFFFAOYSA-N 1 1 319.445 3.953 20 10 DHCDMO COc1cc(O)c(C[N@@H+](CC(C)C)C2CCCC2)cc1OC ZINC000768440248 1022967626 /nfs/dbraw/zinc/96/76/26/1022967626.db2.gz PNHYGWAZBAWFQN-UHFFFAOYSA-N 1 1 307.434 3.810 20 10 DHCDMO COc1cc(C[N@@H+](C)CCc2ccc(F)cc2)c(O)cc1C ZINC000768442195 1022969051 /nfs/dbraw/zinc/96/90/51/1022969051.db2.gz KIWCNEMXCDUMOI-UHFFFAOYSA-N 1 1 303.377 3.523 20 10 DHCDMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OC[C@H]2O ZINC000768464739 1022973580 /nfs/dbraw/zinc/97/35/80/1022973580.db2.gz TVBUPNFPPVOXCN-CRAIPNDOSA-N 1 1 319.445 3.609 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCCOc2ccccc2)c1 ZINC000768823389 1023038011 /nfs/dbraw/zinc/03/80/11/1023038011.db2.gz AZVUFFWJHZCEJA-UHFFFAOYSA-N 1 1 315.413 3.692 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)CCCOc2ccccc2)c1O ZINC000768828143 1023040342 /nfs/dbraw/zinc/04/03/42/1023040342.db2.gz ZWBCPXSYOQKIFW-UHFFFAOYSA-N 1 1 315.413 3.692 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCCOc2ccccc2)c(O)c1 ZINC000768826942 1023040541 /nfs/dbraw/zinc/04/05/41/1023040541.db2.gz QEOBRLYUCUPOLQ-UHFFFAOYSA-N 1 1 315.413 3.692 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000768913005 1023055193 /nfs/dbraw/zinc/05/51/93/1023055193.db2.gz PNBAOELGKURENL-MRXNPFEDSA-N 1 1 315.388 3.747 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 ZINC000768913753 1023055938 /nfs/dbraw/zinc/05/59/38/1023055938.db2.gz RTRCGMKGXNNYLI-QKLQHJQFSA-N 1 1 315.505 3.590 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000769033625 1023071260 /nfs/dbraw/zinc/07/12/60/1023071260.db2.gz JAUIJDIDVFZNBE-IBGZPJMESA-N 1 1 311.425 3.882 20 10 DHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H]1OCCc2ccccc21 ZINC000769021459 1023071981 /nfs/dbraw/zinc/07/19/81/1023071981.db2.gz JTMAZRMKEYNHJN-SFHVURJKSA-N 1 1 317.816 3.791 20 10 DHCDMO CCc1ccc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)o1 ZINC000768997213 1023075357 /nfs/dbraw/zinc/07/53/57/1023075357.db2.gz AYVODBKSXWZSTR-UHFFFAOYSA-N 1 1 314.429 3.563 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1 ZINC000769315193 1023120884 /nfs/dbraw/zinc/12/08/84/1023120884.db2.gz HGLHNOIXGQVFNA-HXUWFJFHSA-N 1 1 310.441 3.716 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000769340320 1023129607 /nfs/dbraw/zinc/12/96/07/1023129607.db2.gz WDXJJTYKMKTOKQ-OAHLLOKOSA-N 1 1 315.388 3.920 20 10 DHCDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000769390591 1023139621 /nfs/dbraw/zinc/13/96/21/1023139621.db2.gz ZJMXCKNXDRHEHH-LBPRGKRZSA-N 1 1 305.805 3.814 20 10 DHCDMO CC(C)C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000769402606 1023141557 /nfs/dbraw/zinc/14/15/57/1023141557.db2.gz MTFYRGZSELZHFS-QGZVFWFLSA-N 1 1 320.452 3.530 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000769425061 1023146197 /nfs/dbraw/zinc/14/61/97/1023146197.db2.gz OEFNSPQUYRZTDO-LBPRGKRZSA-N 1 1 301.361 3.659 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c1O ZINC000769425403 1023146772 /nfs/dbraw/zinc/14/67/72/1023146772.db2.gz PKXBSHGBFWBSJT-LBPRGKRZSA-N 1 1 301.361 3.659 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCCC[C@@H]1c1ccco1)OCO2 ZINC000769428597 1023147633 /nfs/dbraw/zinc/14/76/33/1023147633.db2.gz UKCHIZFTHYAGDG-CQSZACIVSA-N 1 1 315.369 3.831 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000769481887 1023152948 /nfs/dbraw/zinc/15/29/48/1023152948.db2.gz ANRPKFDXLQNIKQ-PXNSSMCTSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCN(CC)C[C@@H]2C)cc1 ZINC000769481887 1023152960 /nfs/dbraw/zinc/15/29/60/1023152960.db2.gz ANRPKFDXLQNIKQ-PXNSSMCTSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCN(CC)C[C@@H]2C)cc1 ZINC000769481887 1023152962 /nfs/dbraw/zinc/15/29/62/1023152962.db2.gz ANRPKFDXLQNIKQ-PXNSSMCTSA-N 1 1 317.521 3.695 20 10 DHCDMO CC[N@@H+](Cc1cc(Br)cc(OC)c1O)C1CCC1 ZINC000769467344 1023162072 /nfs/dbraw/zinc/16/20/72/1023162072.db2.gz UXFYAYGVCNWVNP-UHFFFAOYSA-N 1 1 314.223 3.538 20 10 DHCDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000769498012 1023166910 /nfs/dbraw/zinc/16/69/10/1023166910.db2.gz JKSIYMGAWWSQDT-IBGZPJMESA-N 1 1 313.441 3.782 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2ncc(C)s2)cc1 ZINC000769526195 1023173538 /nfs/dbraw/zinc/17/35/38/1023173538.db2.gz ZQCOXFOHNBVVCO-UHFFFAOYSA-N 1 1 317.502 3.972 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000769559525 1023180139 /nfs/dbraw/zinc/18/01/39/1023180139.db2.gz NCQRFLSIZWVYEY-LLVKDONJSA-N 1 1 307.315 3.799 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCO[C@@H]1CCCCO1)C1CCCC1 ZINC000769726162 1023201416 /nfs/dbraw/zinc/20/14/16/1023201416.db2.gz RRGFYRHIQABZTJ-LJQANCHMSA-N 1 1 319.445 3.680 20 10 DHCDMO C[N@@H+](CCOCc1ccccc1)Cc1cc(Cl)ccc1O ZINC000770306831 1023294962 /nfs/dbraw/zinc/29/49/62/1023294962.db2.gz QZHKBEDAHMKFRU-UHFFFAOYSA-N 1 1 305.805 3.694 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000770323291 1023297661 /nfs/dbraw/zinc/29/76/61/1023297661.db2.gz GLEVOBZIVLFWMG-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000770323291 1023297663 /nfs/dbraw/zinc/29/76/63/1023297663.db2.gz GLEVOBZIVLFWMG-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO Cc1ccc(C)c([C@H]2C[N@@H+](Cc3ccccc3O)[C@H](C)CO2)c1 ZINC000770506158 1023316163 /nfs/dbraw/zinc/31/61/63/1023316163.db2.gz VTTXOYCJTWBZPQ-OXQOHEQNSA-N 1 1 311.425 3.971 20 10 DHCDMO Cc1ccc(C)c([C@@H]2C[N@@H+](Cc3ccccc3O)[C@H](C)CO2)c1 ZINC000770506159 1023316974 /nfs/dbraw/zinc/31/69/74/1023316974.db2.gz VTTXOYCJTWBZPQ-UZLBHIALSA-N 1 1 311.425 3.971 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@H](C)c2c(F)cncc2F)cc1Cl ZINC000825893146 1033124977 /nfs/dbraw/zinc/12/49/77/1033124977.db2.gz QDPIZXYKXWGFPL-SECBINFHSA-N 1 1 312.747 3.878 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000771934829 1023489237 /nfs/dbraw/zinc/48/92/37/1023489237.db2.gz AUUJVWHZWOQZQW-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000876778918 1033141992 /nfs/dbraw/zinc/14/19/92/1033141992.db2.gz RZBNAXDDRIIHML-DYVFJYSZSA-N 1 1 303.427 3.724 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@](CC)(CO)C2)cc1 ZINC000190234038 1023759361 /nfs/dbraw/zinc/75/93/61/1023759361.db2.gz CBYMSISBBARZSU-LJQANCHMSA-N 1 1 304.478 3.517 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)c1ccc(F)cc1O ZINC000756780222 1023799712 /nfs/dbraw/zinc/79/97/12/1023799712.db2.gz XKKFWXDYMQSYPF-VFGSGVCASA-N 1 1 313.463 3.562 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788629723 1023916176 /nfs/dbraw/zinc/91/61/76/1023916176.db2.gz CYVNWAJIUFPUBU-QWRGUYRKSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+]CC1(C)CCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788689273 1023920082 /nfs/dbraw/zinc/92/00/82/1023920082.db2.gz UYMLTOZABNVSCH-LLVKDONJSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788691355 1023920696 /nfs/dbraw/zinc/92/06/96/1023920696.db2.gz MPBRTUGLPONZHA-GMTAPVOTSA-N 1 1 303.324 3.629 20 10 DHCDMO CCOC(C)(C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788758364 1023929738 /nfs/dbraw/zinc/92/97/38/1023929738.db2.gz PFQMHENRZMMSQP-SNVBAGLBSA-N 1 1 305.340 3.877 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788795693 1023935804 /nfs/dbraw/zinc/93/58/04/1023935804.db2.gz BABYSCAQKGYBKF-UWVGGRQHSA-N 1 1 305.365 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)cc1C(C)C ZINC000789506803 1024104881 /nfs/dbraw/zinc/10/48/81/1024104881.db2.gz NPTOLEPEWTZIJA-MJGOQNOKSA-N 1 1 303.446 3.967 20 10 DHCDMO CC[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccc(N(C)C)cc1 ZINC000789724590 1024155936 /nfs/dbraw/zinc/15/59/36/1024155936.db2.gz VKIOSIQJVFUMIX-UHFFFAOYSA-N 1 1 324.428 3.758 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCSC(C)(C)CC2)c1O ZINC000789763948 1024158833 /nfs/dbraw/zinc/15/88/33/1024158833.db2.gz SEAUIEHHNJUTFT-UHFFFAOYSA-N 1 1 315.866 3.772 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC000130457957 1024166949 /nfs/dbraw/zinc/16/69/49/1024166949.db2.gz XJFXZXRAGQCGAL-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Cc1csc([C@H]([NH2+]Cc2cc(F)cc(F)c2O)C2CC2)n1 ZINC000883018612 1024211928 /nfs/dbraw/zinc/21/19/28/1024211928.db2.gz JNLABMZAOOCPEK-CYBMUJFWSA-N 1 1 310.369 3.676 20 10 DHCDMO COc1ccc2nc(C[N@@H+](C)Cc3ccccc3O)sc2c1 ZINC000187246243 1024220865 /nfs/dbraw/zinc/22/08/65/1024220865.db2.gz YBVGZRSENITAMP-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO CSC[C@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000130916564 1024229214 /nfs/dbraw/zinc/22/92/14/1024229214.db2.gz MOHOJMFJWGFQBU-CQSZACIVSA-N 1 1 309.475 3.723 20 10 DHCDMO CCO[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883104604 1024243016 /nfs/dbraw/zinc/24/30/16/1024243016.db2.gz GIZLVQAMCSLKEE-INIZCTEOSA-N 1 1 307.340 3.538 20 10 DHCDMO CC1(C)C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C(C)(C)O1 ZINC000790988848 1024412008 /nfs/dbraw/zinc/41/20/08/1024412008.db2.gz CVENEKUGWMMXKV-LBPRGKRZSA-N 1 1 301.789 3.620 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(C3CC3)no2)cc1F ZINC000877027886 1033209933 /nfs/dbraw/zinc/20/99/33/1033209933.db2.gz UUVOPAOADUZHRS-UHFFFAOYSA-N 1 1 317.408 3.827 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1 ZINC000271028215 1024445865 /nfs/dbraw/zinc/44/58/65/1024445865.db2.gz FRHPPDKFHAJDRJ-UHFFFAOYSA-N 1 1 319.408 3.866 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H](O)c1ccccc1 ZINC000791450349 1024500775 /nfs/dbraw/zinc/50/07/75/1024500775.db2.gz XCDINVCDKDSLAM-HXUWFJFHSA-N 1 1 312.457 3.697 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000792164751 1024638487 /nfs/dbraw/zinc/63/84/87/1024638487.db2.gz DKOYUDMZKNYUGR-MRXNPFEDSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000792164751 1024638493 /nfs/dbraw/zinc/63/84/93/1024638493.db2.gz DKOYUDMZKNYUGR-MRXNPFEDSA-N 1 1 313.800 3.577 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000792164751 1024638500 /nfs/dbraw/zinc/63/85/00/1024638500.db2.gz DKOYUDMZKNYUGR-MRXNPFEDSA-N 1 1 313.800 3.577 20 10 DHCDMO COCC[N@H+](Cc1c(O)ccc(Cl)c1F)C1CCCC1 ZINC000792162941 1024639135 /nfs/dbraw/zinc/63/91/35/1024639135.db2.gz SCWAZIWRJKIWFM-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO COCC[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CCCC1 ZINC000792162941 1024639139 /nfs/dbraw/zinc/63/91/39/1024639139.db2.gz SCWAZIWRJKIWFM-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO C[N@@H+](CCCc1nc(-c2ccccc2)no1)Cc1ccccc1O ZINC000109769435 1024695698 /nfs/dbraw/zinc/69/56/98/1024695698.db2.gz WIKODEZURXAGBN-UHFFFAOYSA-N 1 1 323.396 3.507 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1)Cc1cc(OC)c(OC)cc1O ZINC000159482065 1025057337 /nfs/dbraw/zinc/05/73/37/1025057337.db2.gz LXDPRPIKIHEQGL-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000793607545 1025126568 /nfs/dbraw/zinc/12/65/68/1025126568.db2.gz AMQVVONXLNLKAW-UXHICEINSA-N 1 1 314.473 3.820 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)Cc2ccccc2O1 ZINC000793766050 1025156589 /nfs/dbraw/zinc/15/65/89/1025156589.db2.gz FUHNTQHHDKNEBB-CQSZACIVSA-N 1 1 320.392 3.724 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3cccc(C)c3)CC2)cc1 ZINC000108088214 1025318257 /nfs/dbraw/zinc/31/82/57/1025318257.db2.gz UGJROTUUDXDXOC-UHFFFAOYSA-N 1 1 310.441 3.716 20 10 DHCDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877313457 1033281139 /nfs/dbraw/zinc/28/11/39/1033281139.db2.gz UIXSSTDMAKZQDK-QGZVFWFLSA-N 1 1 316.489 3.516 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1c(O)cccc1F ZINC000886496658 1025651422 /nfs/dbraw/zinc/65/14/22/1025651422.db2.gz BYFYFVZMDIFWAE-FZMZJTMJSA-N 1 1 308.422 3.546 20 10 DHCDMO CCOCc1ccccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886496731 1025654463 /nfs/dbraw/zinc/65/44/63/1025654463.db2.gz FSECVYDIPKQSBJ-CYBMUJFWSA-N 1 1 303.377 3.919 20 10 DHCDMO CCOc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1OC ZINC000886502859 1025657379 /nfs/dbraw/zinc/65/73/79/1025657379.db2.gz QYQDYJIJIOPXNK-GFCCVEGCSA-N 1 1 319.376 3.789 20 10 DHCDMO CCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886506305 1025660792 /nfs/dbraw/zinc/66/07/92/1025660792.db2.gz LBYWJIWIQQAHTP-LBPRGKRZSA-N 1 1 316.376 3.731 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cn1 ZINC000886524469 1025676330 /nfs/dbraw/zinc/67/63/30/1025676330.db2.gz LAZOTGXSUJFFLQ-LBPRGKRZSA-N 1 1 304.365 3.566 20 10 DHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886533143 1025681624 /nfs/dbraw/zinc/68/16/24/1025681624.db2.gz VTKXNEXZWSAXFD-NHYWBVRUSA-N 1 1 317.360 3.714 20 10 DHCDMO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886540286 1025688200 /nfs/dbraw/zinc/68/82/00/1025688200.db2.gz CBIDJWMUYOJUEL-IAQYHMDHSA-N 1 1 301.361 3.878 20 10 DHCDMO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886543781 1025691201 /nfs/dbraw/zinc/69/12/01/1025691201.db2.gz VIQYUOABLZJBCE-QFSBIZTOSA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1c(O)cccc1F ZINC000886646282 1025758256 /nfs/dbraw/zinc/75/82/56/1025758256.db2.gz DMZSHCTVGARWCP-XJKSGUPXSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)cc1O ZINC000806179760 1025835716 /nfs/dbraw/zinc/83/57/16/1025835716.db2.gz GZVAGKISXPYGTR-PELKAZGASA-N 1 1 320.177 3.993 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)CCc2ncc(C)s2)c(O)c1 ZINC000093807321 1026128980 /nfs/dbraw/zinc/12/89/80/1026128980.db2.gz PEAMBIYSDOIOML-UHFFFAOYSA-N 1 1 320.458 3.620 20 10 DHCDMO Cc1c[nH]nc1C[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000289812993 1026185646 /nfs/dbraw/zinc/18/56/46/1026185646.db2.gz IYBZFDXCMOOWSB-UHFFFAOYSA-N 1 1 312.461 3.777 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c1 ZINC000289811694 1026186112 /nfs/dbraw/zinc/18/61/12/1026186112.db2.gz SXFOHSOWZGTJMO-HSALFYBXSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](N3CCCC3)[C@H]2C)cc1C(C)C ZINC000808191487 1026224500 /nfs/dbraw/zinc/22/45/00/1026224500.db2.gz MSIJMAXQWMIBTI-APWZRJJASA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](N3CCCC3)[C@H]2C)cc1C(C)C ZINC000808191487 1026224512 /nfs/dbraw/zinc/22/45/12/1026224512.db2.gz MSIJMAXQWMIBTI-APWZRJJASA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(C[N@H+](C(C)C)C2COC2)ccc1N1CCCCC1 ZINC001170550872 1026266630 /nfs/dbraw/zinc/26/66/30/1026266630.db2.gz UCKOBVUDBPYNNY-UHFFFAOYSA-N 1 1 302.462 3.595 20 10 DHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2[O-])cc1 ZINC000809738935 1026610942 /nfs/dbraw/zinc/61/09/42/1026610942.db2.gz PTMZWXFRJBCNSG-UHFFFAOYSA-N 1 1 318.848 3.739 20 10 DHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000809764948 1026619943 /nfs/dbraw/zinc/61/99/43/1026619943.db2.gz JUHLDRNRJNSKKS-KRWDZBQOSA-N 1 1 301.409 3.870 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)[C@H](C)c2cccnc2)c(O)c1 ZINC000809766091 1026620856 /nfs/dbraw/zinc/62/08/56/1026620856.db2.gz UQYQBFSJAHTOJA-CQSZACIVSA-N 1 1 300.402 3.769 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CCC(F)(F)CC1 ZINC000809782431 1026624251 /nfs/dbraw/zinc/62/42/51/1026624251.db2.gz TXUNGRABPUASGC-UHFFFAOYSA-N 1 1 324.415 3.533 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1 ZINC000810047907 1026669270 /nfs/dbraw/zinc/66/92/70/1026669270.db2.gz OWHGAHUOKRRUQI-OAQYLSRUSA-N 1 1 322.452 3.722 20 10 DHCDMO Cc1cccc2c1OC[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)C2 ZINC000810259776 1026720789 /nfs/dbraw/zinc/72/07/89/1026720789.db2.gz SELCVQOAAKVECN-RISCZKNCSA-N 1 1 319.351 3.633 20 10 DHCDMO COCC1(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)CCCCC1 ZINC000810261441 1026722749 /nfs/dbraw/zinc/72/27/49/1026722749.db2.gz VWKXERTUUSZQLV-GFCCVEGCSA-N 1 1 313.388 3.918 20 10 DHCDMO CSC1(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCC1 ZINC000811453172 1027004112 /nfs/dbraw/zinc/00/41/12/1027004112.db2.gz IHGRWCMPPHQEIB-INIZCTEOSA-N 1 1 321.486 3.659 20 10 DHCDMO Cc1cccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1O ZINC000811508506 1027026918 /nfs/dbraw/zinc/02/69/18/1027026918.db2.gz UGWLEBWYHSCXSQ-GOSISDBHSA-N 1 1 308.425 3.685 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000811513653 1027029245 /nfs/dbraw/zinc/02/92/45/1027029245.db2.gz LUERBGNZBPAYJA-OAHLLOKOSA-N 1 1 322.246 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000811513653 1027029248 /nfs/dbraw/zinc/02/92/48/1027029248.db2.gz LUERBGNZBPAYJA-OAHLLOKOSA-N 1 1 322.246 3.919 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCC1(F)F ZINC000811779778 1027082823 /nfs/dbraw/zinc/08/28/23/1027082823.db2.gz SQXKGQCCTBWNEQ-LLVKDONJSA-N 1 1 313.388 3.872 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1 ZINC000811784026 1027090099 /nfs/dbraw/zinc/09/00/99/1027090099.db2.gz LWRGIBFRDIHBMY-LJQANCHMSA-N 1 1 322.452 3.646 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000296285793 1027597251 /nfs/dbraw/zinc/59/72/51/1027597251.db2.gz HNGMHWHUWQYHHJ-MRXNPFEDSA-N 1 1 302.462 3.676 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)cc1F ZINC000363532258 1027664906 /nfs/dbraw/zinc/66/49/06/1027664906.db2.gz HWRQAANJYVCRAO-INIZCTEOSA-N 1 1 316.424 3.562 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000296619039 1027686892 /nfs/dbraw/zinc/68/68/92/1027686892.db2.gz UPYKDGQZZMWMKE-MRXNPFEDSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H](C)CO1 ZINC000779021301 1027868811 /nfs/dbraw/zinc/86/88/11/1027868811.db2.gz YOXPUEDBDDUDHM-AUUYWEPGSA-N 1 1 315.388 3.802 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)[C@H](C)CO1 ZINC000779021305 1027869250 /nfs/dbraw/zinc/86/92/50/1027869250.db2.gz YOXPUEDBDDUDHM-KUHUBIRLSA-N 1 1 315.388 3.802 20 10 DHCDMO C[N@@H+](Cc1cc(F)ccc1O)[C@H]1CCCN(c2ccccc2)C1 ZINC000779021055 1027873092 /nfs/dbraw/zinc/87/30/92/1027873092.db2.gz QPIPGKHTCDUGFE-SFHVURJKSA-N 1 1 314.404 3.632 20 10 DHCDMO Cc1cnn(C2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)c1 ZINC000364745874 1027883358 /nfs/dbraw/zinc/88/33/58/1027883358.db2.gz IVSSGAFDKQACOG-UHFFFAOYSA-N 1 1 323.799 3.527 20 10 DHCDMO COc1cc(O)c(C[N@@H+](Cc2ccccc2)C(C)C)cc1OC ZINC000159473480 1027993633 /nfs/dbraw/zinc/99/36/33/1027993633.db2.gz JZMZUXYGVQATNR-UHFFFAOYSA-N 1 1 315.413 3.820 20 10 DHCDMO Cc1cc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)ccc1N(C)C ZINC000815055323 1028336449 /nfs/dbraw/zinc/33/64/49/1028336449.db2.gz WOYCITYRISTJNL-HXUWFJFHSA-N 1 1 310.441 3.635 20 10 DHCDMO Cc1cc(C[N@H+]2CCOC[C@@H]2c2ccccc2)ccc1N(C)C ZINC000815055323 1028336469 /nfs/dbraw/zinc/33/64/69/1028336469.db2.gz WOYCITYRISTJNL-HXUWFJFHSA-N 1 1 310.441 3.635 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)cc1 ZINC000815120007 1028364450 /nfs/dbraw/zinc/36/44/50/1028364450.db2.gz LZPTYLXJNNBRLU-MSOLQXFVSA-N 1 1 302.462 3.532 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1 ZINC000815119415 1028365515 /nfs/dbraw/zinc/36/55/15/1028365515.db2.gz WYGAYCAXEHEWLK-RTBURBONSA-N 1 1 314.473 3.676 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CC)[C@H]2CCOC(C)(C)C2)cc1 ZINC000815119834 1028367117 /nfs/dbraw/zinc/36/71/17/1028367117.db2.gz HMDIJFQIBGXHPW-SFHVURJKSA-N 1 1 304.478 3.922 20 10 DHCDMO COc1ccc(Cl)cc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001138482603 1028424510 /nfs/dbraw/zinc/42/45/10/1028424510.db2.gz IIKGWKCHLFMRJW-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)nc1 ZINC000779154572 1028457904 /nfs/dbraw/zinc/45/79/04/1028457904.db2.gz XLSWRXKQAICAIJ-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@H](O)C1)c1cccc(C(F)(F)F)c1O ZINC000815582246 1028554946 /nfs/dbraw/zinc/55/49/46/1028554946.db2.gz AYKYIGTWFATLKE-TUAOUCFPSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+]CCc1ccncc1)c1cccc(C(F)(F)F)c1O ZINC000815588903 1028558399 /nfs/dbraw/zinc/55/83/99/1028558399.db2.gz CJUDMPYVEMIJOZ-NSHDSACASA-N 1 1 310.319 3.699 20 10 DHCDMO CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000040621778 1028580335 /nfs/dbraw/zinc/58/03/35/1028580335.db2.gz MHPKKMNJJDSAAH-NSHDSACASA-N 1 1 317.260 3.519 20 10 DHCDMO CCCO[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816508155 1028911767 /nfs/dbraw/zinc/91/17/67/1028911767.db2.gz DJTUYQFEYBXPIT-CYBMUJFWSA-N 1 1 315.816 3.966 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816508155 1028911779 /nfs/dbraw/zinc/91/17/79/1028911779.db2.gz DJTUYQFEYBXPIT-CYBMUJFWSA-N 1 1 315.816 3.966 20 10 DHCDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816519457 1028916860 /nfs/dbraw/zinc/91/68/60/1028916860.db2.gz JSERGWNJNZXBGG-SFHVURJKSA-N 1 1 321.424 3.788 20 10 DHCDMO Oc1c(C[N@H+]2CCO[C@H](c3ccco3)C2)ccc2ccccc21 ZINC000816518599 1028919211 /nfs/dbraw/zinc/91/92/11/1028919211.db2.gz HLXIAKQETICBQJ-SFHVURJKSA-N 1 1 309.365 3.712 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(Cl)nc1 ZINC000816536015 1028921837 /nfs/dbraw/zinc/92/18/37/1028921837.db2.gz JCRLOFAEJQGZSZ-UHFFFAOYSA-N 1 1 301.148 3.523 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCSC(F)(F)F ZINC000816535146 1028924233 /nfs/dbraw/zinc/92/42/33/1028924233.db2.gz HQTKYKITPKOKPA-UHFFFAOYSA-N 1 1 303.708 3.527 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1cccc(F)c1F ZINC000816549326 1028928721 /nfs/dbraw/zinc/92/87/21/1028928721.db2.gz KVSBYDVZPLBOJI-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C12CCC2 ZINC000816552033 1028939693 /nfs/dbraw/zinc/93/96/93/1028939693.db2.gz YXFWYBIXCBXUHH-HUUCEWRRSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)ccc2ccccc21 ZINC000816593992 1028953120 /nfs/dbraw/zinc/95/31/20/1028953120.db2.gz LYQQAFHEBLONJX-GOSISDBHSA-N 1 1 320.392 3.594 20 10 DHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@@H](O)Cc1ccccc1 ZINC000816624755 1028953756 /nfs/dbraw/zinc/95/37/56/1028953756.db2.gz GVLFIFNBPXSVEN-IBGZPJMESA-N 1 1 321.420 3.581 20 10 DHCDMO C[N@H+](Cc1ccccc1O)[C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000373119805 1028955975 /nfs/dbraw/zinc/95/59/75/1028955975.db2.gz CIHCFFYFKFBYMN-IBGZPJMESA-N 1 1 323.371 3.543 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000373119805 1028955991 /nfs/dbraw/zinc/95/59/91/1028955991.db2.gz CIHCFFYFKFBYMN-IBGZPJMESA-N 1 1 323.371 3.543 20 10 DHCDMO Cc1n[nH]cc1C1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816603772 1028958506 /nfs/dbraw/zinc/95/85/06/1028958506.db2.gz PBYRNFVAIPHLMV-UHFFFAOYSA-N 1 1 323.799 3.596 20 10 DHCDMO CSC[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816617401 1028962430 /nfs/dbraw/zinc/96/24/30/1028962430.db2.gz XVSADEOOIJGALD-JTQLQIEISA-N 1 1 303.830 3.760 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816617401 1028962443 /nfs/dbraw/zinc/96/24/43/1028962443.db2.gz XVSADEOOIJGALD-JTQLQIEISA-N 1 1 303.830 3.760 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817413577 1029152497 /nfs/dbraw/zinc/15/24/97/1029152497.db2.gz ZMVJGGXSTZQGOD-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000155255616 1029212487 /nfs/dbraw/zinc/21/24/87/1029212487.db2.gz IHPSAIBXMZANKN-SFHVURJKSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1ccc(C)c([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938401 1029282989 /nfs/dbraw/zinc/28/29/89/1029282989.db2.gz JVXQTPJLAZEBSH-OXJNMPFZSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(Cl)c1 ZINC000817939106 1029283687 /nfs/dbraw/zinc/28/36/87/1029283687.db2.gz ZAVYWEXIJCDQDU-SCLBCKFNSA-N 1 1 317.864 3.757 20 10 DHCDMO CCc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938943 1029285197 /nfs/dbraw/zinc/28/51/97/1029285197.db2.gz WAVHMPKXKBICCD-YWZLYKJASA-N 1 1 311.473 3.666 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1[O-] ZINC000817950614 1029296000 /nfs/dbraw/zinc/29/60/00/1029296000.db2.gz YVCRSXMSUMPUTL-KRWDZBQOSA-N 1 1 318.848 3.788 20 10 DHCDMO CCCC[C@H](C[NH3+])[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817962054 1029301758 /nfs/dbraw/zinc/30/17/58/1029301758.db2.gz HIZZKBWPERLZPA-GHMZBOCLSA-N 1 1 304.356 3.579 20 10 DHCDMO CC(C)[C@@H](N)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817960033 1029301918 /nfs/dbraw/zinc/30/19/18/1029301918.db2.gz WQSSDGNSTKHDKE-RBUKOAKNSA-N 1 1 312.457 3.639 20 10 DHCDMO C[C@H](NCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969568 1029306907 /nfs/dbraw/zinc/30/69/07/1029306907.db2.gz XJJLKZMMFOGSCT-DOTOQJQBSA-N 1 1 319.468 3.609 20 10 DHCDMO C[C@@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817971642 1029310757 /nfs/dbraw/zinc/31/07/57/1029310757.db2.gz ONUDMFOJSGISKE-LMMKCTJWSA-N 1 1 315.505 3.858 20 10 DHCDMO C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969047 1029311303 /nfs/dbraw/zinc/31/13/03/1029311303.db2.gz QHXUZPXVTLJCTR-RDJZCZTQSA-N 1 1 319.468 3.609 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817971572 1029312079 /nfs/dbraw/zinc/31/20/79/1029312079.db2.gz OHHYYTLNBYVAGP-QKCSRTOESA-N 1 1 316.367 3.592 20 10 DHCDMO C[C@@H](NCCC[NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817983445 1029319099 /nfs/dbraw/zinc/31/90/99/1029319099.db2.gz DOVSYQXJQFDLKB-QGZVFWFLSA-N 1 1 315.505 3.860 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817982910 1029321403 /nfs/dbraw/zinc/32/14/03/1029321403.db2.gz WCEHCHUCHZPCBM-YGRLFVJLSA-N 1 1 316.367 3.579 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1[O-] ZINC000817984997 1029323041 /nfs/dbraw/zinc/32/30/41/1029323041.db2.gz DXHOFTYDCUEUEA-UKRRQHHQSA-N 1 1 308.853 3.761 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COc2cccc(F)c21)c1ccc(N(C)C)cc1 ZINC000374674887 1029427654 /nfs/dbraw/zinc/42/76/54/1029427654.db2.gz BTWBDTUHLYQSMQ-WBMJQRKESA-N 1 1 300.377 3.676 20 10 DHCDMO CCCNc1[nH+]c(C)c(C)cc1C=C(N=[N+]=[N-])C(=O)OCC ZINC001168130846 1029887216 /nfs/dbraw/zinc/88/72/16/1029887216.db2.gz TVFQUAVTDCECHK-LCYFTJDESA-N 1 1 303.366 3.735 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)[C@H](C)c2cccnc2)c1O ZINC000290661538 1030143305 /nfs/dbraw/zinc/14/33/05/1030143305.db2.gz ZROGSLGEQWTAOP-CQSZACIVSA-N 1 1 300.402 3.769 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)[C@@H](C)c2cccnc2)c1O ZINC000290661536 1030144319 /nfs/dbraw/zinc/14/43/19/1030144319.db2.gz ZROGSLGEQWTAOP-AWEZNQCLSA-N 1 1 300.402 3.769 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccc(F)cc1O ZINC000866529470 1030346855 /nfs/dbraw/zinc/34/68/55/1030346855.db2.gz GMJDJXSZNPRPKX-XJKSGUPXSA-N 1 1 307.409 3.779 20 10 DHCDMO C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc2ccccc2c1[O-] ZINC000925840309 1030516877 /nfs/dbraw/zinc/51/68/77/1030516877.db2.gz IBDCSOZYRIYJED-LXGCGDOSSA-N 1 1 310.441 3.728 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2Cc3c[nH]nc3CC(C)(C)C2)cc1 ZINC000828014213 1030530607 /nfs/dbraw/zinc/53/06/07/1030530607.db2.gz XFZHBWBSRWSEMH-WAYWQWQTSA-N 1 1 324.472 3.573 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)c(C)cc2O)on1 ZINC000824596322 1030591365 /nfs/dbraw/zinc/59/13/65/1030591365.db2.gz DWWKNSXBJRQNJU-CQSZACIVSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000824632664 1030598004 /nfs/dbraw/zinc/59/80/04/1030598004.db2.gz PECNYYBMTZXQMC-OAHLLOKOSA-N 1 1 323.845 3.989 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](CO)c2ccc(Cl)cc2)cc1C ZINC000824690789 1030614163 /nfs/dbraw/zinc/61/41/63/1030614163.db2.gz LYWLBSOCJDFPFG-KRWDZBQOSA-N 1 1 319.832 3.828 20 10 DHCDMO CCc1nc(C)c(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)o1 ZINC000291761222 1030634381 /nfs/dbraw/zinc/63/43/81/1030634381.db2.gz RLWUFGIDJHCDLO-UHFFFAOYSA-N 1 1 319.424 3.821 20 10 DHCDMO C[C@@]1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1(Cl)Cl ZINC000824780339 1030635367 /nfs/dbraw/zinc/63/53/67/1030635367.db2.gz KWCLMNVKYUTRDU-NSHDSACASA-N 1 1 312.599 3.858 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2cc(Cl)c(C)cc2O)s1 ZINC000824895223 1030659831 /nfs/dbraw/zinc/65/98/31/1030659831.db2.gz SOVNFPLFTPZPTL-UHFFFAOYSA-N 1 1 310.850 3.793 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)c(C)cc1O ZINC000824895081 1030660772 /nfs/dbraw/zinc/66/07/72/1030660772.db2.gz QDNRHIZSJOXMEQ-UHFFFAOYSA-N 1 1 310.850 3.875 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1C ZINC000824893020 1030661126 /nfs/dbraw/zinc/66/11/26/1030661126.db2.gz IUPWWMXURXPGCI-MSOLQXFVSA-N 1 1 315.457 3.790 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1O ZINC000825215562 1030748105 /nfs/dbraw/zinc/74/81/05/1030748105.db2.gz QKUDXGGGRCZBIB-QGZVFWFLSA-N 1 1 307.459 3.510 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cn(C)cn2)c(C)n1-c1cccc(C)c1 ZINC000926765533 1030910428 /nfs/dbraw/zinc/91/04/28/1030910428.db2.gz XMOIIDGYDFTEGV-INIZCTEOSA-N 1 1 322.456 3.987 20 10 DHCDMO COc1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)cc1C ZINC000237458187 1031041508 /nfs/dbraw/zinc/04/15/08/1031041508.db2.gz SCOLRYMBPIMJEL-UHFFFAOYSA-N 1 1 308.381 3.948 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1cnn(C)c1)C(C)C)c1ccc(F)cc1O ZINC000927067264 1031066354 /nfs/dbraw/zinc/06/63/54/1031066354.db2.gz FDNHETHZCCJPBV-RDJZCZTQSA-N 1 1 305.397 3.703 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1O ZINC000292864070 1031223730 /nfs/dbraw/zinc/22/37/30/1031223730.db2.gz VQVAPLNIUQYUML-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO Cc1nc([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)no1 ZINC000360262655 1031352934 /nfs/dbraw/zinc/35/29/34/1031352934.db2.gz UXTLNCAHEUPXKT-OAHLLOKOSA-N 1 1 323.396 3.616 20 10 DHCDMO CC1(C)CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299928 1031439824 /nfs/dbraw/zinc/43/98/24/1031439824.db2.gz MQWMVUMCMBVDOG-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO CC1(C)CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299928 1031439827 /nfs/dbraw/zinc/43/98/27/1031439827.db2.gz MQWMVUMCMBVDOG-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCOCC3)[C@H]2C2CC2)c1O ZINC000293631433 1031546960 /nfs/dbraw/zinc/54/69/60/1031546960.db2.gz LNPKHBDIFGWIJA-QGZVFWFLSA-N 1 1 321.848 3.745 20 10 DHCDMO COc1cccc(C2([NH2+]Cc3cc(Cl)c(F)cc3O)CC2)c1 ZINC000293714583 1031584760 /nfs/dbraw/zinc/58/47/60/1031584760.db2.gz UZNQCOKIMGQULP-UHFFFAOYSA-N 1 1 321.779 3.972 20 10 DHCDMO COC/C(C)=C\C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000929970061 1031664356 /nfs/dbraw/zinc/66/43/56/1031664356.db2.gz HTLHLNVGQRSXCU-DHDCSXOGSA-N 1 1 301.386 3.580 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)O[C@H](C)C2)cc1C ZINC000872815972 1031667756 /nfs/dbraw/zinc/66/77/56/1031667756.db2.gz FFTSONKLSVZAAV-DOMZBBRYSA-N 1 1 317.351 3.551 20 10 DHCDMO CCCOc1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000873014453 1031693314 /nfs/dbraw/zinc/69/33/14/1031693314.db2.gz RONAPINCOHFKHW-MSOLQXFVSA-N 1 1 302.462 3.500 20 10 DHCDMO CCCOc1ccc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1C ZINC000873014453 1031693327 /nfs/dbraw/zinc/69/33/27/1031693327.db2.gz RONAPINCOHFKHW-MSOLQXFVSA-N 1 1 302.462 3.500 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](COC)c2ccco2)cc1C ZINC000873068177 1031700637 /nfs/dbraw/zinc/70/06/37/1031700637.db2.gz IFQVUHFTZJOQNQ-MRXNPFEDSA-N 1 1 303.402 3.854 20 10 DHCDMO CC(C)c1nccn1C[C@@H]1CCC[N@@H+]1Cc1cccc(F)c1O ZINC000361064767 1031705758 /nfs/dbraw/zinc/70/57/58/1031705758.db2.gz BQYQUSITWXUGFF-HNNXBMFYSA-N 1 1 317.408 3.516 20 10 DHCDMO CC(C)c1nccn1C[C@@H]1CCC[N@H+]1Cc1cccc(F)c1O ZINC000361064767 1031705768 /nfs/dbraw/zinc/70/57/68/1031705768.db2.gz BQYQUSITWXUGFF-HNNXBMFYSA-N 1 1 317.408 3.516 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc2ccccc2c1[O-] ZINC000873245628 1031771309 /nfs/dbraw/zinc/77/13/09/1031771309.db2.gz SKNQIWARLSMGDJ-GDBMZVCRSA-N 1 1 312.457 3.974 20 10 DHCDMO C[C@@]1(CC[NH2+]Cc2c(O)ccc(Cl)c2F)C[C@@]1(F)Cl ZINC000846032073 1031822208 /nfs/dbraw/zinc/82/22/08/1031822208.db2.gz CQDKSWNNAPBOJC-OLZOCXBDSA-N 1 1 310.171 3.979 20 10 DHCDMO CN(C)c1ccc(/C=C/C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000897942041 1031892998 /nfs/dbraw/zinc/89/29/98/1031892998.db2.gz KBCBXIDSBMBRII-VOTSOKGWSA-N 1 1 313.445 3.841 20 10 DHCDMO [O-]c1cc(F)c(F)cc1C[N@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001142527100 1031906653 /nfs/dbraw/zinc/90/66/53/1031906653.db2.gz KOSHBIANOURELV-TXEJJXNPSA-N 1 1 301.336 3.757 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001142527100 1031906664 /nfs/dbraw/zinc/90/66/64/1031906664.db2.gz KOSHBIANOURELV-TXEJJXNPSA-N 1 1 301.336 3.757 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001142527100 1031906673 /nfs/dbraw/zinc/90/66/73/1031906673.db2.gz KOSHBIANOURELV-TXEJJXNPSA-N 1 1 301.336 3.757 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc3scnc3c2)cc1 ZINC001144744534 1031931444 /nfs/dbraw/zinc/93/14/44/1031931444.db2.gz YSAZJOYVEPVZDS-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898072131 1031943620 /nfs/dbraw/zinc/94/36/20/1031943620.db2.gz YKZBPEMMIZXNHS-NSHDSACASA-N 1 1 308.834 3.567 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](Cc3nccs3)C2)cc1C ZINC000898071797 1031945378 /nfs/dbraw/zinc/94/53/78/1031945378.db2.gz SUIWDXUQZXCQMY-CQSZACIVSA-N 1 1 302.443 3.530 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cnn(CC2CCC2)c1 ZINC000898184700 1031985713 /nfs/dbraw/zinc/98/57/13/1031985713.db2.gz VPFCTIUTDOPGID-LLVKDONJSA-N 1 1 321.371 3.518 20 10 DHCDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877468853 1033310613 /nfs/dbraw/zinc/31/06/13/1033310613.db2.gz OEOJAPJEXLWOBD-BRWVUGGUSA-N 1 1 316.489 3.514 20 10 DHCDMO C[C@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1cc(F)ccc1[O-] ZINC000927035664 1033397202 /nfs/dbraw/zinc/39/72/02/1033397202.db2.gz BZQPNAXDILMUBV-UQHVZDHRSA-N 1 1 306.425 3.589 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](O)C[C@@H]1c1ccccc1 ZINC000877674334 1033406901 /nfs/dbraw/zinc/40/69/01/1033406901.db2.gz UBMLINZMECPMNT-NHCUHLMSSA-N 1 1 324.468 3.759 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3nc(C)cs3)C2)c(O)c1 ZINC000877812474 1033462550 /nfs/dbraw/zinc/46/25/50/1033462550.db2.gz ARLGEQOQSRBTOM-CQSZACIVSA-N 1 1 318.442 3.545 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCCOC1 ZINC000151899603 1033491335 /nfs/dbraw/zinc/49/13/35/1033491335.db2.gz PJISMMQFTQWHRC-SFHVURJKSA-N 1 1 302.462 3.535 20 10 DHCDMO C[N@H+](Cc1noc2c1CC(C)(C)CC2)Cc1ccccc1O ZINC000878243046 1033636264 /nfs/dbraw/zinc/63/62/64/1033636264.db2.gz YQODUQFBOJBFPH-UHFFFAOYSA-N 1 1 300.402 3.527 20 10 DHCDMO C[N@@H+](Cc1noc2c1CC(C)(C)CC2)Cc1ccccc1O ZINC000878243046 1033636268 /nfs/dbraw/zinc/63/62/68/1033636268.db2.gz YQODUQFBOJBFPH-UHFFFAOYSA-N 1 1 300.402 3.527 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC000862222388 1033782713 /nfs/dbraw/zinc/78/27/13/1033782713.db2.gz XWGNKVSYQXSNAU-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC000862222388 1033782722 /nfs/dbraw/zinc/78/27/22/1033782722.db2.gz XWGNKVSYQXSNAU-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO C[C@H](c1ccco1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862219502 1033784297 /nfs/dbraw/zinc/78/42/97/1033784297.db2.gz HMQCHDMDYWHQLT-SNVBAGLBSA-N 1 1 310.191 3.941 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC000862366086 1033832404 /nfs/dbraw/zinc/83/24/04/1033832404.db2.gz CWZUHBFQSCMARX-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC000862366086 1033832416 /nfs/dbraw/zinc/83/24/16/1033832416.db2.gz CWZUHBFQSCMARX-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000862449625 1033859772 /nfs/dbraw/zinc/85/97/72/1033859772.db2.gz IAHOAQFSCLPKKZ-UHFFFAOYSA-N 1 1 308.425 3.898 20 10 DHCDMO Oc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000862449625 1033859788 /nfs/dbraw/zinc/85/97/88/1033859788.db2.gz IAHOAQFSCLPKKZ-UHFFFAOYSA-N 1 1 308.425 3.898 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c1 ZINC000862476024 1033861948 /nfs/dbraw/zinc/86/19/48/1033861948.db2.gz FKTLCVZLANMLCE-KXBFYZLASA-N 1 1 316.489 3.833 20 10 DHCDMO CCC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1O ZINC000175284112 1033998656 /nfs/dbraw/zinc/99/86/56/1033998656.db2.gz VDKPKVAQGHETOT-CYBMUJFWSA-N 1 1 320.458 3.968 20 10 DHCDMO CCC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1O ZINC000175284112 1033998668 /nfs/dbraw/zinc/99/86/68/1033998668.db2.gz VDKPKVAQGHETOT-CYBMUJFWSA-N 1 1 320.458 3.968 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](CCF)C2)c(O)c(C(C)(C)C)c1 ZINC000863315897 1034061127 /nfs/dbraw/zinc/06/11/27/1034061127.db2.gz HORFMJMRUFDHQY-OAHLLOKOSA-N 1 1 309.425 3.559 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1O ZINC000879648149 1034069960 /nfs/dbraw/zinc/06/99/60/1034069960.db2.gz AACPIZSIMBKGKR-KGLIPLIRSA-N 1 1 323.396 3.778 20 10 DHCDMO Cc1ccc(C[NH+](C)C)cc1NCc1ccc(F)c(F)c1O ZINC000864030663 1034266003 /nfs/dbraw/zinc/26/60/03/1034266003.db2.gz OBPXXXYJAVFXPZ-UHFFFAOYSA-N 1 1 306.356 3.653 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@H](C3CC3)C2)cc1C(C)C ZINC000794647377 1034311748 /nfs/dbraw/zinc/31/17/48/1034311748.db2.gz OYXFFVMKRZQSAW-IFXJQAMLSA-N 1 1 303.446 3.823 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000179570229 1034314612 /nfs/dbraw/zinc/31/46/12/1034314612.db2.gz RDICXUMHOQRNCF-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000179570229 1034314626 /nfs/dbraw/zinc/31/46/26/1034314626.db2.gz RDICXUMHOQRNCF-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)[C@@H](C)c2cccnc2)c(O)c1 ZINC000183730528 1034417504 /nfs/dbraw/zinc/41/75/04/1034417504.db2.gz VQBICVSPAUUKCP-AWEZNQCLSA-N 1 1 300.402 3.769 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)CC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794835635 1034594620 /nfs/dbraw/zinc/59/46/20/1034594620.db2.gz RFSNDJUJOPHPEI-KOLCDFICSA-N 1 1 318.244 3.901 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2O)n[nH]1 ZINC000186131112 1034600873 /nfs/dbraw/zinc/60/08/73/1034600873.db2.gz WNNJUJFPCCLOJP-GXTWGEPZSA-N 1 1 309.413 3.859 20 10 DHCDMO COC(=O)c1cnc(SCc2c(C)cc(C)[nH+]c2C)s1 ZINC000865369319 1034610905 /nfs/dbraw/zinc/61/09/05/1034610905.db2.gz RAKBMVPOKZWDGS-UHFFFAOYSA-N 1 1 308.428 3.542 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1 ZINC000120545080 1034633535 /nfs/dbraw/zinc/63/35/35/1034633535.db2.gz QGXRZPLWZIOYLL-INIZCTEOSA-N 1 1 317.454 3.943 20 10 DHCDMO C[C@@H]([NH2+]CCCCCCO)c1cc(Cl)c(Cl)cc1O ZINC000193070377 1034828375 /nfs/dbraw/zinc/82/83/75/1034828375.db2.gz ZXQHRBPOELAECB-SNVBAGLBSA-N 1 1 306.233 3.902 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000193467649 1034844511 /nfs/dbraw/zinc/84/45/11/1034844511.db2.gz ZLPBYLALAALSTO-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000193467649 1034844521 /nfs/dbraw/zinc/84/45/21/1034844521.db2.gz ZLPBYLALAALSTO-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc(F)c1F ZINC001143611265 1034902797 /nfs/dbraw/zinc/90/27/97/1034902797.db2.gz WFKPFTBHXXUBCM-UHFFFAOYSA-N 1 1 304.384 3.971 20 10 DHCDMO COc1ccc2c(c1)CC[N@H+](Cc1cc(C)cc(C)c1O)CC2 ZINC000783981063 1035080776 /nfs/dbraw/zinc/08/07/76/1035080776.db2.gz RCUZLCJZOHRLJZ-UHFFFAOYSA-N 1 1 311.425 3.618 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H](C)[N@@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC001177278137 1035363249 /nfs/dbraw/zinc/36/32/49/1035363249.db2.gz RZUAPJAGRCYLCF-ZIAGYGMSSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H](C)[N@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC001177278137 1035363252 /nfs/dbraw/zinc/36/32/52/1035363252.db2.gz RZUAPJAGRCYLCF-ZIAGYGMSSA-N 1 1 310.869 3.707 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cc1 ZINC000773825139 1035499301 /nfs/dbraw/zinc/49/93/01/1035499301.db2.gz WVZXDAQJZAVDIN-MOPGFXCFSA-N 1 1 316.489 3.781 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCc3ccccc3[C@H]2CO)c1 ZINC001179958013 1035559410 /nfs/dbraw/zinc/55/94/10/1035559410.db2.gz VIFAOEJRSHHGNX-LJQANCHMSA-N 1 1 311.425 3.607 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@H]2CN2CCCCC2)c1 ZINC001179967134 1035563062 /nfs/dbraw/zinc/56/30/62/1035563062.db2.gz ZDDICDPVYHSVPS-IBGZPJMESA-N 1 1 316.489 3.966 20 10 DHCDMO CC(C)c1ccc(O)c(CN2CCC[C@H]2C[NH+]2CCCCC2)c1 ZINC001179967134 1035563065 /nfs/dbraw/zinc/56/30/65/1035563065.db2.gz ZDDICDPVYHSVPS-IBGZPJMESA-N 1 1 316.489 3.966 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001180052870 1035577017 /nfs/dbraw/zinc/57/70/17/1035577017.db2.gz WEIGVBXWAGLEDE-RDJZCZTQSA-N 1 1 307.459 3.569 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@@H+](CCCO)Cc2ccccc2)cc1 ZINC001180185185 1035607263 /nfs/dbraw/zinc/60/72/63/1035607263.db2.gz XSWXMOJUVSOHJD-UXBLZVDNSA-N 1 1 324.468 3.650 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](N3CCCC3)C2)c1 ZINC001180249303 1035631642 /nfs/dbraw/zinc/63/16/42/1035631642.db2.gz HSXLLITXFNBGAW-SFHVURJKSA-N 1 1 302.462 3.576 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@H](N3CCCC3)C2)c1 ZINC001180249303 1035631649 /nfs/dbraw/zinc/63/16/49/1035631649.db2.gz HSXLLITXFNBGAW-SFHVURJKSA-N 1 1 302.462 3.576 20 10 DHCDMO COc1cc(C)cc(C[N@H+](Cc2ccccn2)CC(C)C)c1O ZINC000905744952 1035640646 /nfs/dbraw/zinc/64/06/46/1035640646.db2.gz LAIXALKDWUIPCM-UHFFFAOYSA-N 1 1 314.429 3.762 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)CC2(O)CCCCCC2)cc1 ZINC001193615696 1035677133 /nfs/dbraw/zinc/67/71/33/1035677133.db2.gz DBZXGVMNVOHSEW-UHFFFAOYSA-N 1 1 304.478 3.660 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)o1 ZINC001180557789 1035718721 /nfs/dbraw/zinc/71/87/21/1035718721.db2.gz GTYQAGPLAZQERX-UHFFFAOYSA-N 1 1 300.402 3.519 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC(C)=C(Br)C2)ccc1N(C)C ZINC001193882006 1035749259 /nfs/dbraw/zinc/74/92/59/1035749259.db2.gz YZRCZHJTWGZWQX-UHFFFAOYSA-N 1 1 323.278 3.936 20 10 DHCDMO Cc1cc(C[N@H+]2CCC(C)=C(Br)C2)ccc1N(C)C ZINC001193882006 1035749273 /nfs/dbraw/zinc/74/92/73/1035749273.db2.gz YZRCZHJTWGZWQX-UHFFFAOYSA-N 1 1 323.278 3.936 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180970703 1035798739 /nfs/dbraw/zinc/79/87/39/1035798739.db2.gz WBKRXVGVKNVVRO-KWQFWETISA-N 1 1 309.278 3.833 20 10 DHCDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001180970703 1035798749 /nfs/dbraw/zinc/79/87/49/1035798749.db2.gz WBKRXVGVKNVVRO-KWQFWETISA-N 1 1 309.278 3.833 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c(O)c1 ZINC001181212485 1035868488 /nfs/dbraw/zinc/86/84/88/1035868488.db2.gz FHLDMZFFLGKPPV-IBGZPJMESA-N 1 1 315.388 3.780 20 10 DHCDMO Oc1cc(Cl)ccc1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC001181526228 1035935583 /nfs/dbraw/zinc/93/55/83/1035935583.db2.gz VKYNBMIHMBVCCT-ZIAGYGMSSA-N 1 1 309.837 3.684 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC001181675619 1035962769 /nfs/dbraw/zinc/96/27/69/1035962769.db2.gz SVOOUJFCGBZEHN-UHFFFAOYSA-N 1 1 301.336 3.960 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC001181675619 1035962783 /nfs/dbraw/zinc/96/27/83/1035962783.db2.gz SVOOUJFCGBZEHN-UHFFFAOYSA-N 1 1 301.336 3.960 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1cnn(CCF)c1)C1CCCC1 ZINC000929636188 1036158940 /nfs/dbraw/zinc/15/89/40/1036158940.db2.gz QDNALIHHSMRHQQ-UHFFFAOYSA-N 1 1 317.408 3.503 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC001182327334 1036226598 /nfs/dbraw/zinc/22/65/98/1036226598.db2.gz RTWFYMAARNGKMG-OAHLLOKOSA-N 1 1 315.841 3.904 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC001182327334 1036226611 /nfs/dbraw/zinc/22/66/11/1036226611.db2.gz RTWFYMAARNGKMG-OAHLLOKOSA-N 1 1 315.841 3.904 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658757 1036267030 /nfs/dbraw/zinc/26/70/30/1036267030.db2.gz PZXLBKVNTOTDCG-LZWOXQAQSA-N 1 1 322.880 3.883 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658757 1036267050 /nfs/dbraw/zinc/26/70/50/1036267050.db2.gz PZXLBKVNTOTDCG-LZWOXQAQSA-N 1 1 322.880 3.883 20 10 DHCDMO C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774274421 1036272993 /nfs/dbraw/zinc/27/29/93/1036272993.db2.gz SYOZPDXXKDFBNT-JTQLQIEISA-N 1 1 315.244 3.612 20 10 DHCDMO C[C@H]([NH2+]CCOC(F)(F)F)c1cc(Cl)c(Cl)cc1O ZINC000774378555 1036307795 /nfs/dbraw/zinc/30/77/95/1036307795.db2.gz BVHFVTNEAYUPQB-LURJTMIESA-N 1 1 318.122 3.886 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccc3[nH]ccc3c2)cc1 ZINC001182725217 1036437994 /nfs/dbraw/zinc/43/79/94/1036437994.db2.gz GXWSVWMKSUMBKX-UHFFFAOYSA-N 1 1 323.440 3.745 20 10 DHCDMO Cc1cc(Cl)cc(CN(C)CC[C@@H]2CCCC[N@H+]2C)c1O ZINC000775716738 1036524620 /nfs/dbraw/zinc/52/46/20/1036524620.db2.gz MXJXTJMONOJTCJ-INIZCTEOSA-N 1 1 310.869 3.660 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCCC2(CC2)CC1 ZINC001183155054 1036527125 /nfs/dbraw/zinc/52/71/25/1036527125.db2.gz AZTHZPJXECBZMN-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO CCC[N@@H+](Cc1cccc(C)c1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000775715826 1036532875 /nfs/dbraw/zinc/53/28/75/1036532875.db2.gz LVLIZCDEVBUWAA-NXHRZFHOSA-N 1 1 303.446 3.726 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1O ZINC000153507755 1036687530 /nfs/dbraw/zinc/68/75/30/1036687530.db2.gz LCWUNABKJXYZFU-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2c(C)cccc2C)cc1OC ZINC001184034545 1036731228 /nfs/dbraw/zinc/73/12/28/1036731228.db2.gz DGKCTOPIGJLTLA-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H](C)CCCC(C)C)ccc1[N+](=O)[O-] ZINC000774941828 1037249806 /nfs/dbraw/zinc/24/98/06/1037249806.db2.gz FHIQSQHMUIEONB-GFCCVEGCSA-N 1 1 310.394 3.613 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCC(C)(C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775033242 1037443450 /nfs/dbraw/zinc/44/34/50/1037443450.db2.gz NVTZUXOCLTUMCD-AAEUAGOBSA-N 1 1 322.405 3.613 20 10 DHCDMO CN1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@@H]1c1ccccc1 ZINC001203657022 1037611093 /nfs/dbraw/zinc/61/10/93/1037611093.db2.gz BYBXROQHCRTZLO-QGZVFWFLSA-N 1 1 316.832 3.534 20 10 DHCDMO Cc1cc(N(C)Cc2ccc(N3CCCCC3)cc2)nc(C)[nH+]1 ZINC000913035851 1037708320 /nfs/dbraw/zinc/70/83/20/1037708320.db2.gz YGTVIDMGUQASLA-UHFFFAOYSA-N 1 1 310.445 3.720 20 10 DHCDMO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1cc2c(cc1O)CCC2 ZINC000913066356 1037715457 /nfs/dbraw/zinc/71/54/57/1037715457.db2.gz KNLKARAXNHHUAU-UHFFFAOYSA-N 1 1 303.352 3.791 20 10 DHCDMO Cc1cc(F)ccc1C[NH2+]Cc1cccc(Br)c1O ZINC000775151884 1037748889 /nfs/dbraw/zinc/74/88/89/1037748889.db2.gz JDSSAWCHORDDIL-UHFFFAOYSA-N 1 1 324.193 3.892 20 10 DHCDMO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)CCO2 ZINC001201920797 1037940025 /nfs/dbraw/zinc/94/00/25/1037940025.db2.gz UIVVUQBTDPWOEJ-INIZCTEOSA-N 1 1 319.351 3.846 20 10 DHCDMO COc1ccc(N2CC[NH+]([C@@H](C)c3ccccc3F)CC2)cc1 ZINC000916984592 1038104195 /nfs/dbraw/zinc/10/41/95/1038104195.db2.gz KCOZXUVNTHGJKQ-HNNXBMFYSA-N 1 1 314.404 3.718 20 10 DHCDMO COc1cc(C[N@@H+](C)C[C@@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000164309738 1038155350 /nfs/dbraw/zinc/15/53/50/1038155350.db2.gz DALBJUXZGQQDCS-AWEZNQCLSA-N 1 1 321.461 3.557 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000164488818 1038203148 /nfs/dbraw/zinc/20/31/48/1038203148.db2.gz LMCVEGBZAJMZBO-MRXNPFEDSA-N 1 1 303.427 3.644 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCSC(F)(F)F)C2CC2)cc1 ZINC001190445228 1038311193 /nfs/dbraw/zinc/31/11/93/1038311193.db2.gz FHNTZIKCFRIFNR-UHFFFAOYSA-N 1 1 318.408 3.970 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000171295870 1039431979 /nfs/dbraw/zinc/43/19/79/1039431979.db2.gz DHBKLWAHWPOZGW-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000171295870 1039431987 /nfs/dbraw/zinc/43/19/87/1039431987.db2.gz DHBKLWAHWPOZGW-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCN1C ZINC000093643820 193280084 /nfs/dbraw/zinc/28/00/84/193280084.db2.gz GCEYNGOCJYGTGA-PXNSSMCTSA-N 1 1 315.505 3.591 20 10 DHCDMO COc1cccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)c1O ZINC000289419525 131384533 /nfs/dbraw/zinc/38/45/33/131384533.db2.gz IVUUTEWSJRZNQY-OAHLLOKOSA-N 1 1 321.367 3.757 20 10 DHCDMO Cc1ncc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000299193676 132093508 /nfs/dbraw/zinc/09/35/08/132093508.db2.gz GZNMRKWEIIZDPV-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO OCCC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000293671558 335114759 /nfs/dbraw/zinc/11/47/59/335114759.db2.gz QPAIDYBVVIPZPS-MRXNPFEDSA-N 1 1 323.795 3.788 20 10 DHCDMO C[C@@H](CCCCO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296281559 335143044 /nfs/dbraw/zinc/14/30/44/335143044.db2.gz FAOJDBGCKCJFAO-UWVGGRQHSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@H]([NH2+][C@H]1COc2cccc(F)c21)c1ccc(N(C)C)cc1 ZINC000374674883 336994655 /nfs/dbraw/zinc/99/46/55/336994655.db2.gz BTWBDTUHLYQSMQ-LRDDRELGSA-N 1 1 300.377 3.676 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1O ZINC000375531174 337012898 /nfs/dbraw/zinc/01/28/98/337012898.db2.gz ZPMLVTZMZIMWRM-YQVWRLOYSA-N 1 1 303.446 3.606 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCCn2cc(C)nc21)c1ccc(F)cc1O ZINC000375843572 337021007 /nfs/dbraw/zinc/02/10/07/337021007.db2.gz YBDDBPDVINHUGQ-XJKSGUPXSA-N 1 1 317.408 3.655 20 10 DHCDMO C[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccc(F)cc1O ZINC000376131951 337027969 /nfs/dbraw/zinc/02/79/69/337027969.db2.gz QAJGWUJCLMKUCK-CYBMUJFWSA-N 1 1 300.377 3.699 20 10 DHCDMO Cc1c([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)cnn1C ZINC000378446480 337073019 /nfs/dbraw/zinc/07/30/19/337073019.db2.gz YXVYRYVFVYJQTP-MRXNPFEDSA-N 1 1 319.836 3.733 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1noc(-c2ccccc2)n1 ZINC000183562691 337192324 /nfs/dbraw/zinc/19/23/24/337192324.db2.gz VMFWGGQNAVLECS-STQMWFEESA-N 1 1 309.369 3.854 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H]1COc2ccccc21 ZINC000186176013 337254221 /nfs/dbraw/zinc/25/42/21/337254221.db2.gz ZEQJXJZMLBHJRW-OZVIIMIRSA-N 1 1 301.361 3.747 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1O ZINC000190131086 337285173 /nfs/dbraw/zinc/28/51/73/337285173.db2.gz NWHIOJMYCURTQE-KRWDZBQOSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1O ZINC000190131086 337285174 /nfs/dbraw/zinc/28/51/74/337285174.db2.gz NWHIOJMYCURTQE-KRWDZBQOSA-N 1 1 319.351 3.552 20 10 DHCDMO C[N@H+](Cc1ncc(-c2ccccc2F)o1)Cc1ccccc1O ZINC000119527179 337394844 /nfs/dbraw/zinc/39/48/44/337394844.db2.gz GVSVHJRVNYVJDO-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[N@@H+](Cc1ncc(-c2ccccc2F)o1)Cc1ccccc1O ZINC000119527179 337394845 /nfs/dbraw/zinc/39/48/45/337394845.db2.gz GVSVHJRVNYVJDO-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO COC(C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1)OC ZINC000162153201 522528901 /nfs/dbraw/zinc/52/89/01/522528901.db2.gz RAFDCXUSYSEONE-HNNXBMFYSA-N 1 1 315.413 3.574 20 10 DHCDMO C[C@@H]([NH2+]Cc1nccs1)c1ccc(N2CCCCC2)cc1 ZINC000128113968 525563540 /nfs/dbraw/zinc/56/35/40/525563540.db2.gz QIJBWBYZWVNCQK-CQSZACIVSA-N 1 1 301.459 3.984 20 10 DHCDMO COc1cc(C[N@H+]2CCO[C@@H](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000777968500 1032065623 /nfs/dbraw/zinc/06/56/23/1032065623.db2.gz LBLZWGYOYNWJJU-QGZVFWFLSA-N 1 1 321.461 3.555 20 10 DHCDMO Cc1cc(C)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(O)c1 ZINC001167973442 1013406114 /nfs/dbraw/zinc/40/61/14/1013406114.db2.gz KYZONUCCVQEVOO-AYHJJNSGSA-N 1 1 314.473 3.504 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000729465719 1013456359 /nfs/dbraw/zinc/45/63/59/1013456359.db2.gz ISTQWBZFBUNDKG-UHFFFAOYSA-N 1 1 311.425 3.564 20 10 DHCDMO COc1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(O)c1OC ZINC000891499141 1015328134 /nfs/dbraw/zinc/32/81/34/1015328134.db2.gz NGGOVKXBDYKTGI-CYBMUJFWSA-N 1 1 313.397 3.529 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c(O)c1OC ZINC000891558231 1015389860 /nfs/dbraw/zinc/38/98/60/1015389860.db2.gz BNPHSMNDKHLCLD-MRXNPFEDSA-N 1 1 313.397 3.529 20 10 DHCDMO CCc1cc(C[N@@H+]2CCOC[C@@H]2CC)c(O)c(C(C)(C)C)c1 ZINC000738085243 1015397417 /nfs/dbraw/zinc/39/74/17/1015397417.db2.gz RWLVCSKEHAPNOM-INIZCTEOSA-N 1 1 305.462 3.863 20 10 DHCDMO CCc1cccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)c1O ZINC000896422360 1015580354 /nfs/dbraw/zinc/58/03/54/1015580354.db2.gz AUAQSAWAUNZTNG-RDJZCZTQSA-N 1 1 301.361 3.516 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1 ZINC000896640040 1015693603 /nfs/dbraw/zinc/69/36/03/1015693603.db2.gz FYWLMQZQOAQLBO-CABCVRRESA-N 1 1 307.409 3.606 20 10 DHCDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](Cc2cc(C)cc(C)c2O)C1 ZINC000780497579 1015781486 /nfs/dbraw/zinc/78/14/86/1015781486.db2.gz MJXDYHLAOBZIFR-HNNXBMFYSA-N 1 1 317.351 3.552 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000294743746 1032137442 /nfs/dbraw/zinc/13/74/42/1032137442.db2.gz QYSXQFINYJWPTQ-MRXNPFEDSA-N 1 1 313.800 3.576 20 10 DHCDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c(O)c1OC ZINC000892036769 1016140934 /nfs/dbraw/zinc/14/09/34/1016140934.db2.gz QADKMFAKQUHHSP-VNHYZAJKSA-N 1 1 305.418 3.562 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+](C)Cc3nccs3)c2c1 ZINC000074723842 1016348542 /nfs/dbraw/zinc/34/85/42/1016348542.db2.gz UHMNOFVVYFWEIC-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3nccs3)c2c1 ZINC000074723842 1016348553 /nfs/dbraw/zinc/34/85/53/1016348553.db2.gz UHMNOFVVYFWEIC-UHFFFAOYSA-N 1 1 314.410 3.643 20 10 DHCDMO C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000185034240 1016523946 /nfs/dbraw/zinc/52/39/46/1016523946.db2.gz FNUKFEGWKZASNT-CABCVRRESA-N 1 1 308.441 3.694 20 10 DHCDMO Cc1cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)ccc1N(C)C ZINC001167558575 1016533962 /nfs/dbraw/zinc/53/39/62/1016533962.db2.gz PEVSMZQAHBLIES-ROUUACIJSA-N 1 1 304.503 3.921 20 10 DHCDMO Cc1cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)ccc1N(C)C ZINC001167558574 1016535253 /nfs/dbraw/zinc/53/52/53/1016535253.db2.gz PEVSMZQAHBLIES-QZTJIDSGSA-N 1 1 304.503 3.921 20 10 DHCDMO COc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185574331 1017024538 /nfs/dbraw/zinc/02/45/38/1017024538.db2.gz XEMOTTMPSCEWEI-STQMWFEESA-N 1 1 319.376 3.658 20 10 DHCDMO CCc1nocc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000295008417 1032243011 /nfs/dbraw/zinc/24/30/11/1032243011.db2.gz VIZODHONSDINKZ-UHFFFAOYSA-N 1 1 313.445 3.859 20 10 DHCDMO CCc1nocc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000295008417 1032243025 /nfs/dbraw/zinc/24/30/25/1032243025.db2.gz VIZODHONSDINKZ-UHFFFAOYSA-N 1 1 313.445 3.859 20 10 DHCDMO Cc1cccc(O)c1C[N@H+](C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000877563266 1033357950 /nfs/dbraw/zinc/35/79/50/1033357950.db2.gz KCQYGGVRSSGISH-INIZCTEOSA-N 1 1 305.805 3.519 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c1O ZINC000093453353 1032539244 /nfs/dbraw/zinc/53/92/44/1032539244.db2.gz SMLJZPDSONCXSD-QGZVFWFLSA-N 1 1 312.413 3.831 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1O ZINC000124941444 1032683323 /nfs/dbraw/zinc/68/33/23/1032683323.db2.gz NWVGNHIASRFCDM-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO Cc1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)c(C)n1-c1ccccc1 ZINC000857871998 1032695995 /nfs/dbraw/zinc/69/59/95/1032695995.db2.gz ZXYYEWKBQMAXSK-IBGZPJMESA-N 1 1 320.440 3.984 20 10 DHCDMO CCCCN1CCC([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000125144529 1032715570 /nfs/dbraw/zinc/71/55/70/1032715570.db2.gz VCBZYGRFELGDJL-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO CCCC[NH+]1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000125144529 1032715575 /nfs/dbraw/zinc/71/55/75/1032715575.db2.gz VCBZYGRFELGDJL-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795328 1032720466 /nfs/dbraw/zinc/72/04/66/1032720466.db2.gz BALSMSSJHYCCGY-DLBZAZTESA-N 1 1 303.494 3.524 20 10 DHCDMO CC(C)[N@@H+]1CCC[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795328 1032720477 /nfs/dbraw/zinc/72/04/77/1032720477.db2.gz BALSMSSJHYCCGY-DLBZAZTESA-N 1 1 303.494 3.524 20 10 DHCDMO CC(C)[N@H+]1CCC[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795328 1032720488 /nfs/dbraw/zinc/72/04/88/1032720488.db2.gz BALSMSSJHYCCGY-DLBZAZTESA-N 1 1 303.494 3.524 20 10 DHCDMO CC[C@@H]([NH2+]CC(C)(F)F)c1cc(Br)ccc1O ZINC000700111147 1017819248 /nfs/dbraw/zinc/81/92/48/1017819248.db2.gz SVZMPSMRCGNKRJ-SNVBAGLBSA-N 1 1 308.166 3.851 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2[O-])CC1 ZINC000278168263 1018257038 /nfs/dbraw/zinc/25/70/38/1018257038.db2.gz CDWMSGOLRWXFNP-SNVBAGLBSA-N 1 1 317.260 3.834 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000766093275 1018278238 /nfs/dbraw/zinc/27/82/38/1018278238.db2.gz KHOLFZSMJIAPEL-HNNXBMFYSA-N 1 1 300.450 3.771 20 10 DHCDMO CN(C)c1ccc(CNc2[nH+]c3cc(F)ccc3n2C)cc1F ZINC000766109252 1018370926 /nfs/dbraw/zinc/37/09/26/1018370926.db2.gz WAHORSABJRPBEM-UHFFFAOYSA-N 1 1 316.355 3.530 20 10 DHCDMO COc1ccc2c(c1)CCC[N@H+](Cc1cc3c(cc1O)CCC3)C2 ZINC000728564637 1018430500 /nfs/dbraw/zinc/43/05/00/1018430500.db2.gz RKSHFCIFGAWOAS-UHFFFAOYSA-N 1 1 323.436 3.838 20 10 DHCDMO C[C@@H](NC[C@@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933634 1018430970 /nfs/dbraw/zinc/43/09/70/1018430970.db2.gz QFUYVOVXKOOBDT-BRWVUGGUSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@@H](NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764933634 1018430975 /nfs/dbraw/zinc/43/09/75/1018430975.db2.gz QFUYVOVXKOOBDT-BRWVUGGUSA-N 1 1 303.494 3.524 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)c1 ZINC000178885889 1018482739 /nfs/dbraw/zinc/48/27/39/1018482739.db2.gz ZTTOQWJNDMBUOF-GOSISDBHSA-N 1 1 315.388 3.722 20 10 DHCDMO [O-]c1cccc(F)c1C[N@@H+](Cc1ccccc1)C1CCOCC1 ZINC001137839021 1018706382 /nfs/dbraw/zinc/70/63/82/1018706382.db2.gz OJLBZSIFXIOOGX-UHFFFAOYSA-N 1 1 315.388 3.713 20 10 DHCDMO Oc1cccc(F)c1C[N@H+](Cc1ccccc1)C1CCOCC1 ZINC001137839021 1018706389 /nfs/dbraw/zinc/70/63/89/1018706389.db2.gz OJLBZSIFXIOOGX-UHFFFAOYSA-N 1 1 315.388 3.713 20 10 DHCDMO Oc1cccc(F)c1C[N@@H+](Cc1ccccc1)C1CCOCC1 ZINC001137839021 1018706395 /nfs/dbraw/zinc/70/63/95/1018706395.db2.gz OJLBZSIFXIOOGX-UHFFFAOYSA-N 1 1 315.388 3.713 20 10 DHCDMO COc1c(C)cccc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858186227 1032796109 /nfs/dbraw/zinc/79/61/09/1032796109.db2.gz VLPZDTSRNWURNF-UHFFFAOYSA-N 1 1 320.383 3.638 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(F)cc1O ZINC000170788941 1019435836 /nfs/dbraw/zinc/43/58/36/1019435836.db2.gz JXLAFZGAPFFRSA-SNVBAGLBSA-N 1 1 311.303 3.984 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1c(F)cncc1F ZINC000922125010 1019485863 /nfs/dbraw/zinc/48/58/63/1019485863.db2.gz BHYDDYAEEGGLAJ-NSHDSACASA-N 1 1 304.340 3.536 20 10 DHCDMO c1c[nH]c([C@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)n1 ZINC000092071563 1019500872 /nfs/dbraw/zinc/50/08/72/1019500872.db2.gz UQEIVHNXMUSVAA-SFHVURJKSA-N 1 1 324.472 3.780 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)cc1C ZINC000727432105 1019712393 /nfs/dbraw/zinc/71/23/93/1019712393.db2.gz ZWGJIADZDHOLNW-UZLBHIALSA-N 1 1 311.425 3.971 20 10 DHCDMO CO[C@@H]1CCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000728049925 1019866875 /nfs/dbraw/zinc/86/68/75/1019866875.db2.gz NRPLUIJMUPNBMF-CQSZACIVSA-N 1 1 311.381 3.902 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc(F)cc2F)c1O ZINC000887558474 1032860351 /nfs/dbraw/zinc/86/03/51/1032860351.db2.gz ZCSNOVGXKYTLPK-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO c1ccc2c(C[NH2+]Cc3ccc4c(c3)CCCO4)nsc2c1 ZINC000922338992 1020018617 /nfs/dbraw/zinc/01/86/17/1020018617.db2.gz MVCFKVPPVRBGKY-UHFFFAOYSA-N 1 1 310.422 3.911 20 10 DHCDMO CCc1nc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cs1 ZINC000921724317 1020568786 /nfs/dbraw/zinc/56/87/86/1020568786.db2.gz AMVFHHRSDTUMFG-LBPRGKRZSA-N 1 1 302.443 3.881 20 10 DHCDMO CCc1nc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cs1 ZINC000921724316 1020569510 /nfs/dbraw/zinc/56/95/10/1020569510.db2.gz AMVFHHRSDTUMFG-GFCCVEGCSA-N 1 1 302.443 3.881 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490603 1032916488 /nfs/dbraw/zinc/91/64/88/1032916488.db2.gz KKZOLLXJKGXPPS-HOTGVXAUSA-N 1 1 316.489 3.654 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cccc(Cl)c1[O-] ZINC000858490192 1032915435 /nfs/dbraw/zinc/91/54/35/1032915435.db2.gz CTVWVHZYGQTULU-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@H]1SCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)[C@@H]1C ZINC000735668621 1020760225 /nfs/dbraw/zinc/76/02/25/1020760225.db2.gz JYLSQRJRDGTEAS-VXGBXAGGSA-N 1 1 309.475 3.721 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1 ZINC000187594031 1020806391 /nfs/dbraw/zinc/80/63/91/1020806391.db2.gz LJPNEKJRMJRNCL-LBPRGKRZSA-N 1 1 319.351 3.669 20 10 DHCDMO C[C@H]1CSCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000738276414 1020866865 /nfs/dbraw/zinc/86/68/65/1020866865.db2.gz HZNPGGFSJSAHSP-LBPRGKRZSA-N 1 1 317.454 3.955 20 10 DHCDMO C[C@H]([NH2+][C@H]1CO[C@@H](C2CC2)C1)c1cccc(C(F)(F)F)c1O ZINC000858546709 1032941922 /nfs/dbraw/zinc/94/19/22/1032941922.db2.gz DJECSDMUMDXUAT-DRCTWCGVSA-N 1 1 315.335 3.629 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2C[C@H](C)C[C@@H]2C)c1O ZINC000740859203 1020955426 /nfs/dbraw/zinc/95/54/26/1020955426.db2.gz JHRQIDJWSYWAEU-OLZOCXBDSA-N 1 1 313.397 3.562 20 10 DHCDMO CC(C)[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)N1CCCCCC1 ZINC000917395034 1021248794 /nfs/dbraw/zinc/24/87/94/1021248794.db2.gz ZRBMOBUDIKQUTF-IBGZPJMESA-N 1 1 316.489 3.612 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@]1(C)O ZINC001236793728 1021277692 /nfs/dbraw/zinc/27/76/92/1021277692.db2.gz OIMCQURBQYMEJZ-BONVTDFDSA-N 1 1 318.244 3.682 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@]1(C)O ZINC001236793728 1021277699 /nfs/dbraw/zinc/27/76/99/1021277699.db2.gz OIMCQURBQYMEJZ-BONVTDFDSA-N 1 1 318.244 3.682 20 10 DHCDMO CC(C)[C@@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)CCS1 ZINC000743394889 1021280331 /nfs/dbraw/zinc/28/03/31/1021280331.db2.gz DGUJDRHVFXKXRP-KRWDZBQOSA-N 1 1 302.443 3.514 20 10 DHCDMO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)cs1 ZINC000743841766 1021370225 /nfs/dbraw/zinc/37/02/25/1021370225.db2.gz VZCZLNFLICUILD-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cs1 ZINC000743841766 1021370242 /nfs/dbraw/zinc/37/02/42/1021370242.db2.gz VZCZLNFLICUILD-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccncc2Cl)C2CC2)cc1 ZINC000743840969 1021370853 /nfs/dbraw/zinc/37/08/53/1021370853.db2.gz AXQORADCRVJMSA-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccncc2Cl)C2CC2)cc1 ZINC000743840969 1021370871 /nfs/dbraw/zinc/37/08/71/1021370871.db2.gz AXQORADCRVJMSA-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2nc3ccccc3s2)cc1 ZINC000007248403 1021416807 /nfs/dbraw/zinc/41/68/07/1021416807.db2.gz NELDRFLGEFEMBT-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)cc1 ZINC000007248403 1021416813 /nfs/dbraw/zinc/41/68/13/1021416813.db2.gz NELDRFLGEFEMBT-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO CC(C)(C)[N@@H+]1CC[C@@H](NCc2ccc(N3CCCCC3)cc2)C1 ZINC000850351721 1021484365 /nfs/dbraw/zinc/48/43/65/1021484365.db2.gz RUPFYQZOCNBFGM-GOSISDBHSA-N 1 1 315.505 3.639 20 10 DHCDMO CC(C)(C)[N@H+]1CC[C@@H](NCc2ccc(N3CCCCC3)cc2)C1 ZINC000850351721 1021484369 /nfs/dbraw/zinc/48/43/69/1021484369.db2.gz RUPFYQZOCNBFGM-GOSISDBHSA-N 1 1 315.505 3.639 20 10 DHCDMO C[C@H](N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537873 1021594019 /nfs/dbraw/zinc/59/40/19/1021594019.db2.gz ASYDIFTXLGSBTN-ZFWWWQNUSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537873 1021594030 /nfs/dbraw/zinc/59/40/30/1021594030.db2.gz ASYDIFTXLGSBTN-ZFWWWQNUSA-N 1 1 306.425 3.589 20 10 DHCDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000154848346 1021673532 /nfs/dbraw/zinc/67/35/32/1021673532.db2.gz PQNDSZKRFMFSMW-INIZCTEOSA-N 1 1 319.445 3.564 20 10 DHCDMO C[C@@H](c1nnc(-c2cccs2)o1)[N@H+](C)Cc1ccccc1O ZINC000109769393 1021745654 /nfs/dbraw/zinc/74/56/54/1021745654.db2.gz JEOBSLRWGZMOMS-NSHDSACASA-N 1 1 315.398 3.697 20 10 DHCDMO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+](C)Cc1ccccc1O ZINC000109769393 1021745670 /nfs/dbraw/zinc/74/56/70/1021745670.db2.gz JEOBSLRWGZMOMS-NSHDSACASA-N 1 1 315.398 3.697 20 10 DHCDMO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccccc1O ZINC000109770633 1021747621 /nfs/dbraw/zinc/74/76/21/1021747621.db2.gz PTTDODDDFSTEQZ-NSHDSACASA-N 1 1 315.398 3.697 20 10 DHCDMO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccccc1O ZINC000109770633 1021747638 /nfs/dbraw/zinc/74/76/38/1021747638.db2.gz PTTDODDDFSTEQZ-NSHDSACASA-N 1 1 315.398 3.697 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)cc1C ZINC000066794217 1021753303 /nfs/dbraw/zinc/75/33/03/1021753303.db2.gz WLMPGKCHQZPKGK-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3ccccc3F)C2)cc1C ZINC000066794217 1021753319 /nfs/dbraw/zinc/75/33/19/1021753319.db2.gz WLMPGKCHQZPKGK-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000119081029 1021786514 /nfs/dbraw/zinc/78/65/14/1021786514.db2.gz BQVSFDPWXKGYBZ-CQSZACIVSA-N 1 1 321.804 3.820 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000119081029 1021786528 /nfs/dbraw/zinc/78/65/28/1021786528.db2.gz BQVSFDPWXKGYBZ-CQSZACIVSA-N 1 1 321.804 3.820 20 10 DHCDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc2c(cc1O)OCO2 ZINC000746033623 1021832460 /nfs/dbraw/zinc/83/24/60/1021832460.db2.gz RMCKAVKMWVTATE-UHFFFAOYSA-N 1 1 319.788 3.796 20 10 DHCDMO c1ccc([C@@H]2CC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000155063431 1021855485 /nfs/dbraw/zinc/85/54/85/1021855485.db2.gz GQRIJDGLAUDJNN-HXUWFJFHSA-N 1 1 322.452 3.513 20 10 DHCDMO C[N@@H+](CCO[C@H]1CC1(F)F)Cc1ccc(N2CCCCC2)cc1 ZINC000851717608 1021970947 /nfs/dbraw/zinc/97/09/47/1021970947.db2.gz ZORDJPORECQEDT-KRWDZBQOSA-N 1 1 324.415 3.533 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1c1ccccc1 ZINC000919949015 1021973966 /nfs/dbraw/zinc/97/39/66/1021973966.db2.gz MXZJWSIRWHTTRC-GOSISDBHSA-N 1 1 311.381 3.704 20 10 DHCDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cc1cc2c(cc1O)OCO2 ZINC000919950560 1021980457 /nfs/dbraw/zinc/98/04/57/1021980457.db2.gz LZTZVNAUIIMVBU-UHFFFAOYSA-N 1 1 317.360 3.671 20 10 DHCDMO Cc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)s1 ZINC000920206562 1022077579 /nfs/dbraw/zinc/07/75/79/1022077579.db2.gz NZPFSMBOOIHANM-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[O-] ZINC000853241906 1022242426 /nfs/dbraw/zinc/24/24/26/1022242426.db2.gz YSFTWMVCEBYGTK-MAUKXSAKSA-N 1 1 320.452 3.694 20 10 DHCDMO Cc1cc[nH+]c(N[C@H](C)c2ccc(N3CCOCC3)c(F)c2)c1 ZINC000182640652 1022298145 /nfs/dbraw/zinc/29/81/45/1022298145.db2.gz SXFFMHMTCDQYRX-CQSZACIVSA-N 1 1 315.392 3.539 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)cc1C ZINC000853613709 1022299456 /nfs/dbraw/zinc/29/94/56/1022299456.db2.gz IHPIARZMMJXRRM-OCCSQVGLSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)cc1C ZINC000853613709 1022299461 /nfs/dbraw/zinc/29/94/61/1022299461.db2.gz IHPIARZMMJXRRM-OCCSQVGLSA-N 1 1 317.351 3.551 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)cc1OC ZINC000853634050 1022300175 /nfs/dbraw/zinc/30/01/75/1022300175.db2.gz ISYJSQYJEKYKAW-ZFWWWQNUSA-N 1 1 305.418 3.564 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC3(CCOCC3)[C@@H]2C)c(O)c1 ZINC000363866342 1022353709 /nfs/dbraw/zinc/35/37/09/1022353709.db2.gz IAAXTJWHRARZDF-HNNXBMFYSA-N 1 1 319.445 3.572 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000237564349 1022442179 /nfs/dbraw/zinc/44/21/79/1022442179.db2.gz SDYDAWSSSYJRJA-LBPRGKRZSA-N 1 1 303.406 3.540 20 10 DHCDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccccc1O)c1ccc(F)cc1 ZINC000179586911 1022474750 /nfs/dbraw/zinc/47/47/50/1022474750.db2.gz CGPXUMMEOZWVED-QGZVFWFLSA-N 1 1 313.372 3.769 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1cnn2ccccc12)C1CCCC1 ZINC000179589125 1022475378 /nfs/dbraw/zinc/47/53/78/1022475378.db2.gz FLQRPXLZSIQDCF-UHFFFAOYSA-N 1 1 321.424 3.985 20 10 DHCDMO CCCC[N@@H+](Cc1csnc1OC)Cc1ccccc1O ZINC001169754534 1022530885 /nfs/dbraw/zinc/53/08/85/1022530885.db2.gz NONXMRAGYCJKDJ-UHFFFAOYSA-N 1 1 306.431 3.660 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCc2ccccc21 ZINC000179907024 1022577710 /nfs/dbraw/zinc/57/77/10/1022577710.db2.gz VIPXKJZPIQLTBW-OAQYLSRUSA-N 1 1 322.452 3.643 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCC[C@@H]1CCO1)Cc1ccco1 ZINC000876511081 1033079518 /nfs/dbraw/zinc/07/95/18/1033079518.db2.gz VUZGNPRYKKKFSC-MRXNPFEDSA-N 1 1 301.386 3.557 20 10 DHCDMO Cc1cccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c1O ZINC000180703750 1022786103 /nfs/dbraw/zinc/78/61/03/1022786103.db2.gz QEIYBABJGBXWMJ-LJQANCHMSA-N 1 1 311.425 3.534 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000856804916 1022872411 /nfs/dbraw/zinc/87/24/11/1022872411.db2.gz HRDROSPKKYFFDH-SSDOTTSWSA-N 1 1 312.599 3.858 20 10 DHCDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000768138900 1022904379 /nfs/dbraw/zinc/90/43/79/1022904379.db2.gz WHACEYIZKAICGN-OAHLLOKOSA-N 1 1 320.452 3.671 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCC[C@H](O)C2)cc1 ZINC000768140052 1022904965 /nfs/dbraw/zinc/90/49/65/1022904965.db2.gz ABUNVSUZUQPEIX-NRFANRHFSA-N 1 1 324.468 3.670 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@H]1CC=CCC1 ZINC000768162060 1022907336 /nfs/dbraw/zinc/90/73/36/1022907336.db2.gz KGVAPDDWDAUUQL-FUHWJXTLSA-N 1 1 301.430 3.730 20 10 DHCDMO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768171644 1022909849 /nfs/dbraw/zinc/90/98/49/1022909849.db2.gz FXMDYRJYLTUPOA-FUHWJXTLSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1ccc(C[N@H+](C)Cc2c(O)cccc2Cl)c(OC)c1 ZINC000768168685 1022910863 /nfs/dbraw/zinc/91/08/63/1022910863.db2.gz LOCFSPZNIVABGN-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)c(OC)c1 ZINC000768168685 1022910879 /nfs/dbraw/zinc/91/08/79/1022910879.db2.gz LOCFSPZNIVABGN-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(OCC[N@@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000768196496 1022924570 /nfs/dbraw/zinc/92/45/70/1022924570.db2.gz GBMMPYAEHFWZJJ-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000768238585 1022925235 /nfs/dbraw/zinc/92/52/35/1022925235.db2.gz QSUNLPYOSTVNNN-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000768238585 1022925243 /nfs/dbraw/zinc/92/52/43/1022925243.db2.gz QSUNLPYOSTVNNN-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO CC(C)[N@@H+](CCCO)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001248883316 1033092593 /nfs/dbraw/zinc/09/25/93/1033092593.db2.gz FEKPGXXVFYTIPK-UHFFFAOYSA-N 1 1 313.869 3.936 20 10 DHCDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000768252976 1022933881 /nfs/dbraw/zinc/93/38/81/1022933881.db2.gz SXIJZCWVAGOZCC-LLVKDONJSA-N 1 1 319.788 3.967 20 10 DHCDMO Cc1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c(O)c1 ZINC000876558061 1033093295 /nfs/dbraw/zinc/09/32/95/1033093295.db2.gz HWVNLAOMCKOQDE-UHFFFAOYSA-N 1 1 319.408 3.866 20 10 DHCDMO CC(C)C[N@@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000768244358 1022938004 /nfs/dbraw/zinc/93/80/04/1022938004.db2.gz IXGPEVFQCKHIAJ-UHFFFAOYSA-N 1 1 305.422 3.673 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1CO ZINC000857061284 1022940316 /nfs/dbraw/zinc/94/03/16/1022940316.db2.gz NNNZKCDVUUCCDL-HNAYVOBHSA-N 1 1 311.425 3.510 20 10 DHCDMO CC[NH+](CC)CC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000768304160 1022943718 /nfs/dbraw/zinc/94/37/18/1022943718.db2.gz TZKCJHLHWHFNGQ-UHFFFAOYSA-N 1 1 310.869 3.599 20 10 DHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000768337283 1022948357 /nfs/dbraw/zinc/94/83/57/1022948357.db2.gz CVWTZJOLYRZIRV-AWEZNQCLSA-N 1 1 305.422 3.815 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000768351762 1022950884 /nfs/dbraw/zinc/95/08/84/1022950884.db2.gz KABWZIBGUBQMJL-UHFFFAOYSA-N 1 1 313.445 3.572 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1O ZINC000768363999 1022952203 /nfs/dbraw/zinc/95/22/03/1022952203.db2.gz DRXLCKVBZBHTAB-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO CC(C)(C)c1cc(C[N@H+]2CC[C@H](O)C2)c(O)c(C(C)(C)C)c1 ZINC000768408832 1022959200 /nfs/dbraw/zinc/95/92/00/1022959200.db2.gz FWEQHRGYLKSSMC-HNNXBMFYSA-N 1 1 305.462 3.554 20 10 DHCDMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000768419964 1022968106 /nfs/dbraw/zinc/96/81/06/1022968106.db2.gz BAZIRFHBJIPFTQ-AWEZNQCLSA-N 1 1 317.433 3.815 20 10 DHCDMO COc1cc(C[N@H+]2CCc3sccc3[C@@H]2C)c(O)cc1C ZINC000768441460 1022969067 /nfs/dbraw/zinc/96/90/67/1022969067.db2.gz IZSUPZPFLJBGCS-LBPRGKRZSA-N 1 1 303.427 3.890 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c(O)cc1C ZINC000768464199 1022973773 /nfs/dbraw/zinc/97/37/73/1022973773.db2.gz OEIDBSPSRZAOLT-HNNXBMFYSA-N 1 1 315.388 3.838 20 10 DHCDMO CCC[C@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000768465813 1022974510 /nfs/dbraw/zinc/97/45/10/1022974510.db2.gz LYQOOIZIBOESKB-GOSISDBHSA-N 1 1 307.434 3.812 20 10 DHCDMO COc1cc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c(O)cc1C ZINC000768466483 1022975973 /nfs/dbraw/zinc/97/59/73/1022975973.db2.gz QSWHQAPKCDEEPQ-QGZVFWFLSA-N 1 1 319.445 3.633 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCOC1)C1CCCCC1 ZINC000768532230 1022982950 /nfs/dbraw/zinc/98/29/50/1022982950.db2.gz IHRYNDXRCKCUOI-MRXNPFEDSA-N 1 1 303.446 3.954 20 10 DHCDMO C[C@@H]([N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)C(C)(C)C ZINC000768541782 1022985378 /nfs/dbraw/zinc/98/53/78/1022985378.db2.gz AEPMPDDUZFYSMI-CQSZACIVSA-N 1 1 308.441 3.529 20 10 DHCDMO COCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)c1ccccc1 ZINC000768595325 1022998311 /nfs/dbraw/zinc/99/83/11/1022998311.db2.gz HRGDPYXINITEGD-QGZVFWFLSA-N 1 1 312.457 3.962 20 10 DHCDMO C[C@@H]([N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC000876598711 1033101626 /nfs/dbraw/zinc/10/16/26/1033101626.db2.gz PFJDSSYPHIJSNX-OAHLLOKOSA-N 1 1 304.478 3.514 20 10 DHCDMO C[N@H+](Cc1c(O)cccc1Cl)C[C@H]1OCCc2ccccc21 ZINC000769021354 1023070679 /nfs/dbraw/zinc/07/06/79/1023070679.db2.gz HFYHCXOHLJUVGO-GOSISDBHSA-N 1 1 317.816 3.791 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](C[C@H]3CC=CCC3)CC2)cc1 ZINC000768997846 1023075034 /nfs/dbraw/zinc/07/50/34/1023075034.db2.gz IJLQSKSNOBJFFU-KRWDZBQOSA-N 1 1 300.446 3.564 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](C[C@@H]3CC=CCC3)CC2)cc1 ZINC000768997848 1023075637 /nfs/dbraw/zinc/07/56/37/1023075637.db2.gz IJLQSKSNOBJFFU-QGZVFWFLSA-N 1 1 300.446 3.564 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)cc1F ZINC000769228992 1023103499 /nfs/dbraw/zinc/10/34/99/1023103499.db2.gz HOHPQSAMKZBBJA-KRWDZBQOSA-N 1 1 313.420 3.578 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCN(C2CC2)C1 ZINC000769327027 1023123408 /nfs/dbraw/zinc/12/34/08/1023123408.db2.gz SXJAKZUEUAXTRR-HXUWFJFHSA-N 1 1 322.452 3.728 20 10 DHCDMO CN(Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000769327027 1023123412 /nfs/dbraw/zinc/12/34/12/1023123412.db2.gz SXJAKZUEUAXTRR-HXUWFJFHSA-N 1 1 322.452 3.728 20 10 DHCDMO CN(Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000769327027 1023123414 /nfs/dbraw/zinc/12/34/14/1023123414.db2.gz SXJAKZUEUAXTRR-HXUWFJFHSA-N 1 1 322.452 3.728 20 10 DHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769405390 1023143230 /nfs/dbraw/zinc/14/32/30/1023143230.db2.gz UXWZFDKRMFYNNR-YVWKXTFCSA-N 1 1 314.473 3.676 20 10 DHCDMO c1cc(N2CCOCC2)ccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000769489356 1023153906 /nfs/dbraw/zinc/15/39/06/1023153906.db2.gz YFLMVQYHMBPJFE-UHFFFAOYSA-N 1 1 314.473 3.679 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCN(CC)[C@H](C)C2)cc1 ZINC000769470650 1023160879 /nfs/dbraw/zinc/16/08/79/1023160879.db2.gz NEBXSSDZPTXTAB-XLIONFOSSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCN(CC)[C@H](C)C2)cc1 ZINC000769470650 1023160883 /nfs/dbraw/zinc/16/08/83/1023160883.db2.gz NEBXSSDZPTXTAB-XLIONFOSSA-N 1 1 317.521 3.837 20 10 DHCDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000769497392 1023166728 /nfs/dbraw/zinc/16/67/28/1023166728.db2.gz CRYFZDVAPLKEIU-QGZVFWFLSA-N 1 1 319.832 3.819 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000769507866 1023170736 /nfs/dbraw/zinc/17/07/36/1023170736.db2.gz PMGGGMKMGBTZSA-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO CCOc1ccc(C[N@@H+](CCc2nccs2)C(C)C)c(O)c1 ZINC000769517110 1023171381 /nfs/dbraw/zinc/17/13/81/1023171381.db2.gz PBLIIRXGGNECED-UHFFFAOYSA-N 1 1 320.458 3.701 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)cc1 ZINC000769519230 1023171919 /nfs/dbraw/zinc/17/19/19/1023171919.db2.gz LWPCOUUYEVVULC-IBGZPJMESA-N 1 1 316.489 3.781 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)C[C@H]2CCOC2)cc1 ZINC000769532168 1023173273 /nfs/dbraw/zinc/17/32/73/1023173273.db2.gz HSEVBNJHSYIAEH-GOSISDBHSA-N 1 1 304.478 3.781 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)c(O)c1 ZINC000769537190 1023176252 /nfs/dbraw/zinc/17/62/52/1023176252.db2.gz IOKVIPNBQJFAMO-GOSISDBHSA-N 1 1 314.429 3.857 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)cc1 ZINC000770293500 1023294647 /nfs/dbraw/zinc/29/46/47/1023294647.db2.gz PFFJIZAJANLCMR-PKOBYXMFSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000770323288 1023297737 /nfs/dbraw/zinc/29/77/37/1023297737.db2.gz GLEVOBZIVLFWMG-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000770323288 1023297745 /nfs/dbraw/zinc/29/77/45/1023297745.db2.gz GLEVOBZIVLFWMG-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000770354183 1023304953 /nfs/dbraw/zinc/30/49/53/1023304953.db2.gz FFNYUSHSMFJZRU-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000770354183 1023304962 /nfs/dbraw/zinc/30/49/62/1023304962.db2.gz FFNYUSHSMFJZRU-UHFFFAOYSA-N 1 1 319.351 3.627 20 10 DHCDMO Cc1cccc(C[N@@H+]2Cc3cccc(Br)c3C2)c1O ZINC000770664435 1023335757 /nfs/dbraw/zinc/33/57/57/1023335757.db2.gz MYXSRVYEIVLJKO-UHFFFAOYSA-N 1 1 318.214 3.979 20 10 DHCDMO Cc1cccc(C[N@H+]2Cc3cccc(Br)c3C2)c1O ZINC000770664435 1023335761 /nfs/dbraw/zinc/33/57/61/1023335761.db2.gz MYXSRVYEIVLJKO-UHFFFAOYSA-N 1 1 318.214 3.979 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000770677981 1023336910 /nfs/dbraw/zinc/33/69/10/1023336910.db2.gz XIUTXXINJFFHSS-UHFFFAOYSA-N 1 1 310.235 3.839 20 10 DHCDMO Cc1cc(Br)c(O)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000770677981 1023336915 /nfs/dbraw/zinc/33/69/15/1023336915.db2.gz XIUTXXINJFFHSS-UHFFFAOYSA-N 1 1 310.235 3.839 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc3ccccc3[nH]c2=O)cc1 ZINC000771935156 1023489903 /nfs/dbraw/zinc/48/99/03/1023489903.db2.gz LKSVUMPSZLFFLT-UHFFFAOYSA-N 1 1 321.424 3.638 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000876770211 1033140801 /nfs/dbraw/zinc/14/08/01/1033140801.db2.gz KAUUVSCGLDJAHR-SFHVURJKSA-N 1 1 311.425 3.739 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1cc(F)cc(F)c1O ZINC000785571005 1023596094 /nfs/dbraw/zinc/59/60/94/1023596094.db2.gz VKQZLFRDWYFUJX-VFZGTOFNSA-N 1 1 323.314 3.984 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc3cnccc3c2)cc1 ZINC000787038482 1023751685 /nfs/dbraw/zinc/75/16/85/1023751685.db2.gz GZSMAPQUYAYVMU-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1ccc(F)cc1O ZINC000796703406 1023855751 /nfs/dbraw/zinc/85/57/51/1023855751.db2.gz UMAALJQJOMPTIG-FUHWJXTLSA-N 1 1 303.377 3.614 20 10 DHCDMO CC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1ccc(F)cc1O ZINC000796801178 1023857350 /nfs/dbraw/zinc/85/73/50/1023857350.db2.gz YNHBNAJVHBRUNZ-CQSZACIVSA-N 1 1 308.422 3.888 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2C[C@@H](O)C[C@H]2C)cc1 ZINC000788270102 1023870000 /nfs/dbraw/zinc/87/00/00/1023870000.db2.gz PFMSVQZPDWMIPU-UTKZUKDTSA-N 1 1 324.468 3.668 20 10 DHCDMO Cc1cc(C)c([C@H](C)[NH2+]CCCN2CCC(C)CC2)c(O)c1 ZINC000788507175 1023896591 /nfs/dbraw/zinc/89/65/91/1023896591.db2.gz YIUPLPLONPGOOQ-KRWDZBQOSA-N 1 1 304.478 3.782 20 10 DHCDMO CCN1CCC[C@@H]1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788506641 1023897130 /nfs/dbraw/zinc/89/71/30/1023897130.db2.gz XBRWHCWYPXAUGA-VXGBXAGGSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788629724 1023916306 /nfs/dbraw/zinc/91/63/06/1023916306.db2.gz CYVNWAJIUFPUBU-WDEREUQCSA-N 1 1 317.351 3.877 20 10 DHCDMO CC[C@H](O)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788663538 1023921634 /nfs/dbraw/zinc/92/16/34/1023921634.db2.gz GJQULQJHYXEBPN-QWRGUYRKSA-N 1 1 305.340 3.613 20 10 DHCDMO C[C@H]([NH2+]CCOCC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000788749871 1023927169 /nfs/dbraw/zinc/92/71/69/1023927169.db2.gz JLLQPSWTOIKSQL-NSHDSACASA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@H]([NH2+]CCCCCCO)c1cccc(C(F)(F)F)c1O ZINC000788694501 1023927942 /nfs/dbraw/zinc/92/79/42/1023927942.db2.gz UZPOQMVFXGSHKU-NSHDSACASA-N 1 1 305.340 3.614 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788695207 1023927991 /nfs/dbraw/zinc/92/79/91/1023927991.db2.gz ZEISVZNECLAQSW-WDEREUQCSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]([NH2+]CCOCC1CCC1)c1cccc(C(F)(F)F)c1O ZINC000788749870 1023928002 /nfs/dbraw/zinc/92/80/02/1023928002.db2.gz JLLQPSWTOIKSQL-LLVKDONJSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788795690 1023935938 /nfs/dbraw/zinc/93/59/38/1023935938.db2.gz BABYSCAQKGYBKF-NXEZZACHSA-N 1 1 305.365 3.815 20 10 DHCDMO CC(C)n1ncnc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000789292102 1024040166 /nfs/dbraw/zinc/04/01/66/1024040166.db2.gz AWKGXVASQLNAEH-UHFFFAOYSA-N 1 1 314.433 3.509 20 10 DHCDMO CC(C)n1ncnc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000789292102 1024040181 /nfs/dbraw/zinc/04/01/81/1024040181.db2.gz AWKGXVASQLNAEH-UHFFFAOYSA-N 1 1 314.433 3.509 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000707129726 1024053542 /nfs/dbraw/zinc/05/35/42/1024053542.db2.gz RIYPILTVMMDWQI-BXUZGUMPSA-N 1 1 310.235 3.919 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)cc1F ZINC000129957412 1024109881 /nfs/dbraw/zinc/10/98/81/1024109881.db2.gz LMHQBPQMTREDNZ-MRXNPFEDSA-N 1 1 320.452 3.673 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(c3ccccc3F)C[C@H]2C)c1O ZINC000789590006 1024122154 /nfs/dbraw/zinc/12/21/54/1024122154.db2.gz OWAZNHCJOXNBAZ-OAHLLOKOSA-N 1 1 314.404 3.550 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1O ZINC000130150531 1024133387 /nfs/dbraw/zinc/13/33/87/1024133387.db2.gz VKLRBSZBENWQDF-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO COc1ccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)cc1F ZINC000882880646 1024157200 /nfs/dbraw/zinc/15/72/00/1024157200.db2.gz CAHFUBDNZSGKED-VIFPVBQESA-N 1 1 311.303 3.669 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000882880082 1024157321 /nfs/dbraw/zinc/15/73/21/1024157321.db2.gz AWLXJRPYQYMZFA-CQSZACIVSA-N 1 1 307.365 3.997 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1OC ZINC000882887609 1024161642 /nfs/dbraw/zinc/16/16/42/1024161642.db2.gz AIKJQJIKEQGXPQ-HNNXBMFYSA-N 1 1 307.340 3.920 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000268853532 1024179566 /nfs/dbraw/zinc/17/95/66/1024179566.db2.gz QFGVVBJBZAOWOX-GOSISDBHSA-N 1 1 319.408 3.950 20 10 DHCDMO CC(C)(C)Oc1cccc(C[NH2+]Cc2cc(F)cc(F)c2O)n1 ZINC000883079972 1024230972 /nfs/dbraw/zinc/23/09/72/1024230972.db2.gz LWVFDCWKWLHVCR-UHFFFAOYSA-N 1 1 322.355 3.533 20 10 DHCDMO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2cc(F)cc(F)c2O)CCO1 ZINC000883084384 1024236025 /nfs/dbraw/zinc/23/60/25/1024236025.db2.gz PUNMKNQLBBJKBU-ZBFHGGJFSA-N 1 1 313.388 3.744 20 10 DHCDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883089991 1024240749 /nfs/dbraw/zinc/24/07/49/1024240749.db2.gz ZIPPDMQIHIPEBR-SNVBAGLBSA-N 1 1 323.387 3.781 20 10 DHCDMO CC(C)(C)OC1CC(CC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000883103749 1024241663 /nfs/dbraw/zinc/24/16/63/1024241663.db2.gz FIJPULMDINQCIV-UHFFFAOYSA-N 1 1 313.388 3.744 20 10 DHCDMO Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000883289475 1024351524 /nfs/dbraw/zinc/35/15/24/1024351524.db2.gz PUHKIDLVCXPWIC-SFHVURJKSA-N 1 1 323.484 3.598 20 10 DHCDMO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c(Cl)n1 ZINC000883292425 1024355313 /nfs/dbraw/zinc/35/53/13/1024355313.db2.gz NUHNIRNQWFODNB-UHFFFAOYSA-N 1 1 307.800 3.538 20 10 DHCDMO c1cnc(C2([NH2+]Cc3ccc(N4CCCCC4)cc3)CCC2)nc1 ZINC000883308709 1024361429 /nfs/dbraw/zinc/36/14/29/1024361429.db2.gz WAGUJSXASYQLRI-UHFFFAOYSA-N 1 1 322.456 3.636 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790947213 1024402869 /nfs/dbraw/zinc/40/28/69/1024402869.db2.gz MCJRJQNUWSIEHP-GFCCVEGCSA-N 1 1 314.832 3.539 20 10 DHCDMO COc1ccc(C2([NH2+]Cc3c(O)ccc(Cl)c3F)CC2)cc1 ZINC000790961481 1024406374 /nfs/dbraw/zinc/40/63/74/1024406374.db2.gz VXIJIRKWENOORY-UHFFFAOYSA-N 1 1 321.779 3.972 20 10 DHCDMO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790989242 1024412061 /nfs/dbraw/zinc/41/20/61/1024412061.db2.gz AJUNFIXJMRVGNQ-DZGCQCFKSA-N 1 1 315.816 3.868 20 10 DHCDMO COc1cccc(O)c1C[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC000883383017 1024415708 /nfs/dbraw/zinc/41/57/08/1024415708.db2.gz RMQZTNYTIFLYFJ-YJBOKZPZSA-N 1 1 301.361 3.516 20 10 DHCDMO CCO[C@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C12CCC2 ZINC000790972042 1024420226 /nfs/dbraw/zinc/42/02/26/1024420226.db2.gz FCERATQPZHJNFP-KBPBESRZSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000790977700 1024421815 /nfs/dbraw/zinc/42/18/15/1024421815.db2.gz PCDIXVAUVFAYHA-AHIWAGSCSA-N 1 1 317.791 3.860 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc2ccccc2[nH]c1=O ZINC001137188873 1024428865 /nfs/dbraw/zinc/42/88/65/1024428865.db2.gz VXXGDWPCDHVXHH-UHFFFAOYSA-N 1 1 308.381 3.668 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cscn2)cc1F ZINC000271146048 1024462087 /nfs/dbraw/zinc/46/20/87/1024462087.db2.gz PLABGIKTAQIYOP-GFCCVEGCSA-N 1 1 307.438 3.979 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000271255091 1024477937 /nfs/dbraw/zinc/47/79/37/1024477937.db2.gz JKYFJPBRSGPZLY-MLGOLLRUSA-N 1 1 321.804 3.727 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@H]2OCCC[C@@H]12)c1cc(Cl)c(Cl)cc1O ZINC000373206295 1024619774 /nfs/dbraw/zinc/61/97/74/1024619774.db2.gz AQPSABRAPIRTSU-SEWBUJKGSA-N 1 1 316.228 3.917 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCSCC2)c(C(F)(F)F)c1 ZINC000793061588 1024890293 /nfs/dbraw/zinc/89/02/93/1024890293.db2.gz KPKLKOMLBLNAOV-UHFFFAOYSA-N 1 1 318.408 3.710 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000793230496 1024943308 /nfs/dbraw/zinc/94/33/08/1024943308.db2.gz FWRFTDCKBHHVJN-MFKMUULPSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cccc(Cl)c2)cc1OC ZINC000159486918 1025061746 /nfs/dbraw/zinc/06/17/46/1025061746.db2.gz UKJJXZFWMFDHLW-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1(C)C ZINC000740863623 1025087303 /nfs/dbraw/zinc/08/73/03/1025087303.db2.gz VMNBLDQLJOGMBZ-ROUUACIJSA-N 1 1 303.446 3.516 20 10 DHCDMO CC[C@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1ccc(N(C)C)cc1 ZINC000793567241 1025104509 /nfs/dbraw/zinc/10/45/09/1025104509.db2.gz IEBNHVMQXXJZIY-IBGZPJMESA-N 1 1 322.456 3.912 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000793607546 1025127273 /nfs/dbraw/zinc/12/72/73/1025127273.db2.gz AMQVVONXLNLKAW-VQTJNVASSA-N 1 1 314.473 3.820 20 10 DHCDMO CCC(C)(C)[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828307012 1025234691 /nfs/dbraw/zinc/23/46/91/1025234691.db2.gz USGFQVBFUTUWIH-UHFFFAOYSA-N 1 1 304.478 3.922 20 10 DHCDMO Cc1cnc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000794257225 1025242563 /nfs/dbraw/zinc/24/25/63/1025242563.db2.gz LISAHESSNIWGAI-QGZVFWFLSA-N 1 1 324.472 3.968 20 10 DHCDMO CCc1nc(C)c(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)o1 ZINC000794275776 1025245720 /nfs/dbraw/zinc/24/57/20/1025245720.db2.gz QYFSKCLQYANIRJ-UHFFFAOYSA-N 1 1 313.445 3.776 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccccc3C)CC2)cc1 ZINC000108093443 1025324136 /nfs/dbraw/zinc/32/41/36/1025324136.db2.gz NROWGZLFJRYPKR-UHFFFAOYSA-N 1 1 310.441 3.716 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1c(O)cccc1F ZINC000886490061 1025650573 /nfs/dbraw/zinc/65/05/73/1025650573.db2.gz YMDFTIMDBZAAAP-DGCLKSJQSA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886495214 1025652466 /nfs/dbraw/zinc/65/24/66/1025652466.db2.gz NIECRVKAHZXVFZ-ZUZCIYMTSA-N 1 1 309.768 3.569 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cn1 ZINC000886508910 1025661247 /nfs/dbraw/zinc/66/12/47/1025661247.db2.gz SCTKMRZTFNJACV-CYBMUJFWSA-N 1 1 317.408 3.623 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1c(O)cccc1F ZINC000886521394 1025674659 /nfs/dbraw/zinc/67/46/59/1025674659.db2.gz ZYJXPVFKBMFHFL-LBPRGKRZSA-N 1 1 317.360 3.543 20 10 DHCDMO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886540285 1025687628 /nfs/dbraw/zinc/68/76/28/1025687628.db2.gz CBIDJWMUYOJUEL-ABAIWWIYSA-N 1 1 301.361 3.878 20 10 DHCDMO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886543457 1025691459 /nfs/dbraw/zinc/69/14/59/1025691459.db2.gz PDMAKGLRTIITNU-UHIISALHSA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561873 1025706379 /nfs/dbraw/zinc/70/63/79/1025706379.db2.gz LPDUWBCMSJDSTI-GHMZBOCLSA-N 1 1 304.321 3.851 20 10 DHCDMO COc1ccccc1C1([NH2+][C@H](C)c2c(O)cccc2F)CC1 ZINC000886630007 1025749438 /nfs/dbraw/zinc/74/94/38/1025749438.db2.gz SJUGVGGKIPZYSO-GFCCVEGCSA-N 1 1 301.361 3.880 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1[N+](=O)[O-] ZINC000886646585 1025756466 /nfs/dbraw/zinc/75/64/66/1025756466.db2.gz NGXCQLCZOLZDRW-NSHDSACASA-N 1 1 304.321 3.599 20 10 DHCDMO C[C@H]([NH2+]CCSCCC(F)(F)F)c1c(O)cccc1F ZINC000886648269 1025759681 /nfs/dbraw/zinc/75/96/81/1025759681.db2.gz PFQHAYMNHFVSJJ-VIFPVBQESA-N 1 1 311.344 3.868 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H](O)c1ccccc1 ZINC000886649430 1025760193 /nfs/dbraw/zinc/76/01/93/1025760193.db2.gz AKHYCKZWOQVXJG-QITLCBANSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000248518721 1025968722 /nfs/dbraw/zinc/96/87/22/1025968722.db2.gz QCXSBTMCWUKMKY-XZOAIXRZSA-N 1 1 301.361 3.712 20 10 DHCDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCN1C ZINC000093643819 1026121008 /nfs/dbraw/zinc/12/10/08/1026121008.db2.gz GCEYNGOCJYGTGA-XLIONFOSSA-N 1 1 315.505 3.591 20 10 DHCDMO CCCN1CCC([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000808672072 1026354186 /nfs/dbraw/zinc/35/41/86/1026354186.db2.gz BPKYUXXPUZUSDG-ZDUSSCGKSA-N 1 1 310.869 3.879 20 10 DHCDMO COc1cncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000808710550 1026361305 /nfs/dbraw/zinc/36/13/05/1026361305.db2.gz KQDJZEUTNNJOQI-UHFFFAOYSA-N 1 1 313.445 3.567 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1 ZINC000809693383 1026585879 /nfs/dbraw/zinc/58/58/79/1026585879.db2.gz UWRLTZLXEIBUCL-LJQANCHMSA-N 1 1 312.461 3.983 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2cccnc2)c1O ZINC000809728697 1026595228 /nfs/dbraw/zinc/59/52/28/1026595228.db2.gz FSHGDEAMAVRVGU-HNNXBMFYSA-N 1 1 318.804 3.786 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)Cc2cccn2C)cc1 ZINC000809731663 1026597653 /nfs/dbraw/zinc/59/76/53/1026597653.db2.gz MTFHVTHIQATAIF-UHFFFAOYSA-N 1 1 323.440 3.887 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)Cc2cccn2C)cc1 ZINC000809731663 1026597661 /nfs/dbraw/zinc/59/76/61/1026597661.db2.gz MTFHVTHIQATAIF-UHFFFAOYSA-N 1 1 323.440 3.887 20 10 DHCDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809767536 1026606618 /nfs/dbraw/zinc/60/66/18/1026606618.db2.gz NLQVGMQQRKHZIK-LJQANCHMSA-N 1 1 313.441 3.898 20 10 DHCDMO Cc1cccc(C[N@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)c1O ZINC000809774735 1026607497 /nfs/dbraw/zinc/60/74/97/1026607497.db2.gz YHFSPKGQVIWSNS-SJORKVTESA-N 1 1 313.441 3.687 20 10 DHCDMO CC[N@H+](CCCN(C)C)Cc1cc(-c2ccccc2)ccc1O ZINC000809749675 1026613899 /nfs/dbraw/zinc/61/38/99/1026613899.db2.gz JGLZYDPZKXOJDO-UHFFFAOYSA-N 1 1 312.457 3.833 20 10 DHCDMO CC[N@@H+](CCCN(C)C)Cc1cc(-c2ccccc2)ccc1O ZINC000809749675 1026613907 /nfs/dbraw/zinc/61/39/07/1026613907.db2.gz JGLZYDPZKXOJDO-UHFFFAOYSA-N 1 1 312.457 3.833 20 10 DHCDMO CCC(CC)[N@@H+](CC)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000809788017 1026626448 /nfs/dbraw/zinc/62/64/48/1026626448.db2.gz LKCFWUROKJZYMY-UHFFFAOYSA-N 1 1 308.441 3.673 20 10 DHCDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000809791435 1026629474 /nfs/dbraw/zinc/62/94/74/1026629474.db2.gz YQYPDBBTGVJHOX-LJQANCHMSA-N 1 1 304.478 3.517 20 10 DHCDMO Cc1nc(C)c(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000809945908 1026643643 /nfs/dbraw/zinc/64/36/43/1026643643.db2.gz GVMMHLIUHYXDAX-UHFFFAOYSA-N 1 1 300.402 3.942 20 10 DHCDMO Cc1nc(C)c(C[N@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000809961386 1026652401 /nfs/dbraw/zinc/65/24/01/1026652401.db2.gz RWDCPXRACDAPCH-UHFFFAOYSA-N 1 1 312.369 3.792 20 10 DHCDMO Cc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000809961386 1026652405 /nfs/dbraw/zinc/65/24/05/1026652405.db2.gz RWDCPXRACDAPCH-UHFFFAOYSA-N 1 1 312.369 3.792 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)C1CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000810259413 1026720251 /nfs/dbraw/zinc/72/02/51/1026720251.db2.gz IPLDMJMFDKFUGD-YMTOWFKASA-N 1 1 318.244 3.901 20 10 DHCDMO CCC[N@H+](CC)C[C@@H](C)N[C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810261838 1026721206 /nfs/dbraw/zinc/72/12/06/1026721206.db2.gz KSCKOWYKBGVYQH-NFAWXSAZSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810261838 1026721212 /nfs/dbraw/zinc/72/12/12/1026721212.db2.gz KSCKOWYKBGVYQH-NFAWXSAZSA-N 1 1 308.441 3.790 20 10 DHCDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000811520255 1027020563 /nfs/dbraw/zinc/02/05/63/1027020563.db2.gz MNFPSKMDCVAKPM-HNNXBMFYSA-N 1 1 308.441 3.673 20 10 DHCDMO CC1(C)C[N@H+](Cc2cccc(Br)c2O)[C@H]1C1CC1 ZINC000811513917 1027029462 /nfs/dbraw/zinc/02/94/62/1027029462.db2.gz VUOOTQRCEQENNE-AWEZNQCLSA-N 1 1 310.235 3.775 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cccc(Br)c2O)[C@H]1C1CC1 ZINC000811513917 1027029467 /nfs/dbraw/zinc/02/94/67/1027029467.db2.gz VUOOTQRCEQENNE-AWEZNQCLSA-N 1 1 310.235 3.775 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000811781550 1027081953 /nfs/dbraw/zinc/08/19/53/1027081953.db2.gz DRCFJARNXDTLMY-NRFANRHFSA-N 1 1 323.436 3.979 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC000811793250 1027093209 /nfs/dbraw/zinc/09/32/09/1027093209.db2.gz UVSDJPNQKIASQE-SJLPKXTDSA-N 1 1 301.430 3.543 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1 ZINC000811793249 1027093323 /nfs/dbraw/zinc/09/33/23/1027093323.db2.gz UVSDJPNQKIASQE-FUHWJXTLSA-N 1 1 301.430 3.543 20 10 DHCDMO Cc1cccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c1O ZINC000271854315 1027163706 /nfs/dbraw/zinc/16/37/06/1027163706.db2.gz XBATZPWRPVKFNI-UHFFFAOYSA-N 1 1 319.408 3.866 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@](C)(F)C3)cc2)CC1 ZINC000295301654 1027188586 /nfs/dbraw/zinc/18/85/86/1027188586.db2.gz FHYBRKMPXYLPAU-IBGZPJMESA-N 1 1 320.452 3.626 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCOC1 ZINC000812776987 1027399726 /nfs/dbraw/zinc/39/97/26/1027399726.db2.gz UFFOBZJOOQZEMP-IBGZPJMESA-N 1 1 302.462 3.676 20 10 DHCDMO CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1[O-] ZINC000296333320 1027606308 /nfs/dbraw/zinc/60/63/08/1027606308.db2.gz HJRXEUFOLAIRPL-XQERAMJGSA-N 1 1 308.853 3.712 20 10 DHCDMO CCOc1cccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780791959 1027668018 /nfs/dbraw/zinc/66/80/18/1027668018.db2.gz DKOVCRRSKMDFSB-YPMHNXCESA-N 1 1 317.351 3.954 20 10 DHCDMO CC[C@H]([NH2+]Cc1cnc(OC)c(Cl)c1)c1ccc(F)cc1O ZINC000296656922 1027699497 /nfs/dbraw/zinc/69/94/97/1027699497.db2.gz ZKDVMNUCEGVLNO-AWEZNQCLSA-N 1 1 324.783 3.829 20 10 DHCDMO COCC[N@@H+](Cc1cc(F)ccc1O)[C@H](C)c1ccccc1 ZINC000778996414 1027735808 /nfs/dbraw/zinc/73/58/08/1027735808.db2.gz OCMDQJIOCVTALD-CQSZACIVSA-N 1 1 303.377 3.741 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813882911 1027750698 /nfs/dbraw/zinc/75/06/98/1027750698.db2.gz AFWDMEKGKDUDLW-JSGCOSHPSA-N 1 1 318.367 3.600 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000365614508 1027983277 /nfs/dbraw/zinc/98/32/77/1027983277.db2.gz UMLMTZRKEKHVDW-DZGCQCFKSA-N 1 1 305.809 3.640 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1 ZINC000366544075 1028096260 /nfs/dbraw/zinc/09/62/60/1028096260.db2.gz KNYCBRCAZHLMCY-SCLBCKFNSA-N 1 1 312.413 3.940 20 10 DHCDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000780793965 1028183771 /nfs/dbraw/zinc/18/37/71/1028183771.db2.gz ZWXZOGOGVQBXGR-GXTWGEPZSA-N 1 1 300.368 3.915 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@H](c3cccs3)C2)ccc1N(C)C ZINC000815063197 1028347612 /nfs/dbraw/zinc/34/76/12/1028347612.db2.gz WXHQEDWOWIOQHN-KRWDZBQOSA-N 1 1 316.470 3.696 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](c3cccs3)C2)ccc1N(C)C ZINC000815063197 1028347616 /nfs/dbraw/zinc/34/76/16/1028347616.db2.gz WXHQEDWOWIOQHN-KRWDZBQOSA-N 1 1 316.470 3.696 20 10 DHCDMO CSCc1cnc(C[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000815124745 1028370687 /nfs/dbraw/zinc/37/06/87/1028370687.db2.gz JSMWXLALNVESTP-UHFFFAOYSA-N 1 1 321.515 3.670 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)ccc1N(C)C ZINC000815095809 1028376634 /nfs/dbraw/zinc/37/66/34/1028376634.db2.gz YTYWKIIHARQJCT-OAQYLSRUSA-N 1 1 322.452 3.692 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)cc1 ZINC000779152455 1028442463 /nfs/dbraw/zinc/44/24/63/1028442463.db2.gz ABZDNLCYVKGDBU-PKOBYXMFSA-N 1 1 304.478 3.516 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000369878255 1028542831 /nfs/dbraw/zinc/54/28/31/1028542831.db2.gz OWVHLWKADCBOTI-PKOBYXMFSA-N 1 1 315.388 3.576 20 10 DHCDMO Cc1cncc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)c1 ZINC000815598722 1028563592 /nfs/dbraw/zinc/56/35/92/1028563592.db2.gz AXUJGAAAABTMGP-NSHDSACASA-N 1 1 310.319 3.965 20 10 DHCDMO CCN(CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000815573690 1028567732 /nfs/dbraw/zinc/56/77/32/1028567732.db2.gz QSJYMQGNUPHDBG-GFCCVEGCSA-N 1 1 318.383 3.792 20 10 DHCDMO CCC[N@@H+](Cc1cc(-c2cccnc2)n[nH]1)Cc1ccccc1O ZINC000372409886 1028848318 /nfs/dbraw/zinc/84/83/18/1028848318.db2.gz MFUFGYSGFIOWFV-UHFFFAOYSA-N 1 1 322.412 3.590 20 10 DHCDMO COc1ccc(C[N@H+](C)Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816481219 1028888790 /nfs/dbraw/zinc/88/87/90/1028888790.db2.gz MZCQRCCFHNQHON-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816481219 1028888815 /nfs/dbraw/zinc/88/88/15/1028888815.db2.gz MZCQRCCFHNQHON-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc3ccccc3c2O)ccc1O ZINC000816484160 1028893351 /nfs/dbraw/zinc/89/33/51/1028893351.db2.gz RCAPNEURFUPWIC-UHFFFAOYSA-N 1 1 323.392 3.892 20 10 DHCDMO Cc1sccc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000816481542 1028894171 /nfs/dbraw/zinc/89/41/71/1028894171.db2.gz ZUKFHYHRJULVDM-QGZVFWFLSA-N 1 1 317.454 3.943 20 10 DHCDMO Oc1c(CN2CCC[N@H+](C3CCCC3)CC2)ccc2ccccc21 ZINC000816499655 1028908422 /nfs/dbraw/zinc/90/84/22/1028908422.db2.gz WOMWTAFQVNYIBM-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(C[N@@H+]2CCCN(C3CCCC3)CC2)ccc2ccccc21 ZINC000816499655 1028908426 /nfs/dbraw/zinc/90/84/26/1028908426.db2.gz WOMWTAFQVNYIBM-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(C[N@H+]2CCCN(C3CCCC3)CC2)ccc2ccccc21 ZINC000816499655 1028908433 /nfs/dbraw/zinc/90/84/33/1028908433.db2.gz WOMWTAFQVNYIBM-UHFFFAOYSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000816550522 1028929647 /nfs/dbraw/zinc/92/96/47/1028929647.db2.gz TVFVJSPQUYYTEB-KRWDZBQOSA-N 1 1 321.779 3.588 20 10 DHCDMO CCO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C12CCC2 ZINC000816552034 1028939682 /nfs/dbraw/zinc/93/96/82/1028939682.db2.gz YXFWYBIXCBXUHH-LSDHHAIUSA-N 1 1 313.800 3.622 20 10 DHCDMO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816560775 1028945832 /nfs/dbraw/zinc/94/58/32/1028945832.db2.gz ZXONJXUZCNSELG-STQMWFEESA-N 1 1 315.816 3.868 20 10 DHCDMO C[N@H+](Cc1ccccc1O)[C@H](c1ccc(F)cc1)c1cnccn1 ZINC000373119806 1028957699 /nfs/dbraw/zinc/95/76/99/1028957699.db2.gz CIHCFFYFKFBYMN-LJQANCHMSA-N 1 1 323.371 3.543 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H](c1ccc(F)cc1)c1cnccn1 ZINC000373119806 1028957708 /nfs/dbraw/zinc/95/77/08/1028957708.db2.gz CIHCFFYFKFBYMN-LJQANCHMSA-N 1 1 323.371 3.543 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000816610748 1028960402 /nfs/dbraw/zinc/96/04/02/1028960402.db2.gz WVYPEYWAZRUXPT-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000373254630 1028987221 /nfs/dbraw/zinc/98/72/21/1028987221.db2.gz FVNDDAKOILGUJS-OHNRDTAOSA-N 1 1 315.388 3.960 20 10 DHCDMO CO[C@@]1(C)CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373469444 1029053360 /nfs/dbraw/zinc/05/33/60/1029053360.db2.gz ZWDKUBCJXLPFPM-HNNXBMFYSA-N 1 1 301.789 3.576 20 10 DHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373469444 1029053374 /nfs/dbraw/zinc/05/33/74/1029053374.db2.gz ZWDKUBCJXLPFPM-HNNXBMFYSA-N 1 1 301.789 3.576 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000817585552 1029211540 /nfs/dbraw/zinc/21/15/40/1029211540.db2.gz GOLUKRXWOSTPBU-LPXQKFACSA-N 1 1 306.425 3.542 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000374303982 1029281750 /nfs/dbraw/zinc/28/17/50/1029281750.db2.gz XZEULGWQTPEHRI-CQSZACIVSA-N 1 1 304.415 3.585 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000374303982 1029281765 /nfs/dbraw/zinc/28/17/65/1029281765.db2.gz XZEULGWQTPEHRI-CQSZACIVSA-N 1 1 304.415 3.585 20 10 DHCDMO C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1cc2ccccc2o1 ZINC000817938107 1029282120 /nfs/dbraw/zinc/28/21/20/1029282120.db2.gz DQVGICRXSVAHHB-KSSFIOAISA-N 1 1 323.440 3.849 20 10 DHCDMO Cc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817938052 1029282718 /nfs/dbraw/zinc/28/27/18/1029282718.db2.gz CKTWTVSTCDOSLU-UZLBHIALSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)cc1 ZINC000817937989 1029283202 /nfs/dbraw/zinc/28/32/02/1029283202.db2.gz AXJVOYQKTMBSSQ-SCLBCKFNSA-N 1 1 317.864 3.757 20 10 DHCDMO CC(C)[N@H+](C)CCN[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000155730089 1029288545 /nfs/dbraw/zinc/28/85/45/1029288545.db2.gz JPOFYBQAAAQVRW-QGZVFWFLSA-N 1 1 303.494 3.668 20 10 DHCDMO CC(C)[N@@H+](C)CCN[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000155730089 1029288560 /nfs/dbraw/zinc/28/85/60/1029288560.db2.gz JPOFYBQAAAQVRW-QGZVFWFLSA-N 1 1 303.494 3.668 20 10 DHCDMO CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817958937 1029297313 /nfs/dbraw/zinc/29/73/13/1029297313.db2.gz NCALJSHJHWZNGY-VHSXEESVSA-N 1 1 305.249 3.723 20 10 DHCDMO C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817964776 1029299152 /nfs/dbraw/zinc/29/91/52/1029299152.db2.gz IHNYTJQMJNSEOA-FXAWDEMLSA-N 1 1 315.505 3.717 20 10 DHCDMO CCC[NH2+]CC[NH2+][C@@H](CC)c1cc(Cl)cc(Cl)c1[O-] ZINC000817963054 1029301816 /nfs/dbraw/zinc/30/18/16/1029301816.db2.gz RGHXBNDYTFZORJ-ZDUSSCGKSA-N 1 1 305.249 3.739 20 10 DHCDMO C[C@@H](NCC[NH2+]C1CCCCCC1)c1cc(F)cc(F)c1O ZINC000817959375 1029302278 /nfs/dbraw/zinc/30/22/78/1029302278.db2.gz CJPLNGKNMXCGCS-GFCCVEGCSA-N 1 1 312.404 3.633 20 10 DHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cc(OC)ccc1O ZINC000191189870 1029306914 /nfs/dbraw/zinc/30/69/14/1029306914.db2.gz MRIAEJYSDLZCAY-UHFFFAOYSA-N 1 1 310.397 3.904 20 10 DHCDMO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817971168 1029310887 /nfs/dbraw/zinc/31/08/87/1029310887.db2.gz JWUOMTHYUJIDGG-BFYDXBDKSA-N 1 1 319.468 3.607 20 10 DHCDMO CC[NH2+][C@H](C)C[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000817972492 1029311654 /nfs/dbraw/zinc/31/16/54/1029311654.db2.gz LZGBNDOFEOQUHY-SKDRFNHKSA-N 1 1 305.249 3.738 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccc(F)cc1O ZINC000817977124 1029317598 /nfs/dbraw/zinc/31/75/98/1029317598.db2.gz CAEVJYAQJZNVSP-GFCCVEGCSA-N 1 1 300.377 3.740 20 10 DHCDMO CO[C@@](C)(C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000820851867 1029780418 /nfs/dbraw/zinc/78/04/18/1029780418.db2.gz UCYZINYSISBMPY-FQEVSTJZSA-N 1 1 316.489 3.924 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1 ZINC000290110094 1029901081 /nfs/dbraw/zinc/90/10/81/1029901081.db2.gz IEAVXYMFYNKWEG-BETUJISGSA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1cccc2c1CCOC2 ZINC000865724548 1029990415 /nfs/dbraw/zinc/99/04/15/1029990415.db2.gz XPJZDPFACBHUQR-UHFFFAOYSA-N 1 1 321.779 3.547 20 10 DHCDMO CCOc1cccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000865822845 1030041700 /nfs/dbraw/zinc/04/17/00/1030041700.db2.gz PCQBVVLMRIPFPJ-OAHLLOKOSA-N 1 1 307.340 3.730 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCc3cccc(F)c3C2)cc1 ZINC001171005964 1030209897 /nfs/dbraw/zinc/20/98/97/1030209897.db2.gz URGIAEUZFBKMAJ-SFHVURJKSA-N 1 1 312.432 3.881 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccnc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000866473525 1030310265 /nfs/dbraw/zinc/31/02/65/1030310265.db2.gz FPUOIEURERHSBN-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO CC[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000866513366 1030340279 /nfs/dbraw/zinc/34/02/79/1030340279.db2.gz VHOGCXUXHPMASF-RPVQJOFSSA-N 1 1 307.409 3.777 20 10 DHCDMO CCC1([NH3+])CC[NH+]([C@@H](C)c2ccc(Cl)c(Cl)c2[O-])CC1 ZINC000925761325 1030485674 /nfs/dbraw/zinc/48/56/74/1030485674.db2.gz ZMYPSXKIYSURQN-JTQLQIEISA-N 1 1 317.260 3.963 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)Cc2cccs2)cc1)[C@H](C)CO ZINC000824422552 1030550136 /nfs/dbraw/zinc/55/01/36/1030550136.db2.gz CBUNNXLUQJJXPH-OAHLLOKOSA-N 1 1 318.486 3.587 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000824779929 1030636579 /nfs/dbraw/zinc/63/65/79/1030636579.db2.gz YWIKOOFYHFYNHV-GFCCVEGCSA-N 1 1 322.202 3.737 20 10 DHCDMO CCCc1ncc(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)o1 ZINC000825086692 1030718943 /nfs/dbraw/zinc/71/89/43/1030718943.db2.gz VEILIBMGZYNYFZ-UHFFFAOYSA-N 1 1 319.424 3.902 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC3(CCCC3)[C@@H]2C(C)C)cc1OC ZINC000825337148 1030781033 /nfs/dbraw/zinc/78/10/33/1030781033.db2.gz CVRNWDDFONRHGT-SFHVURJKSA-N 1 1 319.445 3.810 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC(C)=O)cc1)Cc1ccccc1O ZINC000123036782 1030956322 /nfs/dbraw/zinc/95/63/22/1030956322.db2.gz QXHJRZBSTOJOOQ-UHFFFAOYSA-N 1 1 313.397 3.730 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926915213 1030986233 /nfs/dbraw/zinc/98/62/33/1030986233.db2.gz KGWYDGSZBDONMW-PXWWUCIGSA-N 1 1 321.314 3.682 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1OCCc2ccccc21)c1c(O)cccc1F ZINC000927113511 1031096821 /nfs/dbraw/zinc/09/68/21/1031096821.db2.gz ZNTNSOCGJORDLM-UGSOOPFHSA-N 1 1 315.388 3.886 20 10 DHCDMO CC[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1O)c1ccc(F)cc1O ZINC000927138776 1031115149 /nfs/dbraw/zinc/11/51/49/1031115149.db2.gz HBFQTOCOXXNVLB-SCTDSRPQSA-N 1 1 315.388 3.620 20 10 DHCDMO C[N@@H+](Cc1cc(Br)c(F)cc1O)C[C@@H]1CC1(C)C ZINC001144306636 1031454855 /nfs/dbraw/zinc/45/48/55/1031454855.db2.gz KHIMKVUEVVZKRD-JTQLQIEISA-N 1 1 316.214 3.772 20 10 DHCDMO C[N@H+](Cc1cc(Br)c(F)cc1O)C[C@@H]1CC1(C)C ZINC001144306636 1031454862 /nfs/dbraw/zinc/45/48/62/1031454862.db2.gz KHIMKVUEVVZKRD-JTQLQIEISA-N 1 1 316.214 3.772 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CCCC(C)(F)F)CC2)cc1 ZINC000929317025 1031490746 /nfs/dbraw/zinc/49/07/46/1031490746.db2.gz VHBLNXGKAGWFEO-UHFFFAOYSA-N 1 1 312.404 3.643 20 10 DHCDMO C[C@@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000124028097 1031575258 /nfs/dbraw/zinc/57/52/58/1031575258.db2.gz XIULBBBTWFJDNT-CQSZACIVSA-N 1 1 303.494 3.712 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](C(F)F)CC2)cc1C(C)C ZINC000872679341 1031642525 /nfs/dbraw/zinc/64/25/25/1031642525.db2.gz WESCLNABJDWIJD-INIZCTEOSA-N 1 1 313.388 3.680 20 10 DHCDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144516429 1031674586 /nfs/dbraw/zinc/67/45/86/1031674586.db2.gz YERTWPOUQMYXCF-JTQLQIEISA-N 1 1 307.777 3.650 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000873052757 1031697877 /nfs/dbraw/zinc/69/78/77/1031697877.db2.gz VXQBYIQVQPKKLT-UHFFFAOYSA-N 1 1 313.376 3.631 20 10 DHCDMO CN(C)c1ccc(/C=C\C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000873165898 1031733042 /nfs/dbraw/zinc/73/30/42/1031733042.db2.gz ZFBUNWMRVAMLOH-ARJAWSKDSA-N 1 1 307.850 3.666 20 10 DHCDMO CC1(C)CCc2onc(C[NH2+]Cc3cc(Cl)ccc3O)c2C1 ZINC000873175009 1031738917 /nfs/dbraw/zinc/73/89/17/1031738917.db2.gz CZDAJZDXHJXJAN-UHFFFAOYSA-N 1 1 320.820 3.838 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)cc1 ZINC000873175479 1031740844 /nfs/dbraw/zinc/74/08/44/1031740844.db2.gz KFZVDIZWDRHUCA-UHFFFAOYSA-N 1 1 313.445 3.545 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc2ccccc2c1[O-] ZINC000873245630 1031772736 /nfs/dbraw/zinc/77/27/36/1031772736.db2.gz SKNQIWARLSMGDJ-HOCLYGCPSA-N 1 1 312.457 3.974 20 10 DHCDMO C[C@@]12CC[N@H+](Cc3cc(Cl)c(F)cc3O)C[C@@H]1C2(F)F ZINC000294085477 1031790041 /nfs/dbraw/zinc/79/00/41/1031790041.db2.gz ZDYDFRMQIDTAQY-QWHCGFSZSA-N 1 1 305.727 3.662 20 10 DHCDMO C[C@@]12CC[N@@H+](Cc3cc(Cl)c(F)cc3O)C[C@@H]1C2(F)F ZINC000294085477 1031790054 /nfs/dbraw/zinc/79/00/54/1031790054.db2.gz ZDYDFRMQIDTAQY-QWHCGFSZSA-N 1 1 305.727 3.662 20 10 DHCDMO COc1cccc([C@@H](C)NCCC[NH+](C(C)C)C(C)C)c1O ZINC000846149131 1031882875 /nfs/dbraw/zinc/88/28/75/1031882875.db2.gz WFOBTALPJXKLRI-OAHLLOKOSA-N 1 1 308.466 3.560 20 10 DHCDMO CC[C@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccc(F)cc1O ZINC000846188887 1031921500 /nfs/dbraw/zinc/92/15/00/1031921500.db2.gz QSJHFCPTSIASQC-FUHWJXTLSA-N 1 1 307.409 3.777 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)[C@](C)(O)c1ccccc1)c1ccc(F)cc1O ZINC000846189342 1031924010 /nfs/dbraw/zinc/92/40/10/1031924010.db2.gz TVGUCFKLJHPZBV-FMEYXAORSA-N 1 1 317.404 3.868 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000846699571 1032043688 /nfs/dbraw/zinc/04/36/88/1032043688.db2.gz UTTGPDBGQXHJNO-AEFFLSMTSA-N 1 1 303.494 3.625 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)cc2O)o1 ZINC000877395894 1033295108 /nfs/dbraw/zinc/29/51/08/1033295108.db2.gz OYQYHLHUSNVBPM-INIZCTEOSA-N 1 1 301.386 3.777 20 10 DHCDMO Cc1cccc(O)c1C[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000877470816 1033311467 /nfs/dbraw/zinc/31/14/67/1033311467.db2.gz NERRILJZHLQOOR-AWEZNQCLSA-N 1 1 323.396 3.525 20 10 DHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1(C)C ZINC000877548682 1033349178 /nfs/dbraw/zinc/34/91/78/1033349178.db2.gz QXEJSEZVDGRQLN-LJQANCHMSA-N 1 1 316.489 3.514 20 10 DHCDMO Cn1cc(C[N@@H+]2Cc3cccc(O)c3C2)c(C2CCCCC2)n1 ZINC000877703154 1033418456 /nfs/dbraw/zinc/41/84/56/1033418456.db2.gz TXYPICUZSCQRTL-UHFFFAOYSA-N 1 1 311.429 3.689 20 10 DHCDMO Cn1cc(C[N@H+]2Cc3cccc(O)c3C2)c(C2CCCCC2)n1 ZINC000877703154 1033418464 /nfs/dbraw/zinc/41/84/64/1033418464.db2.gz TXYPICUZSCQRTL-UHFFFAOYSA-N 1 1 311.429 3.689 20 10 DHCDMO COc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)cc1OC(F)F ZINC000877703312 1033418612 /nfs/dbraw/zinc/41/86/12/1033418612.db2.gz AUFGKQJFQFLEOA-UHFFFAOYSA-N 1 1 321.323 3.518 20 10 DHCDMO COc1ccc(C[N@H+]2Cc3cccc(O)c3C2)cc1OC(F)F ZINC000877703312 1033418618 /nfs/dbraw/zinc/41/86/18/1033418618.db2.gz AUFGKQJFQFLEOA-UHFFFAOYSA-N 1 1 321.323 3.518 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)c(O)c1 ZINC000877812473 1033462101 /nfs/dbraw/zinc/46/21/01/1033462101.db2.gz ARLGEQOQSRBTOM-AWEZNQCLSA-N 1 1 318.442 3.545 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](c3nc(C)cs3)C2)c1O ZINC000877814407 1033466120 /nfs/dbraw/zinc/46/61/20/1033466120.db2.gz YKDNKEKNWJEWPY-CQSZACIVSA-N 1 1 318.442 3.545 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CC[C@@H](C(F)(F)F)O1 ZINC000877823521 1033473879 /nfs/dbraw/zinc/47/38/79/1033473879.db2.gz MCKZFXXIVOMUBJ-RNCFNFMXSA-N 1 1 323.742 3.587 20 10 DHCDMO CCC[N@@H+](CC(=O)c1ccccc1F)Cc1ccccc1O ZINC000878151389 1033598164 /nfs/dbraw/zinc/59/81/64/1033598164.db2.gz QAWAXBUNERCPNF-UHFFFAOYSA-N 1 1 301.361 3.626 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1F ZINC000862213290 1033780197 /nfs/dbraw/zinc/78/01/97/1033780197.db2.gz WQWFFLSAQOHQED-INIZCTEOSA-N 1 1 305.372 3.696 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1F ZINC000862213290 1033780214 /nfs/dbraw/zinc/78/02/14/1033780214.db2.gz WQWFFLSAQOHQED-INIZCTEOSA-N 1 1 305.372 3.696 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+]3CCC=C(Cl)C3)cc2)CC1 ZINC000878790872 1033828118 /nfs/dbraw/zinc/82/81/18/1033828118.db2.gz XANDFXSPLIPLNE-UHFFFAOYSA-N 1 1 320.864 3.630 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC=C(Cl)C3)cc2)CC1 ZINC000878790872 1033828125 /nfs/dbraw/zinc/82/81/25/1033828125.db2.gz XANDFXSPLIPLNE-UHFFFAOYSA-N 1 1 320.864 3.630 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c1 ZINC000862476023 1033861749 /nfs/dbraw/zinc/86/17/49/1033861749.db2.gz FKTLCVZLANMLCE-HNAYVOBHSA-N 1 1 316.489 3.833 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862482564 1033867120 /nfs/dbraw/zinc/86/71/20/1033867120.db2.gz JVOGUKHSVKBPFG-SFHVURJKSA-N 1 1 317.816 3.529 20 10 DHCDMO CCc1ccc(-c2noc(C[NH2+][C@H](C)c3ccccc3O)n2)cc1 ZINC000879647880 1034070517 /nfs/dbraw/zinc/07/05/17/1034070517.db2.gz PAMKQJBVUQOMER-CYBMUJFWSA-N 1 1 323.396 3.855 20 10 DHCDMO Oc1cccc(Br)c1Nc1cc[nH+]c2ccccc12 ZINC001174038896 1034095830 /nfs/dbraw/zinc/09/58/30/1034095830.db2.gz RSWGTPXLMCBIQI-UHFFFAOYSA-N 1 1 315.170 3.868 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCOCC3)[C@H]2C(C)C)cc1Cl ZINC000826122058 1034119614 /nfs/dbraw/zinc/11/96/14/1034119614.db2.gz XJHPNZFQCOMCOT-QGZVFWFLSA-N 1 1 323.864 3.991 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000826120465 1034119670 /nfs/dbraw/zinc/11/96/70/1034119670.db2.gz DQFDUNOOXGACKG-DOTOQJQBSA-N 1 1 317.816 3.662 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[C@H](C)[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000863547998 1034127099 /nfs/dbraw/zinc/12/70/99/1034127099.db2.gz SZDVOEKJWHVARL-KWBADKCTSA-N 1 1 317.260 3.880 20 10 DHCDMO CC(C)C[NH+]1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000177836057 1034185485 /nfs/dbraw/zinc/18/54/85/1034185485.db2.gz TYFSHRSADTUUHA-INIZCTEOSA-N 1 1 303.494 3.524 20 10 DHCDMO CC(C)CN1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000177836057 1034185491 /nfs/dbraw/zinc/18/54/91/1034185491.db2.gz TYFSHRSADTUUHA-INIZCTEOSA-N 1 1 303.494 3.524 20 10 DHCDMO CC[N@@H+](Cc1[nH]nc2c1cccc2C)Cc1ccc(N(C)C)cc1 ZINC001137150771 1034275251 /nfs/dbraw/zinc/27/52/51/1034275251.db2.gz VZYGJAUBWBJTBD-UHFFFAOYSA-N 1 1 322.456 3.959 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](c3nccs3)C2)ccc1N(C)C ZINC000880320871 1034296774 /nfs/dbraw/zinc/29/67/74/1034296774.db2.gz IJLGOAFFLJTKOV-OAHLLOKOSA-N 1 1 301.459 3.507 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@@H](C3CC3)C2)cc1C(C)C ZINC000794647376 1034313184 /nfs/dbraw/zinc/31/31/84/1034313184.db2.gz OYXFFVMKRZQSAW-AUUYWEPGSA-N 1 1 303.446 3.823 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2O)cc1OC ZINC000179555403 1034315127 /nfs/dbraw/zinc/31/51/27/1034315127.db2.gz KYZCNFCYKASZQD-MRXNPFEDSA-N 1 1 313.397 3.747 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1ccnn1C)Cc1ccccc1O ZINC000179642117 1034321846 /nfs/dbraw/zinc/32/18/46/1034321846.db2.gz PNKCMGCTWWRZAQ-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2cccnc2)c1O ZINC000184745010 1034499260 /nfs/dbraw/zinc/49/92/60/1034499260.db2.gz MPNCOCLQVYEHEL-LLVKDONJSA-N 1 1 306.793 3.642 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2[O-])c1 ZINC000185352346 1034542880 /nfs/dbraw/zinc/54/28/80/1034542880.db2.gz XJQLPNCVUYJQIN-AWEZNQCLSA-N 1 1 316.420 3.834 20 10 DHCDMO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185737660 1034570915 /nfs/dbraw/zinc/57/09/15/1034570915.db2.gz RETCEYUXWAIXCX-OFQRWUPVSA-N 1 1 317.404 3.737 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@@]23CCCOC3)cc1 ZINC001177008671 1035342633 /nfs/dbraw/zinc/34/26/33/1035342633.db2.gz NCDJPTRCRBJSNP-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(N(C)CC)cc2)CC1 ZINC000773755437 1035438094 /nfs/dbraw/zinc/43/80/94/1035438094.db2.gz JITFUSTVMROHCY-IBGZPJMESA-N 1 1 304.478 3.924 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CC)CCc2nccs2)cc1 ZINC000773803275 1035467863 /nfs/dbraw/zinc/46/78/63/1035467863.db2.gz XTRATDBIVQTXDW-UHFFFAOYSA-N 1 1 303.475 3.664 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)cc1 ZINC000773822823 1035494610 /nfs/dbraw/zinc/49/46/10/1035494610.db2.gz SKTAHQHTJRAREU-GOSISDBHSA-N 1 1 312.461 3.820 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1 ZINC000773825194 1035498574 /nfs/dbraw/zinc/49/85/74/1035498574.db2.gz WVZXDAQJZAVDIN-RTBURBONSA-N 1 1 316.489 3.781 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1 ZINC000773825173 1035498891 /nfs/dbraw/zinc/49/88/91/1035498891.db2.gz WVZXDAQJZAVDIN-RBUKOAKNSA-N 1 1 316.489 3.781 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042934 1035571295 /nfs/dbraw/zinc/57/12/95/1035571295.db2.gz MLJGNIROTSASLE-ZENOOKHLSA-N 1 1 324.415 3.508 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042934 1035571308 /nfs/dbraw/zinc/57/13/08/1035571308.db2.gz MLJGNIROTSASLE-ZENOOKHLSA-N 1 1 324.415 3.508 20 10 DHCDMO Cn1nccc1[C@@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000905742426 1035638898 /nfs/dbraw/zinc/63/88/98/1035638898.db2.gz QIQQWOIEVUDUQY-SFHVURJKSA-N 1 1 307.397 3.616 20 10 DHCDMO C[N@@H+](Cc1ccc(Br)cc1O)C[C@H]1CC=CCC1 ZINC001180311263 1035641670 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C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207486 1036229883 /nfs/dbraw/zinc/22/98/83/1036229883.db2.gz VUYBQELILONETQ-GARJFASQSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207486 1036229898 /nfs/dbraw/zinc/22/98/98/1036229898.db2.gz VUYBQELILONETQ-GARJFASQSA-N 1 1 317.260 3.832 20 10 DHCDMO CCC[C@@](C)(O)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774185958 1036236096 /nfs/dbraw/zinc/23/60/96/1036236096.db2.gz WKAZYQINFDHPAU-YMTOWFKASA-N 1 1 306.233 3.901 20 10 DHCDMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775654535 1036248642 /nfs/dbraw/zinc/24/86/42/1036248642.db2.gz LJIIRWFYGAMPEU-HNNXBMFYSA-N 1 1 303.427 3.972 20 10 DHCDMO C[C@@H]([NH2+]CC1(CCO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774372185 1036304835 /nfs/dbraw/zinc/30/48/35/1036304835.db2.gz WEEPKJZDTXBJIZ-SECBINFHSA-N 1 1 304.217 3.512 20 10 DHCDMO Cc1cc(O)c(C[N@H+](CCc2nccs2)C(C)C)cc1C ZINC000151565219 1036340249 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COc1ccc(O)c(C[N@H+]2CC[C@H](Cc3ccccc3)[C@@H]2C)c1 ZINC000775724569 1036566462 /nfs/dbraw/zinc/56/64/62/1036566462.db2.gz MBWNZPSZVFSXEB-DOTOQJQBSA-N 1 1 311.425 3.854 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC001183696090 1036651323 /nfs/dbraw/zinc/65/13/23/1036651323.db2.gz JEXVKVCKJSUQTD-INIZCTEOSA-N 1 1 318.505 3.762 20 10 DHCDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccc(O)c(O)c1 ZINC001203878559 1036782195 /nfs/dbraw/zinc/78/21/95/1036782195.db2.gz CFDNWWMXERWTCD-UHFFFAOYSA-N 1 1 311.303 3.749 20 10 DHCDMO CCc1cccc(C[N@@H+](C)Cc2cc(-c3ccccc3)n[nH]2)c1O ZINC001184238468 1036785179 /nfs/dbraw/zinc/78/51/79/1036785179.db2.gz CPZPKTFAHLSPSY-UHFFFAOYSA-N 1 1 321.424 3.977 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776014248 1037300097 /nfs/dbraw/zinc/30/00/97/1037300097.db2.gz QQNQWGWHDSWUSP-GWCFXTLKSA-N 1 1 303.324 3.564 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000776012124 1037304651 /nfs/dbraw/zinc/30/46/51/1037304651.db2.gz CZCFQLNVGUGONW-BXUZGUMPSA-N 1 1 317.351 3.954 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775012021 1037384325 /nfs/dbraw/zinc/38/43/25/1037384325.db2.gz OURVQGBHROKICF-CHWSQXEVSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775020563 1037424776 /nfs/dbraw/zinc/42/47/76/1037424776.db2.gz JSCHTLOTQWEVCP-QWHCGFSZSA-N 1 1 322.405 3.615 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001203658387 1037617377 /nfs/dbraw/zinc/61/73/77/1037617377.db2.gz SYEOZRHGGVURBK-CYBMUJFWSA-N 1 1 302.805 3.820 20 10 DHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC001201418941 1037658846 /nfs/dbraw/zinc/65/88/46/1037658846.db2.gz TWWFNNXCBAOGKJ-OAHLLOKOSA-N 1 1 310.441 3.901 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccsc2)c1 ZINC000800985080 1037994836 /nfs/dbraw/zinc/99/48/36/1037994836.db2.gz LJFXRZNCCOICQL-MNOVXSKESA-N 1 1 305.399 3.652 20 10 DHCDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cc(OCC)ccc1O ZINC000775206180 1038011351 /nfs/dbraw/zinc/01/13/51/1038011351.db2.gz VYDDZPVNGQOKHH-SFHVURJKSA-N 1 1 307.434 3.572 20 10 DHCDMO COc1ccc(N2CCC[N@H+]([C@H](C)c3ccccc3)CC2)cc1 ZINC000917089734 1038186594 /nfs/dbraw/zinc/18/65/94/1038186594.db2.gz JFBAAWZOSLFKOV-QGZVFWFLSA-N 1 1 310.441 3.969 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000164488684 1038202922 /nfs/dbraw/zinc/20/29/22/1038202922.db2.gz LMCVEGBZAJMZBO-INIZCTEOSA-N 1 1 303.427 3.644 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCCC[C@H]1O ZINC001190436886 1038316375 /nfs/dbraw/zinc/31/63/75/1038316375.db2.gz NIQOAEUWZRVWCP-IEBWSBKVSA-N 1 1 304.478 3.514 20 10 DHCDMO C[N@@H+](CCc1nccs1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000157138339 1038514202 /nfs/dbraw/zinc/51/42/02/1038514202.db2.gz QZSQYDJNTGTKCZ-UHFFFAOYSA-N 1 1 320.458 3.526 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]CC2(CN(C)C)CCCC2)c2c1c(F)ccc2O ZINC000760896583 1039032665 /nfs/dbraw/zinc/03/26/65/1039032665.db2.gz HGAOYXZFZVQWJS-ZFWWWQNUSA-N 1 1 320.452 3.791 20 10 DHCDMO CC(=O)c1cc(F)cc(C[NH2+]C(C)(C)c2nc(C)cs2)c1O ZINC000079437234 185171390 /nfs/dbraw/zinc/17/13/90/185171390.db2.gz RWLNJLKJVMJKHB-UHFFFAOYSA-N 1 1 322.405 3.524 20 10 DHCDMO COc1cccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000091901777 193124565 /nfs/dbraw/zinc/12/45/65/193124565.db2.gz CLIJMSQYPSVUML-UHFFFAOYSA-N 1 1 303.324 3.565 20 10 DHCDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000092223780 193176208 /nfs/dbraw/zinc/17/62/08/193176208.db2.gz PYFDGRWIGYGCLD-KRWDZBQOSA-N 1 1 316.376 3.712 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)c1O ZINC000093275461 193224081 /nfs/dbraw/zinc/22/40/81/193224081.db2.gz HLMUOKKSPWRYDT-LLVKDONJSA-N 1 1 306.431 3.667 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N(C)C)c(F)c1)c1nccs1 ZINC000273191792 130096517 /nfs/dbraw/zinc/09/65/17/130096517.db2.gz PWAYZVONWIQWRW-GFCCVEGCSA-N 1 1 307.438 3.584 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000273414837 130118420 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C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c2nccn21 ZINC000297908965 132039995 /nfs/dbraw/zinc/03/99/95/132039995.db2.gz WMPFUBOBCBXADM-APWZRJJASA-N 1 1 324.472 3.915 20 10 DHCDMO C[C@H](NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)ccc1O ZINC000185634791 333211143 /nfs/dbraw/zinc/21/11/43/333211143.db2.gz PREBVPKUVJCONV-AWEZNQCLSA-N 1 1 320.452 3.979 20 10 DHCDMO C[C@H](CCCCO)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296281557 335143150 /nfs/dbraw/zinc/14/31/50/335143150.db2.gz FAOJDBGCKCJFAO-NXEZZACHSA-N 1 1 306.233 3.901 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccc(F)cc1O ZINC000286207560 334151774 /nfs/dbraw/zinc/15/17/74/334151774.db2.gz RWPTZLULYMKNFJ-HWPZZCPQSA-N 1 1 306.381 3.808 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000375255468 337006720 /nfs/dbraw/zinc/00/67/20/337006720.db2.gz GNAJJCICETUFCD-WBVHZDCISA-N 1 1 313.445 3.532 20 10 DHCDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000378631566 337077050 /nfs/dbraw/zinc/07/70/50/337077050.db2.gz JKOCPMOGUKXISX-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccccc1O)CCC2 ZINC000179582101 337170271 /nfs/dbraw/zinc/17/02/71/337170271.db2.gz UDRAOQMHYITYAP-CQSZACIVSA-N 1 1 302.443 3.921 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nccnc2C)cc1F ZINC000187989865 520910311 /nfs/dbraw/zinc/91/03/11/520910311.db2.gz KPUWJIDPHJHYJJ-AWEZNQCLSA-N 1 1 316.424 3.621 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)c1O ZINC000160626628 525915189 /nfs/dbraw/zinc/91/51/89/525915189.db2.gz JFLWCQLVGPDIST-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000365664656 526347618 /nfs/dbraw/zinc/34/76/18/526347618.db2.gz WJJFBCCQXBZUJX-CVEARBPZSA-N 1 1 307.821 3.579 20 10 DHCDMO Cc1nccn1CCC[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000162840407 527410902 /nfs/dbraw/zinc/41/09/02/527410902.db2.gz CRUIGJZZZZDWRD-UHFFFAOYSA-N 1 1 309.413 3.572 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1[O-] ZINC000286136921 535911878 /nfs/dbraw/zinc/91/18/78/535911878.db2.gz OUIMVYOLLVCSRO-PBHICJAKSA-N 1 1 308.441 3.692 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000894431162 1013359466 /nfs/dbraw/zinc/35/94/66/1013359466.db2.gz NQJONHXJOVQTBP-YPMHNXCESA-N 1 1 317.351 3.872 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCO1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001167982267 1013477526 /nfs/dbraw/zinc/47/75/26/1013477526.db2.gz BGEGIRPZRVAIFY-FPAYPSAMSA-N 1 1 315.457 3.809 20 10 DHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(C)cc(OC)c1O ZINC000894783889 1013489584 /nfs/dbraw/zinc/48/95/84/1013489584.db2.gz ZKFFOJXFRFNEBF-MRXNPFEDSA-N 1 1 300.402 3.687 20 10 DHCDMO [O-]c1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895581149 1015217649 /nfs/dbraw/zinc/21/76/49/1015217649.db2.gz LUNITFVKGBREQU-VIFPVBQESA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895581149 1015217654 /nfs/dbraw/zinc/21/76/54/1015217654.db2.gz LUNITFVKGBREQU-VIFPVBQESA-N 1 1 312.797 3.631 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895581149 1015217659 /nfs/dbraw/zinc/21/76/59/1015217659.db2.gz LUNITFVKGBREQU-VIFPVBQESA-N 1 1 312.797 3.631 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(F)c(F)cc1OC ZINC001143400654 1015411850 /nfs/dbraw/zinc/41/18/50/1015411850.db2.gz YVUIPUQFXPNQCO-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896224882 1015510640 /nfs/dbraw/zinc/51/06/40/1015510640.db2.gz PUGUYICSPHQWOD-ZDUSSCGKSA-N 1 1 303.299 3.567 20 10 DHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)[nH]1 ZINC000276847996 1015711078 /nfs/dbraw/zinc/71/10/78/1015711078.db2.gz CUVUMDKSJRKLQV-IHRRRGAJSA-N 1 1 315.465 3.796 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087489 1016323469 /nfs/dbraw/zinc/32/34/69/1016323469.db2.gz KRVCDDOOMYTJJU-ZWKOTPCHSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183714985 1016329184 /nfs/dbraw/zinc/32/91/84/1016329184.db2.gz SWAXYAKWXZUVPY-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO COc1ccc(OCCC[NH2+][C@H](C)c2ccc(F)cc2O)cc1 ZINC000185127159 1016598258 /nfs/dbraw/zinc/59/82/58/1016598258.db2.gz WPJQMHAIVNROKB-CYBMUJFWSA-N 1 1 319.376 3.660 20 10 DHCDMO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000185227933 1016769882 /nfs/dbraw/zinc/76/98/82/1016769882.db2.gz LAJGYRSYKBLWLK-CZUORRHYSA-N 1 1 320.408 3.858 20 10 DHCDMO CSc1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)s1 ZINC001142029184 1017307398 /nfs/dbraw/zinc/30/73/98/1017307398.db2.gz PHFJNJFLOSFCIB-UHFFFAOYSA-N 1 1 321.467 3.830 20 10 DHCDMO CSc1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)s1 ZINC001142029184 1017307406 /nfs/dbraw/zinc/30/74/06/1017307406.db2.gz PHFJNJFLOSFCIB-UHFFFAOYSA-N 1 1 321.467 3.830 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c1O ZINC000093453354 1032539310 /nfs/dbraw/zinc/53/93/10/1032539310.db2.gz SMLJZPDSONCXSD-KRWDZBQOSA-N 1 1 312.413 3.831 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171382778 1032557515 /nfs/dbraw/zinc/55/75/15/1032557515.db2.gz DYMSXDUEMIYBQN-OAHLLOKOSA-N 1 1 303.352 3.660 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCO[C@@H](c3ccccc3)C1)CCC2 ZINC000729851305 1032599754 /nfs/dbraw/zinc/59/97/54/1032599754.db2.gz JRBIACMIKOUOCM-OAQYLSRUSA-N 1 1 323.436 3.845 20 10 DHCDMO C[N@H+](Cc1ccsc1)Cc1cccc(Br)c1O ZINC000120475848 1012588513 /nfs/dbraw/zinc/58/85/13/1012588513.db2.gz HNZVRCIBXNYDML-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[N@@H+](Cc1ccsc1)Cc1cccc(Br)c1O ZINC000120475848 1012588532 /nfs/dbraw/zinc/58/85/32/1012588532.db2.gz HNZVRCIBXNYDML-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO Cc1cc(NCc2ccc(N3CCC(C)CC3)cc2)nc(C)[nH+]1 ZINC000301200968 1017245366 /nfs/dbraw/zinc/24/53/66/1017245366.db2.gz MIFATOIBLUTABZ-UHFFFAOYSA-N 1 1 310.445 3.942 20 10 DHCDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n[nH]1 ZINC000186131225 1017873759 /nfs/dbraw/zinc/87/37/59/1017873759.db2.gz XZFFJDCSJUVHCI-OCCSQVGLSA-N 1 1 313.445 3.584 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000021963004 1018015134 /nfs/dbraw/zinc/01/51/34/1018015134.db2.gz VHVBIYUBOXPICR-UHFFFAOYSA-N 1 1 308.381 3.581 20 10 DHCDMO COc1cc(C[N@@H+](C)[C@H]2CCSC2)c(O)c(C(C)(C)C)c1 ZINC000125161320 1032738801 /nfs/dbraw/zinc/73/88/01/1032738801.db2.gz UJSUWGTVPRMOEK-ZDUSSCGKSA-N 1 1 309.475 3.636 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc1C ZINC000728559206 1018264334 /nfs/dbraw/zinc/26/43/34/1018264334.db2.gz COIMPSFNJBAPNX-UHFFFAOYSA-N 1 1 311.425 3.830 20 10 DHCDMO C[C@H]1OCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)[C@H]1C ZINC000765099786 1018475690 /nfs/dbraw/zinc/47/56/90/1018475690.db2.gz KEWGZLSTKRQTLS-QWHCGFSZSA-N 1 1 311.381 3.901 20 10 DHCDMO C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000705967492 1018689210 /nfs/dbraw/zinc/68/92/10/1018689210.db2.gz MRWBAXFKTNPETK-NSHDSACASA-N 1 1 317.260 3.521 20 10 DHCDMO C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765450957 1018790697 /nfs/dbraw/zinc/79/06/97/1018790697.db2.gz SMRUGJXDKBDXGG-CVEARBPZSA-N 1 1 321.484 3.807 20 10 DHCDMO C[C@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765450957 1018790711 /nfs/dbraw/zinc/79/07/11/1018790711.db2.gz SMRUGJXDKBDXGG-CVEARBPZSA-N 1 1 321.484 3.807 20 10 DHCDMO CC(C)[N@H+](C)CCN[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765625339 1019013307 /nfs/dbraw/zinc/01/33/07/1019013307.db2.gz XHIGNICDKUQGFR-MRXNPFEDSA-N 1 1 321.484 3.807 20 10 DHCDMO CC(C)[N@@H+](C)CCN[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765625339 1019013334 /nfs/dbraw/zinc/01/33/34/1019013334.db2.gz XHIGNICDKUQGFR-MRXNPFEDSA-N 1 1 321.484 3.807 20 10 DHCDMO Cc1nc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)nc2ccccc12 ZINC000765636486 1019024031 /nfs/dbraw/zinc/02/40/31/1019024031.db2.gz XEPVUNTYUPBUFN-CQSZACIVSA-N 1 1 320.440 3.855 20 10 DHCDMO COc1cc(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825773974 1032809097 /nfs/dbraw/zinc/80/90/97/1032809097.db2.gz SAMWFIXAMVOXDW-ZFWWWQNUSA-N 1 1 321.461 3.698 20 10 DHCDMO CC[C@H]1CCCC[N@@H+]1CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765962610 1019194012 /nfs/dbraw/zinc/19/40/12/1019194012.db2.gz ULXFBRCWCUDSEG-WMZOPIPTSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765962610 1019194016 /nfs/dbraw/zinc/19/40/16/1019194016.db2.gz ULXFBRCWCUDSEG-WMZOPIPTSA-N 1 1 303.494 3.668 20 10 DHCDMO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000170788996 1019434801 /nfs/dbraw/zinc/43/48/01/1019434801.db2.gz CIGJMMMTVDFEIM-LBPRGKRZSA-N 1 1 313.376 3.540 20 10 DHCDMO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000170788999 1019435160 /nfs/dbraw/zinc/43/51/60/1019435160.db2.gz CIGJMMMTVDFEIM-GFCCVEGCSA-N 1 1 313.376 3.540 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H](C)C1 ZINC000282222723 1019697798 /nfs/dbraw/zinc/69/77/98/1019697798.db2.gz IBXQLRBZXXBETG-LPHOPBHVSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1C ZINC000922519854 1020112890 /nfs/dbraw/zinc/11/28/90/1020112890.db2.gz HOECCEGLSRGQJF-CRAIPNDOSA-N 1 1 301.361 3.570 20 10 DHCDMO CC[C@H]1CCC[N@H+](C(C)(C)CNCc2ccc3c(c2)CCO3)C1 ZINC000732229777 1020215132 /nfs/dbraw/zinc/21/51/32/1020215132.db2.gz GGDIPLHJRRPOIU-INIZCTEOSA-N 1 1 316.489 3.612 20 10 DHCDMO CC[C@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000732229777 1020215148 /nfs/dbraw/zinc/21/51/48/1020215148.db2.gz GGDIPLHJRRPOIU-INIZCTEOSA-N 1 1 316.489 3.612 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC000179583572 1020412898 /nfs/dbraw/zinc/41/28/98/1020412898.db2.gz PUFATYFXCJPSOF-AWEZNQCLSA-N 1 1 303.789 3.699 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490327 1032916737 /nfs/dbraw/zinc/91/67/37/1032916737.db2.gz GFWNYCYCWRQUJS-JKSUJKDBSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490327 1032916746 /nfs/dbraw/zinc/91/67/46/1032916746.db2.gz GFWNYCYCWRQUJS-JKSUJKDBSA-N 1 1 312.457 3.928 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1C(C)C ZINC000739875419 1020919523 /nfs/dbraw/zinc/91/95/23/1020919523.db2.gz JNZFEVWMIDPUFB-KRWDZBQOSA-N 1 1 316.489 3.742 20 10 DHCDMO CCN(CC)c1ccc(CNC[C@@H](C)[NH+]2CCCCC2)cc1F ZINC000740004249 1020923240 /nfs/dbraw/zinc/92/32/40/1020923240.db2.gz LSQWCVKNTDZKLH-MRXNPFEDSA-N 1 1 321.484 3.636 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1O ZINC000278802254 1021017085 /nfs/dbraw/zinc/01/70/85/1021017085.db2.gz OQMKRWXXMVWNAU-SNVBAGLBSA-N 1 1 319.298 3.508 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@]1(C)O ZINC001236793727 1021275772 /nfs/dbraw/zinc/27/57/72/1021275772.db2.gz OIMCQURBQYMEJZ-BMIGLBTASA-N 1 1 318.244 3.682 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@]1(C)O ZINC001236793727 1021275777 /nfs/dbraw/zinc/27/57/77/1021275777.db2.gz OIMCQURBQYMEJZ-BMIGLBTASA-N 1 1 318.244 3.682 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@](C)(F)CC2)c(Cl)c1 ZINC001236798390 1021278845 /nfs/dbraw/zinc/27/88/45/1021278845.db2.gz NVEALLCAROJCCD-OAHLLOKOSA-N 1 1 301.789 3.768 20 10 DHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000743398410 1021284891 /nfs/dbraw/zinc/28/48/91/1021284891.db2.gz HQSIXNKDUFTFNN-IAGOWNOFSA-N 1 1 305.487 3.987 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@H](N(C)Cc3ccccc3)C2)cc1C ZINC000743377273 1021285115 /nfs/dbraw/zinc/28/51/15/1021285115.db2.gz PNUORPVEARVQRH-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@H]([N@H+](C)Cc3ccccc3)C2)cc1C ZINC000743377273 1021285127 /nfs/dbraw/zinc/28/51/27/1021285127.db2.gz PNUORPVEARVQRH-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1C ZINC000743377273 1021285137 /nfs/dbraw/zinc/28/51/37/1021285137.db2.gz PNUORPVEARVQRH-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1nc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)[nH]c1C ZINC000850128677 1021424028 /nfs/dbraw/zinc/42/40/28/1021424028.db2.gz HACPMVLOBVBSQD-UHFFFAOYSA-N 1 1 312.461 3.553 20 10 DHCDMO COc1cccc(OC)c1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000850355018 1021483569 /nfs/dbraw/zinc/48/35/69/1021483569.db2.gz BBEFJVAWRBBJOO-UHFFFAOYSA-N 1 1 321.804 3.661 20 10 DHCDMO Oc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154728804 1021520718 /nfs/dbraw/zinc/52/07/18/1021520718.db2.gz DCCHHGVLDXKILW-UHFFFAOYSA-N 1 1 309.365 3.893 20 10 DHCDMO Oc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000154728804 1021520725 /nfs/dbraw/zinc/52/07/25/1021520725.db2.gz DCCHHGVLDXKILW-UHFFFAOYSA-N 1 1 309.365 3.893 20 10 DHCDMO COC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1cccc(OC)c1 ZINC000850513079 1021569193 /nfs/dbraw/zinc/56/91/93/1021569193.db2.gz DKHUVXIOBSPNDJ-SJKOYZFVSA-N 1 1 319.376 3.578 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000850522125 1021574576 /nfs/dbraw/zinc/57/45/76/1021574576.db2.gz DDUGFNMZLHSDMH-CQSZACIVSA-N 1 1 313.397 3.646 20 10 DHCDMO COCc1csc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)c1 ZINC000850531420 1021584913 /nfs/dbraw/zinc/58/49/13/1021584913.db2.gz DOOQHDCGJISUIV-SECBINFHSA-N 1 1 313.369 3.729 20 10 DHCDMO Cc1ccc(O)c([C@H](C)N[C@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC000850538568 1021591700 /nfs/dbraw/zinc/59/17/00/1021591700.db2.gz IBQHCBHLEAAMGO-HOTGVXAUSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc(O)c([C@H](C)N[C@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC000850538568 1021591704 /nfs/dbraw/zinc/59/17/04/1021591704.db2.gz IBQHCBHLEAAMGO-HOTGVXAUSA-N 1 1 302.462 3.758 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(F)cc1O ZINC000850541908 1021596434 /nfs/dbraw/zinc/59/64/34/1021596434.db2.gz DNFGJNKQXOCYCK-IRXDYDNUSA-N 1 1 301.361 3.965 20 10 DHCDMO CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000850554355 1021600735 /nfs/dbraw/zinc/60/07/35/1021600735.db2.gz JCKJGFZKXHXASW-AGRHKRQWSA-N 1 1 317.404 3.940 20 10 DHCDMO CO[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237085076 1021669340 /nfs/dbraw/zinc/66/93/40/1021669340.db2.gz UWVMWIZFHVECDJ-JTQLQIEISA-N 1 1 304.217 3.700 20 10 DHCDMO CO[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237085076 1021669343 /nfs/dbraw/zinc/66/93/43/1021669343.db2.gz UWVMWIZFHVECDJ-JTQLQIEISA-N 1 1 304.217 3.700 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)n1 ZINC000745984764 1021819058 /nfs/dbraw/zinc/81/90/58/1021819058.db2.gz ZRDDFSPNXBURNK-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)n1 ZINC000745984764 1021819072 /nfs/dbraw/zinc/81/90/72/1021819072.db2.gz ZRDDFSPNXBURNK-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO CC(C)C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000746062210 1021834281 /nfs/dbraw/zinc/83/42/81/1021834281.db2.gz XDANKYZYCDIDAL-UHFFFAOYSA-N 1 1 313.397 3.779 20 10 DHCDMO CC(C)[N@@H+](CCOCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000919770644 1021890444 /nfs/dbraw/zinc/89/04/44/1021890444.db2.gz ODTRZLRQEBDFKJ-UHFFFAOYSA-N 1 1 318.383 3.542 20 10 DHCDMO COc1cccc(SCC[N@@H+](C)Cc2ccccc2O)c1 ZINC000851841482 1022019214 /nfs/dbraw/zinc/01/92/14/1022019214.db2.gz SYJAZUJSDMIXPP-UHFFFAOYSA-N 1 1 303.427 3.625 20 10 DHCDMO Cc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC000155175882 1022030441 /nfs/dbraw/zinc/03/04/41/1022030441.db2.gz MECLNBSOGDDYHI-UHFFFAOYSA-N 1 1 324.428 3.676 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1O ZINC000179694603 1022076182 /nfs/dbraw/zinc/07/61/82/1022076182.db2.gz XCIRADXIVLWREX-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO C[N@H+](Cc1nc2ccccc2s1)Cc1cc(F)ccc1O ZINC000179889854 1022090225 /nfs/dbraw/zinc/09/02/25/1022090225.db2.gz IOHWKJIKTGNBPD-UHFFFAOYSA-N 1 1 302.374 3.773 20 10 DHCDMO C[N@@H+](Cc1nc2ccccc2s1)Cc1cc(F)ccc1O ZINC000179889854 1022090241 /nfs/dbraw/zinc/09/02/41/1022090241.db2.gz IOHWKJIKTGNBPD-UHFFFAOYSA-N 1 1 302.374 3.773 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)c1O ZINC000763622849 1022189646 /nfs/dbraw/zinc/18/96/46/1022189646.db2.gz QWYZBCAIEZVXNX-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCc1ccccn1)Cc1ccco1 ZINC000111232791 1022253252 /nfs/dbraw/zinc/25/32/52/1022253252.db2.gz 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CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(CC(C)C)CC2)cc1 ZINC000131174825 1024274755 /nfs/dbraw/zinc/27/47/55/1024274755.db2.gz KRSIHOFULKHYNN-QGZVFWFLSA-N 1 1 317.521 3.914 20 10 DHCDMO C[C@H]([NH2+]CCc1ccns1)c1cccc(C(F)(F)F)c1O ZINC000883247307 1024318906 /nfs/dbraw/zinc/31/89/06/1024318906.db2.gz GCDGJEDMGZWSOM-VIFPVBQESA-N 1 1 316.348 3.761 20 10 DHCDMO COc1ccc(C2CC2)cc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000883257145 1024324645 /nfs/dbraw/zinc/32/46/45/1024324645.db2.gz SSASEQQBSSQBHH-UHFFFAOYSA-N 1 1 319.351 3.846 20 10 DHCDMO CC(C)OCC[C@@H](C)[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172451720 1033207883 /nfs/dbraw/zinc/20/78/83/1033207883.db2.gz UMMNTYZJRKZOHH-QGZVFWFLSA-N 1 1 304.478 3.922 20 10 DHCDMO C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790947214 1024402710 /nfs/dbraw/zinc/40/27/10/1024402710.db2.gz MCJRJQNUWSIEHP-LBPRGKRZSA-N 1 1 314.832 3.539 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000790959003 1024405282 /nfs/dbraw/zinc/40/52/82/1024405282.db2.gz SJUWSIKFGHSTLD-INIZCTEOSA-N 1 1 321.779 3.588 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc(OCC4CC4)cc3)ccc21 ZINC000790980766 1024423880 /nfs/dbraw/zinc/42/38/80/1024423880.db2.gz HUYMHLVFJBFOAL-UHFFFAOYSA-N 1 1 307.397 3.974 20 10 DHCDMO Cc1nc2sccn2c1C[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000271177653 1024466556 /nfs/dbraw/zinc/46/65/56/1024466556.db2.gz XJEWSSKSQUELLL-UHFFFAOYSA-N 1 1 315.442 3.659 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@@H]2OCCC[C@H]12)c1cc(Cl)c(Cl)cc1O ZINC000373206288 1024619523 /nfs/dbraw/zinc/61/95/23/1024619523.db2.gz AQPSABRAPIRTSU-OUXRHDKJSA-N 1 1 316.228 3.917 20 10 DHCDMO CC(C)(C)OC1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000792167327 1024641085 /nfs/dbraw/zinc/64/10/85/1024641085.db2.gz NGAYYYAJEJBAGF-UHFFFAOYSA-N 1 1 315.816 3.964 20 10 DHCDMO CCc1ccc2c(C[N@@H+](C)Cc3ccccc3O)cc(=O)oc2c1 ZINC000109769549 1024696474 /nfs/dbraw/zinc/69/64/74/1024696474.db2.gz CTBWJIGTGODFDY-UHFFFAOYSA-N 1 1 323.392 3.693 20 10 DHCDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(O)cc1C ZINC000793575061 1025124873 /nfs/dbraw/zinc/12/48/73/1025124873.db2.gz RTRCYIVURORRJJ-SFHVURJKSA-N 1 1 312.413 3.687 20 10 DHCDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c(O)cc1C ZINC000793575059 1025125107 /nfs/dbraw/zinc/12/51/07/1025125107.db2.gz RTRCYIVURORRJJ-GOSISDBHSA-N 1 1 312.413 3.687 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000793787617 1025164121 /nfs/dbraw/zinc/16/41/21/1025164121.db2.gz DIFAGXMARXHKOP-ZDUSSCGKSA-N 1 1 302.443 3.515 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000793793000 1025165317 /nfs/dbraw/zinc/16/53/17/1025165317.db2.gz QVMGXYQKNAVCCR-ZDUSSCGKSA-N 1 1 323.502 3.970 20 10 DHCDMO Cc1n[nH]c(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1C ZINC000893948057 1025619519 /nfs/dbraw/zinc/61/95/19/1025619519.db2.gz QRNYMYFXDYMYHD-UHFFFAOYSA-N 1 1 300.450 3.503 20 10 DHCDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886491363 1025649424 /nfs/dbraw/zinc/64/94/24/1025649424.db2.gz ASLQXJUNNAGDOS-NEPJUHHUSA-N 1 1 319.376 3.960 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886495213 1025652593 /nfs/dbraw/zinc/65/25/93/1025652593.db2.gz NIECRVKAHZXVFZ-MEBBXXQBSA-N 1 1 309.768 3.569 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1c(O)cccc1F ZINC000886519294 1025670011 /nfs/dbraw/zinc/67/00/11/1025670011.db2.gz RVEFIHJHOCZPNC-GFCCVEGCSA-N 1 1 316.376 3.566 20 10 DHCDMO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886540287 1025687072 /nfs/dbraw/zinc/68/70/72/1025687072.db2.gz CBIDJWMUYOJUEL-NHYWBVRUSA-N 1 1 301.361 3.878 20 10 DHCDMO COc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886547971 1025693209 /nfs/dbraw/zinc/69/32/09/1025693209.db2.gz VLIZJOFZUKLGRF-FZMZJTMJSA-N 1 1 317.360 3.714 20 10 DHCDMO COCC[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccc(C)o1 ZINC000886586069 1025724483 /nfs/dbraw/zinc/72/44/83/1025724483.db2.gz KKAOEMKZIXVPEL-JSGCOSHPSA-N 1 1 307.365 3.861 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1c([O-])cccc1F ZINC000886588729 1025727603 /nfs/dbraw/zinc/72/76/03/1025727603.db2.gz XXONVWGFNGYVCD-SOUVJXGZSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)OCCc2sccc21)c1c(O)cccc1F ZINC000886612148 1025737060 /nfs/dbraw/zinc/73/70/60/1025737060.db2.gz DGINZQIOTIMMMS-APPDUMDISA-N 1 1 321.417 3.732 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000886774909 1025894454 /nfs/dbraw/zinc/89/44/54/1025894454.db2.gz XYWUYOVLNZDXSY-DYVFJYSZSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000808190858 1026223453 /nfs/dbraw/zinc/22/34/53/1026223453.db2.gz KHRUJEJBKZXHMG-HNAYVOBHSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1[C@H]([NH+]2CCCC2)CCN1Cc1c(O)ccc2ccccc21 ZINC000808190858 1026223464 /nfs/dbraw/zinc/22/34/64/1026223464.db2.gz KHRUJEJBKZXHMG-HNAYVOBHSA-N 1 1 310.441 3.604 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCSC(C)C)c1 ZINC000808419753 1026284301 /nfs/dbraw/zinc/28/43/01/1026284301.db2.gz OKRBYSMZEPPVDN-UHFFFAOYSA-N 1 1 318.280 3.694 20 10 DHCDMO COc1cncc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000808728954 1026382095 /nfs/dbraw/zinc/38/20/95/1026382095.db2.gz XDMKMRAEDLYTDY-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO CC(C)Oc1ccc(N(C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809654249 1026582191 /nfs/dbraw/zinc/58/21/91/1026582191.db2.gz WMOIQQXFFCATHH-UHFFFAOYSA-N 1 1 319.474 3.628 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)CC2(F)CC2)cc1 ZINC000809731039 1026597494 /nfs/dbraw/zinc/59/74/94/1026597494.db2.gz ASNPITMYLURPKJ-UHFFFAOYSA-N 1 1 302.393 3.850 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)CC2(F)CC2)cc1 ZINC000809731039 1026597500 /nfs/dbraw/zinc/59/75/00/1026597500.db2.gz ASNPITMYLURPKJ-UHFFFAOYSA-N 1 1 302.393 3.850 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1F ZINC000809758487 1026618126 /nfs/dbraw/zinc/61/81/26/1026618126.db2.gz OGPIRNWUKUIANZ-DOTOQJQBSA-N 1 1 320.452 3.530 20 10 DHCDMO COc1ccc(O)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1 ZINC000809782922 1026623968 /nfs/dbraw/zinc/62/39/68/1026623968.db2.gz KVDZIRFAEMFYHV-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCCn3c(cc4ccccc43)C2)c1 ZINC000809782922 1026623972 /nfs/dbraw/zinc/62/39/72/1026623972.db2.gz KVDZIRFAEMFYHV-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO CC[C@@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccc(F)cc1O ZINC000796856870 1026677647 /nfs/dbraw/zinc/67/76/47/1026677647.db2.gz NJRAPUJSOLCSET-CZUORRHYSA-N 1 1 309.425 3.761 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cocn1)c1ccc(C(F)(F)F)cc1O ZINC000810232027 1026715065 /nfs/dbraw/zinc/71/50/65/1026715065.db2.gz USOIZPGWPHTDMB-GFCCVEGCSA-N 1 1 300.280 3.640 20 10 DHCDMO Cc1cccc2c1OC[C@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)C2 ZINC000810259774 1026720321 /nfs/dbraw/zinc/72/03/21/1026720321.db2.gz SELCVQOAAKVECN-BXUZGUMPSA-N 1 1 319.351 3.633 20 10 DHCDMO Cc1ccc(O)c(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000811508247 1027025547 /nfs/dbraw/zinc/02/55/47/1027025547.db2.gz IFMOTCSSEOHZDD-SFHVURJKSA-N 1 1 308.425 3.685 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cccc(Br)c2O)CCC1(F)F ZINC000811512716 1027028994 /nfs/dbraw/zinc/02/89/94/1027028994.db2.gz QJUQAFKTNYZRMF-SECBINFHSA-N 1 1 320.177 3.632 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cccc(Br)c2O)CCC1(F)F ZINC000811512716 1027028999 /nfs/dbraw/zinc/02/89/99/1027028999.db2.gz QJUQAFKTNYZRMF-SECBINFHSA-N 1 1 320.177 3.632 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cncn1C)Cc1ccccc1O ZINC000272011370 1027201806 /nfs/dbraw/zinc/20/18/06/1027201806.db2.gz JXSAHZIEIBFCPP-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812854099 1027452944 /nfs/dbraw/zinc/45/29/44/1027452944.db2.gz VJUWEMPMEWVSBV-OXJNMPFZSA-N 1 1 312.457 3.697 20 10 DHCDMO C[C@H]1C[C@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000778984775 1027710659 /nfs/dbraw/zinc/71/06/59/1027710659.db2.gz KIECYALTLWMBOT-PKOBYXMFSA-N 1 1 316.489 3.924 20 10 DHCDMO C[C@H]1C[C@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)CCO1 ZINC000778985420 1027717218 /nfs/dbraw/zinc/71/72/18/1027717218.db2.gz SYRAMOQQLSUAKX-JKSUJKDBSA-N 1 1 315.413 3.803 20 10 DHCDMO COCC[N@@H+](Cc1cc(F)ccc1O)[C@@H](C)c1ccccc1 ZINC000778996413 1027735079 /nfs/dbraw/zinc/73/50/79/1027735079.db2.gz OCMDQJIOCVTALD-AWEZNQCLSA-N 1 1 303.377 3.741 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCO[C@@H](C)C1 ZINC000778996879 1027740902 /nfs/dbraw/zinc/74/09/02/1027740902.db2.gz UYTZBWACOZJKDV-WMZOPIPTSA-N 1 1 304.478 3.778 20 10 DHCDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2O)cc(Cl)c1O ZINC000298004883 1027890660 /nfs/dbraw/zinc/89/06/60/1027890660.db2.gz ZXDBYDLLSHVTGF-UHFFFAOYSA-N 1 1 321.804 3.782 20 10 DHCDMO Cc1ccoc1C[N@@H+](C)Cc1cccc(Br)c1O ZINC000814174551 1027910236 /nfs/dbraw/zinc/91/02/36/1027910236.db2.gz GADWNVVZVYDPPT-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1cccc(Br)c1O ZINC000814174551 1027910256 /nfs/dbraw/zinc/91/02/56/1027910256.db2.gz GADWNVVZVYDPPT-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000365509485 1027958290 /nfs/dbraw/zinc/95/82/90/1027958290.db2.gz QJKRWEJDFVNQER-ATZDWAIDSA-N 1 1 311.425 3.791 20 10 DHCDMO COc1cccc([C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)OC)c1 ZINC000527929617 1027989992 /nfs/dbraw/zinc/98/99/92/1027989992.db2.gz STLLUMPTRKSIEF-SGTLLEGYSA-N 1 1 319.376 3.578 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(N2CCCCC2)cc1 ZINC000368001183 1028272838 /nfs/dbraw/zinc/27/28/38/1028272838.db2.gz XGHOLQJLLIIMRL-DOTOQJQBSA-N 1 1 324.472 3.608 20 10 DHCDMO COc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000368329291 1028339826 /nfs/dbraw/zinc/33/98/26/1028339826.db2.gz RYLRGTBPKKCYAC-IAQYHMDHSA-N 1 1 317.360 3.714 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)cc1 ZINC000815117458 1028364777 /nfs/dbraw/zinc/36/47/77/1028364777.db2.gz NITSSIQXFSECEP-VQIMIIECSA-N 1 1 304.478 3.658 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)cc1 ZINC000815120010 1028365919 /nfs/dbraw/zinc/36/59/19/1028365919.db2.gz LZPTYLXJNNBRLU-ZWKOTPCHSA-N 1 1 302.462 3.532 20 10 DHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815095045 1028377123 /nfs/dbraw/zinc/37/71/23/1028377123.db2.gz RBHWNHWDWJLMDB-KRWDZBQOSA-N 1 1 304.478 3.700 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cc1 ZINC000815108917 1028382603 /nfs/dbraw/zinc/38/26/03/1028382603.db2.gz QBFAKQPUXCEHGH-DOMZBBRYSA-N 1 1 300.368 3.915 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)ccc1N(C)C ZINC000815108801 1028383952 /nfs/dbraw/zinc/38/39/52/1028383952.db2.gz ODSZWXMTTRXXQS-JSGCOSHPSA-N 1 1 300.368 3.834 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1nc(C(C)C)no1 ZINC000076074402 1028555264 /nfs/dbraw/zinc/55/52/64/1028555264.db2.gz QRQGMXKIEBCQLT-CYBMUJFWSA-N 1 1 303.406 3.872 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(C(C)C)no1 ZINC000076074402 1028555267 /nfs/dbraw/zinc/55/52/67/1028555267.db2.gz QRQGMXKIEBCQLT-CYBMUJFWSA-N 1 1 303.406 3.872 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCSC1)c1cccc(C(F)(F)F)c1O ZINC000815586104 1028557188 /nfs/dbraw/zinc/55/71/88/1028557188.db2.gz ZITPMQBDOVNKHL-VHSXEESVSA-N 1 1 305.365 3.957 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccncc1)c1cccc(C(F)(F)F)c1O ZINC000815588902 1028559647 /nfs/dbraw/zinc/55/96/47/1028559647.db2.gz CJUDMPYVEMIJOZ-LLVKDONJSA-N 1 1 310.319 3.699 20 10 DHCDMO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815600672 1028565257 /nfs/dbraw/zinc/56/52/57/1028565257.db2.gz AYGZYZSOPFFWGH-JTNHKYCSSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1ccc(N2CCCCC2)cc1 ZINC000370662697 1028631836 /nfs/dbraw/zinc/63/18/36/1028631836.db2.gz NNQFTVAVLZOLIR-MAUKXSAKSA-N 1 1 324.472 3.608 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000748051384 1028768689 /nfs/dbraw/zinc/76/86/89/1028768689.db2.gz SSILZLCTFCTKAD-SFHVURJKSA-N 1 1 313.372 3.853 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@H](C)Cc1ccsc1 ZINC000190259151 1028868401 /nfs/dbraw/zinc/86/84/01/1028868401.db2.gz QOURYKIPHYAFPU-CYBMUJFWSA-N 1 1 305.443 3.915 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2nc(C)cs2)C1 ZINC000372597052 1028874515 /nfs/dbraw/zinc/87/45/15/1028874515.db2.gz WOBCUEVFFHHXHI-GOEBONIOSA-N 1 1 318.442 3.682 20 10 DHCDMO COc1ccccc1C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816481093 1028890315 /nfs/dbraw/zinc/89/03/15/1028890315.db2.gz INONLLXSSNXIDF-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1ccccc1C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816481093 1028890338 /nfs/dbraw/zinc/89/03/38/1028890338.db2.gz INONLLXSSNXIDF-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CS[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816549958 1028929591 /nfs/dbraw/zinc/92/95/91/1028929591.db2.gz DGSWWTAEBKUFJK-GHMZBOCLSA-N 1 1 303.830 3.949 20 10 DHCDMO CC(C)[N@H+](Cc1cnn(C)c1Cl)Cc1ccc(N(C)C)cc1 ZINC000816487640 1028892157 /nfs/dbraw/zinc/89/21/57/1028892157.db2.gz SZVKLHVGNILFQJ-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO CC(C)[N@@H+](Cc1cnn(C)c1Cl)Cc1ccc(N(C)C)cc1 ZINC000816487640 1028892170 /nfs/dbraw/zinc/89/21/70/1028892170.db2.gz SZVKLHVGNILFQJ-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816492976 1028897338 /nfs/dbraw/zinc/89/73/38/1028897338.db2.gz KSVLLOAWWSAXSC-GFCCVEGCSA-N 1 1 323.795 3.568 20 10 DHCDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816492976 1028897346 /nfs/dbraw/zinc/89/73/46/1028897346.db2.gz KSVLLOAWWSAXSC-GFCCVEGCSA-N 1 1 323.795 3.568 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000816549596 1028929119 /nfs/dbraw/zinc/92/91/19/1028929119.db2.gz SQDGNJANJOWSHY-NSHDSACASA-N 1 1 321.779 3.841 20 10 DHCDMO COc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(F)c1 ZINC000816556934 1028941651 /nfs/dbraw/zinc/94/16/51/1028941651.db2.gz YSBOIMYHHCRIHU-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO COc1cccc2c1CC[C@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816556729 1028942984 /nfs/dbraw/zinc/94/29/84/1028942984.db2.gz SMYQKVXYUKUYIC-OAHLLOKOSA-N 1 1 321.779 3.970 20 10 DHCDMO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816560772 1028945391 /nfs/dbraw/zinc/94/53/91/1028945391.db2.gz ZXONJXUZCNSELG-CHWSQXEVSA-N 1 1 315.816 3.868 20 10 DHCDMO C[C@@](O)(CC[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816574566 1028950968 /nfs/dbraw/zinc/95/09/68/1028950968.db2.gz MGHZQKKKPZVYOP-QGZVFWFLSA-N 1 1 323.795 3.572 20 10 DHCDMO Cc1cc(C)cc([C@@H](O)C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000816600551 1028957247 /nfs/dbraw/zinc/95/72/47/1028957247.db2.gz AXCZWUKZMUHQMX-KRWDZBQOSA-N 1 1 323.795 3.625 20 10 DHCDMO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816613222 1028963130 /nfs/dbraw/zinc/96/31/30/1028963130.db2.gz MTHKBPYTXOUSDN-JDNHERCYSA-N 1 1 307.752 3.797 20 10 DHCDMO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816613221 1028964246 /nfs/dbraw/zinc/96/42/46/1028964246.db2.gz MTHKBPYTXOUSDN-FVMDXXJSSA-N 1 1 307.752 3.797 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)cc1 ZINC000816665983 1028985682 /nfs/dbraw/zinc/98/56/82/1028985682.db2.gz BJSYJKAGHNZZTH-PMACEKPBSA-N 1 1 314.473 3.676 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817413576 1029152963 /nfs/dbraw/zinc/15/29/63/1029152963.db2.gz ZMVJGGXSTZQGOD-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000817413575 1029153370 /nfs/dbraw/zinc/15/33/70/1029153370.db2.gz ZLMBCBZBKWFXEV-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO CCO[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000155431812 1029234846 /nfs/dbraw/zinc/23/48/46/1029234846.db2.gz RVSIBEFWENWEQU-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCc1ccc(N2CCCC2)cc1 ZINC000817898136 1029268221 /nfs/dbraw/zinc/26/82/21/1029268221.db2.gz DKLMRHWCVUKGPJ-MJGOQNOKSA-N 1 1 315.505 3.687 20 10 DHCDMO C[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)s1 ZINC000817938782 1029280597 /nfs/dbraw/zinc/28/05/97/1029280597.db2.gz SIIWKQFJUXCEKF-FZMZJTMJSA-N 1 1 323.893 3.818 20 10 DHCDMO CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817958938 1029298013 /nfs/dbraw/zinc/29/80/13/1029298013.db2.gz NCALJSHJHWZNGY-ZJUUUORDSA-N 1 1 305.249 3.723 20 10 DHCDMO C[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000817971199 1029312319 /nfs/dbraw/zinc/31/23/19/1029312319.db2.gz KLBWDKKKEHTXCU-FUHIMQAGSA-N 1 1 315.505 3.716 20 10 DHCDMO CO[C@H](C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000822570103 1030064984 /nfs/dbraw/zinc/06/49/84/1030064984.db2.gz GOXBKGXTAWPFJN-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000120964816 1030177375 /nfs/dbraw/zinc/17/73/75/1030177375.db2.gz PEQQTCDIUJQRKB-MRXNPFEDSA-N 1 1 321.461 3.642 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@@H](c2ccsc2)O1 ZINC000245942384 1030209486 /nfs/dbraw/zinc/20/94/86/1030209486.db2.gz KAVPSZNBLCOJHS-BZNIZROVSA-N 1 1 307.390 3.555 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@@H](c2ccsc2)O1 ZINC000245942384 1030209505 /nfs/dbraw/zinc/20/95/05/1030209505.db2.gz KAVPSZNBLCOJHS-BZNIZROVSA-N 1 1 307.390 3.555 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1C ZINC000291012003 1030287557 /nfs/dbraw/zinc/28/75/57/1030287557.db2.gz WXKDBDPPGYYPJR-ROUUACIJSA-N 1 1 301.430 3.543 20 10 DHCDMO C[C@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866480914 1030319182 /nfs/dbraw/zinc/31/91/82/1030319182.db2.gz KATIPAINQQEOHJ-GUYCJALGSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000866518245 1030343053 /nfs/dbraw/zinc/34/30/53/1030343053.db2.gz VSPWEWFMJHLMAZ-MBRDSATJSA-N 1 1 320.452 3.932 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1O ZINC000866541380 1030363515 /nfs/dbraw/zinc/36/35/15/1030363515.db2.gz ZYEDOQBOJHHVAP-HNNXBMFYSA-N 1 1 318.348 3.989 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)[C@@H]2CCOC(C)(C)C2)c1O ZINC000291469569 1030515715 /nfs/dbraw/zinc/51/57/15/1030515715.db2.gz DTEDJPVREJDPQE-OAHLLOKOSA-N 1 1 307.434 3.570 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2Cc3c[nH]nc3CC(C)(C)C2)cc1 ZINC000828014212 1030530074 /nfs/dbraw/zinc/53/00/74/1030530074.db2.gz XFZHBWBSRWSEMH-AATRIKPKSA-N 1 1 324.472 3.573 20 10 DHCDMO COCc1csc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000824473839 1030560907 /nfs/dbraw/zinc/56/09/07/1030560907.db2.gz FJKQFYQPINHCDF-UHFFFAOYSA-N 1 1 304.459 3.593 20 10 DHCDMO CC(C)(C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccn1 ZINC000824589122 1030588497 /nfs/dbraw/zinc/58/84/97/1030588497.db2.gz AMYFLBNKRKJKGH-UHFFFAOYSA-N 1 1 308.784 3.647 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c(O)c1 ZINC000824714268 1030618998 /nfs/dbraw/zinc/61/89/98/1030618998.db2.gz AVMXGGMDPNFONK-WCQYABFASA-N 1 1 317.351 3.954 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc2c(c1)COC2 ZINC001137027132 1030788809 /nfs/dbraw/zinc/78/88/09/1030788809.db2.gz DRGNBUMPWARPDY-UHFFFAOYSA-N 1 1 322.452 3.949 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccccn2)c(O)c(C(C)(C)C)c1 ZINC000825502118 1030829036 /nfs/dbraw/zinc/82/90/36/1030829036.db2.gz UKODNRCNWXOIPC-UHFFFAOYSA-N 1 1 314.429 3.725 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](Cc2cccs2)C2CC2)c1O ZINC000122712257 1030829481 /nfs/dbraw/zinc/82/94/81/1030829481.db2.gz SDTRPAHIJFSMMT-UHFFFAOYSA-N 1 1 319.401 3.960 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+](Cc2cccs2)C2CC2)c1O ZINC000122712257 1030829497 /nfs/dbraw/zinc/82/94/97/1030829497.db2.gz SDTRPAHIJFSMMT-UHFFFAOYSA-N 1 1 319.401 3.960 20 10 DHCDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(C)c1OC ZINC000927123909 1031106048 /nfs/dbraw/zinc/10/60/48/1031106048.db2.gz DSMWDZXICDIXSS-GFCCVEGCSA-N 1 1 319.376 3.708 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144298542 1031437531 /nfs/dbraw/zinc/43/75/31/1031437531.db2.gz GEGKGTFCRXUQOH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144298542 1031437541 /nfs/dbraw/zinc/43/75/41/1031437541.db2.gz GEGKGTFCRXUQOH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144298542 1031437552 /nfs/dbraw/zinc/43/75/52/1031437552.db2.gz GEGKGTFCRXUQOH-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H](O)c1ccccc1 ZINC000872134445 1031527539 /nfs/dbraw/zinc/52/75/39/1031527539.db2.gz WFWYLNNCBMDPDY-IWEFOYFVSA-N 1 1 303.377 3.694 20 10 DHCDMO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144514855 1031672717 /nfs/dbraw/zinc/67/27/17/1031672717.db2.gz VDDYMVKKLDOSKN-FZKQIMNGSA-N 1 1 323.433 3.567 20 10 DHCDMO CC[C@H]1CO[C@](C)(CCC(C)C)[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144514856 1031673060 /nfs/dbraw/zinc/67/30/60/1031673060.db2.gz VDDYMVKKLDOSKN-SCLBCKFNSA-N 1 1 323.433 3.567 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2nccn2C(F)F)cc1C ZINC000873026689 1031697052 /nfs/dbraw/zinc/69/70/52/1031697052.db2.gz KNSTWZQHZHXLBA-UHFFFAOYSA-N 1 1 309.360 3.665 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)c1[O-] ZINC000873261002 1031778984 /nfs/dbraw/zinc/77/89/84/1031778984.db2.gz KJKWTHPELJEMGN-RJZRQDKASA-N 1 1 308.853 3.535 20 10 DHCDMO CC[N@H+](CCCNCc1cccc(OC)c1O)C1CCCCC1 ZINC000846022126 1031814900 /nfs/dbraw/zinc/81/49/00/1031814900.db2.gz FSSTWMGOBMXRRQ-UHFFFAOYSA-N 1 1 320.477 3.535 20 10 DHCDMO CC[N@@H+](CCCNCc1cccc(OC)c1O)C1CCCCC1 ZINC000846022126 1031814918 /nfs/dbraw/zinc/81/49/18/1031814918.db2.gz FSSTWMGOBMXRRQ-UHFFFAOYSA-N 1 1 320.477 3.535 20 10 DHCDMO Oc1ccc(Cl)cc1C[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000846056330 1031816516 /nfs/dbraw/zinc/81/65/16/1031816516.db2.gz VCIIXMICTAFLNO-UHFFFAOYSA-N 1 1 322.739 3.811 20 10 DHCDMO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@](C)(O)c1ccccc1 ZINC000846045924 1031838539 /nfs/dbraw/zinc/83/85/39/1031838539.db2.gz XFYMAOVOKKPXMH-DIFFPNOSSA-N 1 1 323.795 3.571 20 10 DHCDMO FC(F)O[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000781531451 1031870300 /nfs/dbraw/zinc/87/03/00/1031870300.db2.gz CFAAEXTVDPICEK-KRWDZBQOSA-N 1 1 324.415 3.881 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1O ZINC000846104840 1031876020 /nfs/dbraw/zinc/87/60/20/1031876020.db2.gz MRBKFNMVPGQJGS-CQSZACIVSA-N 1 1 317.763 3.675 20 10 DHCDMO Cc1ccc(C[N@H+]2Cc3cccc(O)c3C2)c(-c2ccnn2C)c1 ZINC000877703038 1033417528 /nfs/dbraw/zinc/41/75/28/1033417528.db2.gz PBBXJOVPROKRQS-UHFFFAOYSA-N 1 1 319.408 3.617 20 10 DHCDMO C[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccc1O ZINC000877755756 1033432872 /nfs/dbraw/zinc/43/28/72/1033432872.db2.gz LXOOJQRGYWMSTJ-MRVPVSSYSA-N 1 1 302.321 3.718 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)C1Cc2cc(F)c(F)cc2C1 ZINC001173484768 1033741058 /nfs/dbraw/zinc/74/10/58/1033741058.db2.gz WIVNQNRFORUMQC-UHFFFAOYSA-N 1 1 303.352 3.660 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl ZINC000826049737 1033749732 /nfs/dbraw/zinc/74/97/32/1033749732.db2.gz YJJYOJTZWURZMP-OIISXLGYSA-N 1 1 323.864 3.870 20 10 DHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(C(F)(F)F)CC2)cc1F ZINC000862216531 1033784251 /nfs/dbraw/zinc/78/42/51/1033784251.db2.gz NFPSMTMINGHXTR-UHFFFAOYSA-N 1 1 322.321 3.805 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000862242789 1033794540 /nfs/dbraw/zinc/79/45/40/1033794540.db2.gz QXWKKEMQBPZZBW-NSHDSACASA-N 1 1 322.202 3.737 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCO[C@@H](CCF)C1 ZINC000862530494 1033875645 /nfs/dbraw/zinc/87/56/45/1033875645.db2.gz NPXSJGBZQZROMA-SFHVURJKSA-N 1 1 315.388 3.620 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc(C)c3O)C2)cc1F ZINC000862541690 1033882023 /nfs/dbraw/zinc/88/20/23/1033882023.db2.gz TVFYJLSGEBNGFF-HNNXBMFYSA-N 1 1 315.388 3.838 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(-c2cccs2)no1 ZINC000879651833 1034074609 /nfs/dbraw/zinc/07/46/09/1034074609.db2.gz LYOOWTZRYHKEIC-WDEREUQCSA-N 1 1 315.398 3.916 20 10 DHCDMO CCc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccccc3O)n2)cc1 ZINC000879653361 1034075932 /nfs/dbraw/zinc/07/59/32/1034075932.db2.gz PAMKQJBVUQOMER-ZDUSSCGKSA-N 1 1 323.396 3.855 20 10 DHCDMO COc1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC000128380807 1034313396 /nfs/dbraw/zinc/31/33/96/1034313396.db2.gz XOCNEBJQJZVTDJ-INIZCTEOSA-N 1 1 315.438 3.691 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2ccccn2)c1O ZINC000184715930 1034496583 /nfs/dbraw/zinc/49/65/83/1034496583.db2.gz CEIBSMWSWAIJKM-NSHDSACASA-N 1 1 306.793 3.642 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000184998416 1034519510 /nfs/dbraw/zinc/51/95/10/1034519510.db2.gz LSJMPBKVLYXVSN-LSDHHAIUSA-N 1 1 314.404 3.708 20 10 DHCDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2O)n[nH]1 ZINC000186131064 1034602046 /nfs/dbraw/zinc/60/20/46/1034602046.db2.gz WNNJUJFPCCLOJP-OCCSQVGLSA-N 1 1 309.413 3.859 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000691682292 1035327527 /nfs/dbraw/zinc/32/75/27/1035327527.db2.gz OZPKKVQMHYXIAP-NSHDSACASA-N 1 1 316.214 3.726 20 10 DHCDMO CCCOc1ccc(CN[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1C ZINC001177476193 1035371604 /nfs/dbraw/zinc/37/16/04/1035371604.db2.gz YXAQIHRHEYPHBL-SJLPKXTDSA-N 1 1 318.505 3.994 20 10 DHCDMO CCCOc1ccc(CN[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1C ZINC001177476193 1035371607 /nfs/dbraw/zinc/37/16/07/1035371607.db2.gz YXAQIHRHEYPHBL-SJLPKXTDSA-N 1 1 318.505 3.994 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc2cccnc21 ZINC001177557973 1035381333 /nfs/dbraw/zinc/38/13/33/1035381333.db2.gz NENMCJAOUUYOPO-UHFFFAOYSA-N 1 1 300.308 3.508 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)cc1 ZINC000773832776 1035510164 /nfs/dbraw/zinc/51/01/64/1035510164.db2.gz PVJYFDJWNFHYLE-IBGZPJMESA-N 1 1 309.457 3.602 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cc1C ZINC000905678870 1035612215 /nfs/dbraw/zinc/61/22/15/1035612215.db2.gz SMPBHVHMLVGTFO-CQSZACIVSA-N 1 1 317.326 3.875 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)cc1 ZINC000773846968 1035637589 /nfs/dbraw/zinc/63/75/89/1035637589.db2.gz MJSGGXGHWJWFQC-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000773862459 1035705250 /nfs/dbraw/zinc/70/52/50/1035705250.db2.gz YVRZWMVPQHFKQR-NRFANRHFSA-N 1 1 322.452 3.774 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+]Cc1ccc2ncccc2c1 ZINC001181436627 1035923416 /nfs/dbraw/zinc/92/34/16/1035923416.db2.gz XAEDJBSUABPBCP-UHFFFAOYSA-N 1 1 300.308 3.508 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2O)CCC1(F)F ZINC001233452426 1036008666 /nfs/dbraw/zinc/00/86/66/1036008666.db2.gz WDQWSJUDGXDONV-VIFPVBQESA-N 1 1 309.278 3.888 20 10 DHCDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632879 1036122979 /nfs/dbraw/zinc/12/29/79/1036122979.db2.gz CRLKXQFQEZNMHO-HXUWFJFHSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(C)N1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632879 1036122992 /nfs/dbraw/zinc/12/29/92/1036122992.db2.gz CRLKXQFQEZNMHO-HXUWFJFHSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(C)N1CC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000775632879 1036122997 /nfs/dbraw/zinc/12/29/97/1036122997.db2.gz CRLKXQFQEZNMHO-HXUWFJFHSA-N 1 1 315.505 3.591 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)ncn2C ZINC000775636421 1036131319 /nfs/dbraw/zinc/13/13/19/1036131319.db2.gz BIGAWNNVMCRCPY-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774148867 1036197160 /nfs/dbraw/zinc/19/71/60/1036197160.db2.gz UHSVCXVULWIVLF-NXEZZACHSA-N 1 1 304.217 3.919 20 10 DHCDMO C[C@H]([NH2+]CCN1CC[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774212088 1036233348 /nfs/dbraw/zinc/23/33/48/1036233348.db2.gz YGVOZKBSYWWALZ-QWRGUYRKSA-N 1 1 317.260 3.691 20 10 DHCDMO COc1ccc(C[N@H+]2CC3(CCCC3)[C@@H]2C(C)C)c(O)c1OC ZINC001182332351 1036233651 /nfs/dbraw/zinc/23/36/51/1036233651.db2.gz BZMGRUHRBWSULT-SFHVURJKSA-N 1 1 319.445 3.810 20 10 DHCDMO CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC001182343725 1036241196 /nfs/dbraw/zinc/24/11/96/1036241196.db2.gz GIWRCJXNUPHZFN-UKRRQHHQSA-N 1 1 301.789 3.622 20 10 DHCDMO Cc1cccc(C[N@@H+](C)CCCOc2ccc(F)cc2)c1O ZINC000775656683 1036244479 /nfs/dbraw/zinc/24/44/79/1036244479.db2.gz ZASQLFKLIPEAPZ-UHFFFAOYSA-N 1 1 303.377 3.741 20 10 DHCDMO CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000774499352 1036361083 /nfs/dbraw/zinc/36/10/83/1036361083.db2.gz XFUSMQKJUBCNBS-KRWDZBQOSA-N 1 1 322.880 3.961 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000775713911 1036524754 /nfs/dbraw/zinc/52/47/54/1036524754.db2.gz LMHZKZBZGWGMHR-UKRRQHHQSA-N 1 1 315.388 3.918 20 10 DHCDMO COc1ccc(O)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC000775737859 1036596761 /nfs/dbraw/zinc/59/67/61/1036596761.db2.gz NNGZSXFUBWYBNC-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC000775737859 1036596767 /nfs/dbraw/zinc/59/67/67/1036596767.db2.gz NNGZSXFUBWYBNC-LLVKDONJSA-N 1 1 319.351 3.798 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC001183696091 1036652645 /nfs/dbraw/zinc/65/26/45/1036652645.db2.gz JEXVKVCKJSUQTD-MRXNPFEDSA-N 1 1 318.505 3.762 20 10 DHCDMO COc1ccc(C[N@H+]2CCC[C@@H](C3CCCC3)C2)c(O)c1OC ZINC001184351518 1036822291 /nfs/dbraw/zinc/82/22/91/1036822291.db2.gz QFYLGRLDJDSZJK-OAHLLOKOSA-N 1 1 319.445 3.812 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccnc(OC)c2)cc1 ZINC000762920432 1037067781 /nfs/dbraw/zinc/06/77/81/1037067781.db2.gz XCOCDBMMMODQFA-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902205 1037193429 /nfs/dbraw/zinc/19/34/29/1037193429.db2.gz HLSYJRPCVFOZKF-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902205 1037193434 /nfs/dbraw/zinc/19/34/34/1037193434.db2.gz HLSYJRPCVFOZKF-OCCSQVGLSA-N 1 1 322.405 3.710 20 10 DHCDMO C[C@@H]1CCCC[C@H]1OCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199275762 1037242792 /nfs/dbraw/zinc/24/27/92/1037242792.db2.gz MDLVDVIQOSLKNC-IAQYHMDHSA-N 1 1 315.816 3.870 20 10 DHCDMO Cc1cc(O)c(CNC[C@@H](C)C[NH+]2CCCCC2)c(Cl)c1 ZINC001199580939 1037286568 /nfs/dbraw/zinc/28/65/68/1037286568.db2.gz DHBHVPYSWAOGSX-CQSZACIVSA-N 1 1 310.869 3.566 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1O ZINC000776012705 1037306151 /nfs/dbraw/zinc/30/61/51/1037306151.db2.gz ACSLXBYAKUCTFK-FQEVSTJZSA-N 1 1 309.409 3.722 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CCCCC1 ZINC000774990333 1037348615 /nfs/dbraw/zinc/34/86/15/1037348615.db2.gz SNBIIGWZLWRJLY-AWEZNQCLSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H](C)CCC(C)(C)C)ccc1[N+](=O)[O-] ZINC000775026951 1037431458 /nfs/dbraw/zinc/43/14/58/1037431458.db2.gz BZWQSURGRZGKRB-LLVKDONJSA-N 1 1 310.394 3.613 20 10 DHCDMO COC[C@H]1CCC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000164331925 1038154560 /nfs/dbraw/zinc/15/45/60/1038154560.db2.gz PZZGQROXSVFQDN-AWEZNQCLSA-N 1 1 321.461 3.557 20 10 DHCDMO COC[C@@H]1CCC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000164332040 1038155915 /nfs/dbraw/zinc/15/59/15/1038155915.db2.gz PZZGQROXSVFQDN-CQSZACIVSA-N 1 1 321.461 3.557 20 10 DHCDMO Oc1c(F)cccc1C[NH2+]CCN1CCC2(CCCCC2)CC1 ZINC001205513265 1038305770 /nfs/dbraw/zinc/30/57/70/1038305770.db2.gz DPRWZBATYNUNSD-UHFFFAOYSA-N 1 1 320.452 3.667 20 10 DHCDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001191908510 1038560750 /nfs/dbraw/zinc/56/07/50/1038560750.db2.gz CAVOVQBBAICMGV-HXUWFJFHSA-N 1 1 316.489 3.924 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493280 1038570383 /nfs/dbraw/zinc/57/03/83/1038570383.db2.gz WXICDCCGKNTXIR-LRDDRELGSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493280 1038570392 /nfs/dbraw/zinc/57/03/92/1038570392.db2.gz WXICDCCGKNTXIR-LRDDRELGSA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775493444 1038577290 /nfs/dbraw/zinc/57/72/90/1038577290.db2.gz SJPXIBCBTQOIMW-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000760882441 1038959821 /nfs/dbraw/zinc/95/98/21/1038959821.db2.gz WUSIGGSHSDKSRL-VHSKPIJISA-N 1 1 307.394 3.590 20 10 DHCDMO C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1[O-])C[NH+]1CCCC1 ZINC000171141666 1039283187 /nfs/dbraw/zinc/28/31/87/1039283187.db2.gz NJAFUWQPUFQRCP-HZPDHXFCSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@H](CC(F)(F)F)[NH2+]Cc1cccc(Br)c1O ZINC000231750483 1040394045 /nfs/dbraw/zinc/39/40/45/1040394045.db2.gz PRDVTWFDCFFNLY-SSDOTTSWSA-N 1 1 312.129 3.585 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c1O ZINC000761203931 1040577450 /nfs/dbraw/zinc/57/74/50/1040577450.db2.gz ZMHGWUAKQYWEQJ-MRXNPFEDSA-N 1 1 317.816 3.871 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2cc[nH]n2)cc1 ZINC000174365654 1040624862 /nfs/dbraw/zinc/62/48/62/1040624862.db2.gz PPGDUUMLPKEUKW-UHFFFAOYSA-N 1 1 320.440 3.726 20 10 DHCDMO CCC(CC)[N@@H+](CCOC)Cc1cc(Cl)cc(OC)c1O ZINC000228629710 1041017359 /nfs/dbraw/zinc/01/73/59/1041017359.db2.gz HNRKLUMLGJXVAJ-UHFFFAOYSA-N 1 1 315.841 3.691 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1 ZINC000093316100 193230136 /nfs/dbraw/zinc/23/01/36/193230136.db2.gz UTHDLDJVHMBEJH-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)c1O ZINC000093365100 193239889 /nfs/dbraw/zinc/23/98/89/193239889.db2.gz CUCQKHFATGSUFT-CQSZACIVSA-N 1 1 318.442 3.675 20 10 DHCDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000272460580 130033125 /nfs/dbraw/zinc/03/31/25/130033125.db2.gz QPSLFBNAEKVPAC-QGZVFWFLSA-N 1 1 321.424 3.715 20 10 DHCDMO CCc1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)s1 ZINC000273301198 130105482 /nfs/dbraw/zinc/10/54/82/130105482.db2.gz BOCJGFMBEIYSMX-NSHDSACASA-N 1 1 319.426 3.654 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccc(F)cc1O ZINC000285484159 131173423 /nfs/dbraw/zinc/17/34/23/131173423.db2.gz BSXJSOFMUQRWNO-OAHLLOKOSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccc(COC)c1)c1ccc(F)cc1O ZINC000285532676 131178489 /nfs/dbraw/zinc/17/84/89/131178489.db2.gz FMWYLWKYLCDCOO-QGZVFWFLSA-N 1 1 303.377 3.919 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(OC)c(OC)c1)c1ccc(F)cc1O ZINC000285769471 131200541 /nfs/dbraw/zinc/20/05/41/131200541.db2.gz SSWRSBNROFWNQW-HNNXBMFYSA-N 1 1 319.376 3.789 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1[O-] ZINC000286138805 131221414 /nfs/dbraw/zinc/22/14/14/131221414.db2.gz OUIMVYOLLVCSRO-YOEHRIQHSA-N 1 1 308.441 3.692 20 10 DHCDMO Cc1cnc([C@@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000293651900 131755465 /nfs/dbraw/zinc/75/54/65/131755465.db2.gz OUOZPYYTLGGUOL-QMMMGPOBSA-N 1 1 314.813 3.843 20 10 DHCDMO CC[C@H](C)C[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000297534136 132021148 /nfs/dbraw/zinc/02/11/48/132021148.db2.gz PKVGKLYRVXAENR-INIZCTEOSA-N 1 1 304.478 3.780 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](CCc1cn[nH]c1)Cc1ccccc1O ZINC000298553892 132067779 /nfs/dbraw/zinc/06/77/79/132067779.db2.gz VBSIRRVSRIRJOH-MRXNPFEDSA-N 1 1 321.424 3.921 20 10 DHCDMO CC(=O)c1cc(F)cc(C[NH+]2CCC(C(F)(F)F)CC2)c1O ZINC000132258086 332124701 /nfs/dbraw/zinc/12/47/01/332124701.db2.gz MJIFVVOJMPWLAA-UHFFFAOYSA-N 1 1 319.298 3.508 20 10 DHCDMO C[C@H](CC[S@](C)=O)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278799736 334101556 /nfs/dbraw/zinc/10/15/56/334101556.db2.gz RBPLPGYBBUURGW-LQJGKPAFSA-N 1 1 324.273 3.507 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(F)cc1O ZINC000286161790 334151449 /nfs/dbraw/zinc/15/14/49/334151449.db2.gz PWINEUGLLFKJBT-PXAZEXFGSA-N 1 1 303.377 3.826 20 10 DHCDMO CC[C@H]([NH2+]C[C@@](C)(O)c1ccsc1)c1ccc(F)cc1O ZINC000286244408 334152223 /nfs/dbraw/zinc/15/22/23/334152223.db2.gz UCTZUHMYANZRCD-GOEBONIOSA-N 1 1 309.406 3.541 20 10 DHCDMO CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1[O-] ZINC000296331622 334232031 /nfs/dbraw/zinc/23/20/31/334232031.db2.gz HJRXEUFOLAIRPL-IAYQEVDDSA-N 1 1 308.853 3.712 20 10 DHCDMO C[C@@H](Nc1[nH]c2ccccc2[nH+]1)c1ccc(N2CCOCC2)cc1 ZINC000301873854 336335508 /nfs/dbraw/zinc/33/55/08/336335508.db2.gz JNFGGYTZAOGGGR-CQSZACIVSA-N 1 1 322.412 3.573 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1ccc(F)cc1O ZINC000375345063 337008501 /nfs/dbraw/zinc/00/85/01/337008501.db2.gz KTJUROZQUQEYSY-ZUZCIYMTSA-N 1 1 305.324 3.845 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000305750357 337035510 /nfs/dbraw/zinc/03/55/10/337035510.db2.gz ZHUKPQQIOQOBHJ-WMZOPIPTSA-N 1 1 315.413 3.854 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@@H]2CCCc3cccnc32)c1O ZINC000377244484 337049283 /nfs/dbraw/zinc/04/92/83/337049283.db2.gz LQRSAIGCMFXNTP-MRXNPFEDSA-N 1 1 312.413 3.695 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@H](O)C[C@H]1c1cccc(F)c1 ZINC000377695798 337058811 /nfs/dbraw/zinc/05/88/11/337058811.db2.gz IJNLBZSDBITIPL-NXHRZFHOSA-N 1 1 315.388 3.790 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1n1cccn1)c1ccc(F)cc1O ZINC000185627849 337249778 /nfs/dbraw/zinc/24/97/78/337249778.db2.gz XUNUIWRNLPQUFI-MAZHCROVSA-N 1 1 303.381 3.562 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2ncc(-c3ccccc3)cn2)cc1C ZINC000185866227 337252045 /nfs/dbraw/zinc/25/20/45/337252045.db2.gz WJRBBRRWRLMBGU-UHFFFAOYSA-N 1 1 319.408 3.756 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000527928222 337775995 /nfs/dbraw/zinc/77/59/95/337775995.db2.gz NTXQTMFLIVABGF-RYUDHWBXSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@H](NC1CC[NH+](C2CCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000160468503 525297044 /nfs/dbraw/zinc/29/70/44/525297044.db2.gz PKNGHFDKMFAYAV-INIZCTEOSA-N 1 1 315.505 3.810 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccc(F)cc1O ZINC000188060678 525688248 /nfs/dbraw/zinc/68/82/48/525688248.db2.gz KTJUROZQUQEYSY-BMIGLBTASA-N 1 1 305.324 3.845 20 10 DHCDMO CC[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(F)cc1O ZINC000297442560 535802891 /nfs/dbraw/zinc/80/28/91/535802891.db2.gz WHTMNRCBVWMBSO-OAHLLOKOSA-N 1 1 302.393 3.945 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccc(F)cc1O ZINC000287357697 535808094 /nfs/dbraw/zinc/80/80/94/535808094.db2.gz HCEMMLPNWKIKLR-NVXWUHKLSA-N 1 1 307.409 3.921 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(N(C)C)cc1 ZINC000274226802 535808783 /nfs/dbraw/zinc/80/87/83/535808783.db2.gz OXESCFHYWKBOGW-IAQYHMDHSA-N 1 1 304.463 3.714 20 10 DHCDMO CC[C@@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(F)cc1O ZINC000287357664 535809513 /nfs/dbraw/zinc/80/95/13/535809513.db2.gz HBUVSWPBIIFILI-OAHLLOKOSA-N 1 1 304.365 3.678 20 10 DHCDMO CCOC1(C)CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293878809 1013113773 /nfs/dbraw/zinc/11/37/73/1013113773.db2.gz JNOAAXUUHJAIEZ-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO [O-]c1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000293912893 1013115693 /nfs/dbraw/zinc/11/56/93/1013115693.db2.gz LWPGCYLVHZNYOV-OAHLLOKOSA-N 1 1 306.768 3.917 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001167982270 1013474835 /nfs/dbraw/zinc/47/48/35/1013474835.db2.gz BGEGIRPZRVAIFY-ZAWLATJESA-N 1 1 315.457 3.809 20 10 DHCDMO C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000839183548 1013621779 /nfs/dbraw/zinc/62/17/79/1013621779.db2.gz YBZDPZQLAGVGAK-LLVKDONJSA-N 1 1 317.260 3.521 20 10 DHCDMO CC[N@@H+](Cc1cccs1)Cc1cc(F)cc(C(C)=O)c1O ZINC000050151492 1017116612 /nfs/dbraw/zinc/11/66/12/1017116612.db2.gz RIJUQDJKZVJTSH-UHFFFAOYSA-N 1 1 307.390 3.818 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(F)c(OC)c1 ZINC001204563373 1014989214 /nfs/dbraw/zinc/98/92/14/1014989214.db2.gz NVCPSEOMMSTNEH-UHFFFAOYSA-N 1 1 316.420 3.922 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001167474149 1015057190 /nfs/dbraw/zinc/05/71/90/1015057190.db2.gz PYYOFLGPJOKZQR-QZTJIDSGSA-N 1 1 304.478 3.778 20 10 DHCDMO COc1cc(F)c(F)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001143402775 1015489703 /nfs/dbraw/zinc/48/97/03/1015489703.db2.gz ONVDKBMWBLTDGY-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO COc1cc(F)c(F)cc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001143402775 1015489706 /nfs/dbraw/zinc/48/97/06/1015489706.db2.gz ONVDKBMWBLTDGY-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO CC[N@@H+](CCc1cccs1)Cc1ccc(OC)c(OC)c1O ZINC000891690714 1015534428 /nfs/dbraw/zinc/53/44/28/1015534428.db2.gz CNJUZXBQSRDYBX-UHFFFAOYSA-N 1 1 321.442 3.536 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1O ZINC000896536929 1015625491 /nfs/dbraw/zinc/62/54/91/1015625491.db2.gz RYHFLHXDVKRJCS-AWEZNQCLSA-N 1 1 302.443 3.612 20 10 DHCDMO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2c(O)cccc2F)CC1 ZINC000896637542 1015693255 /nfs/dbraw/zinc/69/32/55/1015693255.db2.gz OTIURRDZHVIGEO-UHFFFAOYSA-N 1 1 323.408 3.521 20 10 DHCDMO CC1(C)Cc2cc(C[NH2+]Cc3c(O)cccc3F)ccc2O1 ZINC000896640227 1015693424 /nfs/dbraw/zinc/69/34/24/1015693424.db2.gz HFFRUBDUXHECPB-UHFFFAOYSA-N 1 1 301.361 3.535 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000896641341 1015695290 /nfs/dbraw/zinc/69/52/90/1015695290.db2.gz QPBDEAPPVKZPSZ-UHFFFAOYSA-N 1 1 318.367 3.560 20 10 DHCDMO C[NH+](C)[C@@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000277329134 1016206401 /nfs/dbraw/zinc/20/64/01/1016206401.db2.gz CNQWGUKYTDGPGN-LJQANCHMSA-N 1 1 315.505 3.593 20 10 DHCDMO C[C@H]([NH2+]CCCOCCc1ccccc1)c1ccc(F)cc1O ZINC000185080729 1016535593 /nfs/dbraw/zinc/53/55/93/1016535593.db2.gz UAJLGIFLDFRTRE-HNNXBMFYSA-N 1 1 317.404 3.831 20 10 DHCDMO C[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccc(F)cc1O ZINC000185080745 1016535921 /nfs/dbraw/zinc/53/59/21/1016535921.db2.gz UAJLGIFLDFRTRE-OAHLLOKOSA-N 1 1 317.404 3.831 20 10 DHCDMO COc1ccccc1OCC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000054569181 1032401768 /nfs/dbraw/zinc/40/17/68/1032401768.db2.gz PQLAUNNNOARALY-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO CC(C)[N@@H+]1CCCC[C@H]1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000773086074 1032554908 /nfs/dbraw/zinc/55/49/08/1032554908.db2.gz YCKALHCPDXYLRK-APWZRJJASA-N 1 1 303.494 3.666 20 10 DHCDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000773086074 1032554912 /nfs/dbraw/zinc/55/49/12/1032554912.db2.gz YCKALHCPDXYLRK-APWZRJJASA-N 1 1 303.494 3.666 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)cc1 ZINC000773135307 1032566576 /nfs/dbraw/zinc/56/65/76/1032566576.db2.gz COGVFAIKZFPSCP-UONOGXRCSA-N 1 1 315.465 3.796 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1C ZINC000773256180 1032661111 /nfs/dbraw/zinc/66/11/11/1032661111.db2.gz BFYJGAWEQRCGSU-IAGOWNOFSA-N 1 1 303.446 3.648 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926914331 1032716276 /nfs/dbraw/zinc/71/62/76/1032716276.db2.gz HPUYBXLJOKJBTN-OUJBWJOFSA-N 1 1 321.314 3.682 20 10 DHCDMO CCCCN1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000125144337 1032716893 /nfs/dbraw/zinc/71/68/93/1032716893.db2.gz VCBZYGRFELGDJL-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO CCCC[NH+]1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000125144337 1032716905 /nfs/dbraw/zinc/71/69/05/1032716905.db2.gz VCBZYGRFELGDJL-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1O ZINC000186138128 1017907033 /nfs/dbraw/zinc/90/70/33/1017907033.db2.gz BYNJFFAKPOEOKP-LBPRGKRZSA-N 1 1 303.381 3.694 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1O ZINC000363533848 1018013293 /nfs/dbraw/zinc/01/32/93/1018013293.db2.gz JWUKISVENJHYTK-BHYGNILZSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533848 1018013310 /nfs/dbraw/zinc/01/33/10/1018013310.db2.gz JWUKISVENJHYTK-BHYGNILZSA-N 1 1 310.441 3.823 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000363533848 1018013323 /nfs/dbraw/zinc/01/33/23/1018013323.db2.gz JWUKISVENJHYTK-BHYGNILZSA-N 1 1 310.441 3.823 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Cl)c1 ZINC000841030184 1018040262 /nfs/dbraw/zinc/04/02/62/1018040262.db2.gz UHCPNFJZFXVACR-LBPRGKRZSA-N 1 1 304.821 3.664 20 10 DHCDMO C[C@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccccc1O ZINC000114721348 1018185346 /nfs/dbraw/zinc/18/53/46/1018185346.db2.gz HYIJGUJHNJOYPV-CYBMUJFWSA-N 1 1 309.369 3.635 20 10 DHCDMO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccccc1O ZINC000114721348 1018185353 /nfs/dbraw/zinc/18/53/53/1018185353.db2.gz HYIJGUJHNJOYPV-CYBMUJFWSA-N 1 1 309.369 3.635 20 10 DHCDMO CCCN1CCC([NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000161601255 1018217284 /nfs/dbraw/zinc/21/72/84/1018217284.db2.gz HDGDTZIIPRHGCI-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H]([NH2+]CCOCC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000278154345 1018224883 /nfs/dbraw/zinc/22/48/83/1018224883.db2.gz AJAKKNBVVWMDFQ-SSDOTTSWSA-N 1 1 314.159 3.631 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cc(C)cc(C)c2)cc1OC ZINC000766092985 1018278112 /nfs/dbraw/zinc/27/81/12/1018278112.db2.gz QCNVETZLEDEBLC-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO Cc1cc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414289 1018467725 /nfs/dbraw/zinc/46/77/25/1018467725.db2.gz UWGNBDZJMYBSKG-FPOVZHCZSA-N 1 1 323.484 3.811 20 10 DHCDMO Cc1cc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414289 1018467733 /nfs/dbraw/zinc/46/77/33/1018467733.db2.gz UWGNBDZJMYBSKG-FPOVZHCZSA-N 1 1 323.484 3.811 20 10 DHCDMO C[C@@H]1OCC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)[C@H]1C ZINC000765099788 1018474829 /nfs/dbraw/zinc/47/48/29/1018474829.db2.gz KEWGZLSTKRQTLS-STQMWFEESA-N 1 1 311.381 3.901 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H]2CCc3c2cccc3O)cc1F ZINC000858130207 1032774132 /nfs/dbraw/zinc/77/41/32/1032774132.db2.gz BRXDKGLUAIEHQO-INIZCTEOSA-N 1 1 318.367 3.514 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000278367469 1018620645 /nfs/dbraw/zinc/62/06/45/1018620645.db2.gz BXDLISQLTRXBSK-BBBLOLIVSA-N 1 1 304.217 3.917 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2cc(F)ccc2F)cc1F ZINC000858130042 1032773412 /nfs/dbraw/zinc/77/34/12/1032773412.db2.gz VWQWSBNYWCUROG-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO Oc1cccc(F)c1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001137837414 1018650141 /nfs/dbraw/zinc/65/01/41/1018650141.db2.gz FZWVIXYAKHFKTC-MRXNPFEDSA-N 1 1 303.402 3.821 20 10 DHCDMO Oc1cccc(F)c1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001137837414 1018650147 /nfs/dbraw/zinc/65/01/47/1018650147.db2.gz FZWVIXYAKHFKTC-MRXNPFEDSA-N 1 1 303.402 3.821 20 10 DHCDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(O)cccc1F ZINC001137837674 1018659941 /nfs/dbraw/zinc/65/99/41/1018659941.db2.gz QNBHXQSPLZRVMP-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(O)cccc1F ZINC001137837674 1018659947 /nfs/dbraw/zinc/65/99/47/1018659947.db2.gz QNBHXQSPLZRVMP-MRXNPFEDSA-N 1 1 301.361 3.877 20 10 DHCDMO Oc1cccc(F)c1C[NH+]1CCC(Oc2cccc(F)c2)CC1 ZINC001137837680 1018661653 /nfs/dbraw/zinc/66/16/53/1018661653.db2.gz QSFVQHHWTASIGU-UHFFFAOYSA-N 1 1 319.351 3.714 20 10 DHCDMO C[C@H](CCN(C)C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765449464 1018791297 /nfs/dbraw/zinc/79/12/97/1018791297.db2.gz KZEMOCOPFMSKCY-IAGOWNOFSA-N 1 1 303.494 3.668 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](C)NC(=O)OC(C)(C)C ZINC000785457833 1018998781 /nfs/dbraw/zinc/99/87/81/1018998781.db2.gz IQFBPTZUBZKSMG-CQSZACIVSA-N 1 1 322.449 3.517 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1cc(Cl)c(Cl)cc1O ZINC000278725754 1019096332 /nfs/dbraw/zinc/09/63/32/1019096332.db2.gz MMKCVQRVSCUGSF-IMSIIYSGSA-N 1 1 318.244 3.901 20 10 DHCDMO CCC[N@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1[O-] ZINC000923311355 1019127128 /nfs/dbraw/zinc/12/71/28/1019127128.db2.gz VQCRRLVCONAFGY-ZNXRZULTSA-N 1 1 302.462 3.525 20 10 DHCDMO CCC[N@@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1[O-] ZINC000923311355 1019127139 /nfs/dbraw/zinc/12/71/39/1019127139.db2.gz VQCRRLVCONAFGY-ZNXRZULTSA-N 1 1 302.462 3.525 20 10 DHCDMO CC(C)(C)c1cccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c1O ZINC001143104360 1019377087 /nfs/dbraw/zinc/37/70/87/1019377087.db2.gz SDLBOPLRYNEHCX-LJQANCHMSA-N 1 1 303.446 3.692 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1c(F)cncc1F ZINC000922125009 1019485761 /nfs/dbraw/zinc/48/57/61/1019485761.db2.gz BHYDDYAEEGGLAJ-LLVKDONJSA-N 1 1 304.340 3.536 20 10 DHCDMO CC[C@@H]1CCC[N@H+]1Cc1c(O)c(C(=O)OC)cc2ccccc21 ZINC000727824178 1019821447 /nfs/dbraw/zinc/82/14/47/1019821447.db2.gz NWCZPDBVBHBZOQ-CQSZACIVSA-N 1 1 313.397 3.706 20 10 DHCDMO C[N@@H+](Cc1ccc(F)cc1F)Cc1cc2c(cc1O)CCC2 ZINC000887558406 1032857919 /nfs/dbraw/zinc/85/79/19/1032857919.db2.gz PYSBLTVRLRUQSR-UHFFFAOYSA-N 1 1 303.352 3.791 20 10 DHCDMO c1nc2c(s1)CCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000858351664 1032858510 /nfs/dbraw/zinc/85/85/10/1032858510.db2.gz MWBXSTWFOXGGGV-MRXNPFEDSA-N 1 1 313.470 3.911 20 10 DHCDMO C[C@H]1CCCC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715814265 1020172906 /nfs/dbraw/zinc/17/29/06/1020172906.db2.gz JZCLJWCLAIGMKJ-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715814265 1020172914 /nfs/dbraw/zinc/17/29/14/1020172914.db2.gz JZCLJWCLAIGMKJ-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO Cc1cc(C[N@H+](C)[C@H]2CCN(C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189150 1020205636 /nfs/dbraw/zinc/20/56/36/1020205636.db2.gz POUIYSCUKYQLGO-KRWDZBQOSA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN(C)[C@H]2CC[N@@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189150 1020205642 /nfs/dbraw/zinc/20/56/42/1020205642.db2.gz POUIYSCUKYQLGO-KRWDZBQOSA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189150 1020205648 /nfs/dbraw/zinc/20/56/48/1020205648.db2.gz POUIYSCUKYQLGO-KRWDZBQOSA-N 1 1 316.489 3.667 20 10 DHCDMO Nc1[nH+]cccc1Nc1ccccc1C(=O)c1ccc(F)cc1 ZINC001212398188 1020310977 /nfs/dbraw/zinc/31/09/77/1020310977.db2.gz MAZTXFIVKCZTLB-UHFFFAOYSA-N 1 1 307.328 3.778 20 10 DHCDMO Cc1ccc(O)c(C[NH2+]C[C@@]2(C)CCN(Cc3ccccc3)C2)c1 ZINC000310064378 1020312111 /nfs/dbraw/zinc/31/21/11/1020312111.db2.gz AVIFGOQPUXUFRU-OAQYLSRUSA-N 1 1 324.468 3.702 20 10 DHCDMO Cc1ccc(Nc2ccc[nH+]c2N)c(C(=O)c2ccccc2)c1 ZINC001212405932 1020350992 /nfs/dbraw/zinc/35/09/92/1020350992.db2.gz PEDSBBBXSAFKRF-UHFFFAOYSA-N 1 1 303.365 3.947 20 10 DHCDMO C[C@H]1C[C@H](C)CN(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000733325212 1020372331 /nfs/dbraw/zinc/37/23/31/1020372331.db2.gz FBAZKUDDOHLFPV-KBPBESRZSA-N 1 1 324.896 3.892 20 10 DHCDMO COc1ccc(OC)c(C[N@@H+](Cc2ccccc2O)C2CC2)c1 ZINC000179557147 1020408875 /nfs/dbraw/zinc/40/88/75/1020408875.db2.gz NOIACIQRBGUCEC-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](C)C(=O)OC(C)(C)C ZINC001171921367 1032920705 /nfs/dbraw/zinc/92/07/05/1032920705.db2.gz UOWIAHKXNDZWNL-HNNXBMFYSA-N 1 1 320.477 3.613 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](C)C(=O)OC(C)(C)C ZINC001171921367 1032920715 /nfs/dbraw/zinc/92/07/15/1032920715.db2.gz UOWIAHKXNDZWNL-HNNXBMFYSA-N 1 1 320.477 3.613 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2ccn(C)n2)c(C)n1-c1ccccc1 ZINC000858542188 1032938143 /nfs/dbraw/zinc/93/81/43/1032938143.db2.gz IWUIHPVGNJUMBA-OAHLLOKOSA-N 1 1 308.429 3.678 20 10 DHCDMO COc1ccc(C[N@H+]2CCc3cccc(O)c3C2)c(Cl)c1 ZINC001140822705 1021066407 /nfs/dbraw/zinc/06/64/07/1021066407.db2.gz FPJRHJGMIGUWMJ-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CC1(C)C[C@H]([NH2+]Cc2ccccc2O)CCN1Cc1ccccc1 ZINC001171970057 1032954710 /nfs/dbraw/zinc/95/47/10/1032954710.db2.gz XTFHNCXZMRPHSV-LJQANCHMSA-N 1 1 324.468 3.925 20 10 DHCDMO COc1cc(C[N@H+]2CCCSCC2)c(O)c(C(C)(C)C)c1 ZINC000164116962 1021232044 /nfs/dbraw/zinc/23/20/44/1021232044.db2.gz KNIMOLSLUHAUDF-UHFFFAOYSA-N 1 1 309.475 3.637 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@H](C)CO1 ZINC000917428764 1021264836 /nfs/dbraw/zinc/26/48/36/1021264836.db2.gz XKNSMJPPPRAJBV-CHWSQXEVSA-N 1 1 315.413 3.626 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H]3CCCC[C@@H]32)cc1C(C)C ZINC000917473336 1021270680 /nfs/dbraw/zinc/27/06/80/1021270680.db2.gz PWYUFVYPDXKFAE-HKUYNNGSSA-N 1 1 303.446 3.967 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCCCC1)OCO2 ZINC000917477798 1021271415 /nfs/dbraw/zinc/27/14/15/1021271415.db2.gz JHSGXJXAKVLIHU-HNNXBMFYSA-N 1 1 303.402 3.666 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H]3CCCC[C@H]32)cc1C(C)C ZINC000917473337 1021271505 /nfs/dbraw/zinc/27/15/05/1021271505.db2.gz PWYUFVYPDXKFAE-IEBWSBKVSA-N 1 1 303.446 3.967 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@H](c2ccccc2)CO1 ZINC000743409061 1021290322 /nfs/dbraw/zinc/29/03/22/1021290322.db2.gz QYTFQLHUZICXEW-QRWLVFNGSA-N 1 1 323.436 3.843 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nccn2C(C)C)cc1 ZINC000850034251 1021400326 /nfs/dbraw/zinc/40/03/26/1021400326.db2.gz JKQGRDAIYMXTRZ-UHFFFAOYSA-N 1 1 300.450 3.600 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O)C(F)F ZINC000850312677 1021472426 /nfs/dbraw/zinc/47/24/26/1021472426.db2.gz WZLZLMLGHJMKDD-CYBMUJFWSA-N 1 1 301.377 3.832 20 10 DHCDMO CCc1nc(C[NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)co1 ZINC000850316147 1021472545 /nfs/dbraw/zinc/47/25/45/1021472545.db2.gz BTBFALFISIHJOF-UHFFFAOYSA-N 1 1 318.417 3.539 20 10 DHCDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539327 1021593284 /nfs/dbraw/zinc/59/32/84/1021593284.db2.gz RXNCXVVEDRFPLQ-JKSUJKDBSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539327 1021593296 /nfs/dbraw/zinc/59/32/96/1021593296.db2.gz RXNCXVVEDRFPLQ-JKSUJKDBSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cc(Cl)c(Cl)cc1O ZINC000850573179 1021616975 /nfs/dbraw/zinc/61/69/75/1021616975.db2.gz VUOCUMPIGZBKTC-BDAKNGLRSA-N 1 1 314.216 3.844 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@@H]2CCCCO2)c(O)c(C(C)(C)C)c1 ZINC000918735342 1021636196 /nfs/dbraw/zinc/63/61/96/1021636196.db2.gz KGVSZZZRHCRODL-INIZCTEOSA-N 1 1 305.462 3.999 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)cc1C ZINC000066794218 1021751528 /nfs/dbraw/zinc/75/15/28/1021751528.db2.gz WLMPGKCHQZPKGK-LJQANCHMSA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)cc1C ZINC000066794218 1021751542 /nfs/dbraw/zinc/75/15/42/1021751542.db2.gz WLMPGKCHQZPKGK-LJQANCHMSA-N 1 1 315.388 3.722 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000746025105 1021826811 /nfs/dbraw/zinc/82/68/11/1021826811.db2.gz JXDIKRKOOOUXQF-CYBMUJFWSA-N 1 1 311.381 3.847 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccc(F)n2)cc1 ZINC000851716454 1021970969 /nfs/dbraw/zinc/97/09/69/1021970969.db2.gz MTGKHWTWSDEMGG-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO C[N@@H+](CCO[C@@H]1CC1(F)F)Cc1ccc(N2CCCCC2)cc1 ZINC000851717609 1021972398 /nfs/dbraw/zinc/97/23/98/1021972398.db2.gz ZORDJPORECQEDT-QGZVFWFLSA-N 1 1 324.415 3.533 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)OCO3)[C@H]1c1ccccc1 ZINC000919949020 1021974687 /nfs/dbraw/zinc/97/46/87/1021974687.db2.gz MXZJWSIRWHTTRC-SFHVURJKSA-N 1 1 311.381 3.704 20 10 DHCDMO CCCn1nc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1C ZINC000155190960 1022054025 /nfs/dbraw/zinc/05/40/25/1022054025.db2.gz WLCHYTVNSWBHSV-UHFFFAOYSA-N 1 1 314.477 3.608 20 10 DHCDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000180068156 1022105866 /nfs/dbraw/zinc/10/58/66/1022105866.db2.gz PSAXJXIZGMFHEE-OLZOCXBDSA-N 1 1 307.434 3.808 20 10 DHCDMO C[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241444 1022241405 /nfs/dbraw/zinc/24/14/05/1022241405.db2.gz VFFXRVDYUWOLLD-WMZOPIPTSA-N 1 1 315.505 3.525 20 10 DHCDMO C[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241444 1022241410 /nfs/dbraw/zinc/24/14/10/1022241410.db2.gz VFFXRVDYUWOLLD-WMZOPIPTSA-N 1 1 315.505 3.525 20 10 DHCDMO Cc1cc(C[N@@H+](C)CC2=CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000853561777 1022291284 /nfs/dbraw/zinc/29/12/84/1022291284.db2.gz QQNOIITWGSYXAM-UHFFFAOYSA-N 1 1 303.446 3.777 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cc(C)ccc2F)c(O)cc1C ZINC000766629502 1022317782 /nfs/dbraw/zinc/31/77/82/1022317782.db2.gz CGFARBZGVQXENI-UHFFFAOYSA-N 1 1 303.377 3.789 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CNCC[C@@H]1c1ccccc1)c1ccc(N(C)C)cc1 ZINC000854221843 1022433223 /nfs/dbraw/zinc/43/32/23/1022433223.db2.gz AZCPRAWFFJXCJN-MAODMQOUSA-N 1 1 323.484 3.549 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)c1O ZINC000179563463 1022473788 /nfs/dbraw/zinc/47/37/88/1022473788.db2.gz DUUKJHYIDYNCSU-UHFFFAOYSA-N 1 1 307.340 3.934 20 10 DHCDMO CC[C@@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1ccccc1O ZINC000179584199 1022475982 /nfs/dbraw/zinc/47/59/82/1022475982.db2.gz KAWIEOQFYJHKIC-KRWDZBQOSA-N 1 1 313.397 3.519 20 10 DHCDMO CC[C@@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1ccccc1O ZINC000179584199 1022475984 /nfs/dbraw/zinc/47/59/84/1022475984.db2.gz KAWIEOQFYJHKIC-KRWDZBQOSA-N 1 1 313.397 3.519 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1 ZINC000179803225 1022546584 /nfs/dbraw/zinc/54/65/84/1022546584.db2.gz QXRLHDXWNIQFDG-UHFFFAOYSA-N 1 1 308.425 3.748 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](C3CC3)C1)oc1ccccc12 ZINC000776772737 1022561533 /nfs/dbraw/zinc/56/15/33/1022561533.db2.gz PQHNYUVCADIRQT-HXUWFJFHSA-N 1 1 323.392 3.902 20 10 DHCDMO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cccc(Br)c1O ZINC000763650300 1022680813 /nfs/dbraw/zinc/68/08/13/1022680813.db2.gz YOBLBNIKIDTMDK-NSHDSACASA-N 1 1 310.235 3.919 20 10 DHCDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cccc(Br)c1O ZINC000763650300 1022680817 /nfs/dbraw/zinc/68/08/17/1022680817.db2.gz YOBLBNIKIDTMDK-NSHDSACASA-N 1 1 310.235 3.919 20 10 DHCDMO CN1CCC[C@H]1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396346 1022709716 /nfs/dbraw/zinc/70/97/16/1022709716.db2.gz DKQXMMBWSNZKMS-KRWDZBQOSA-N 1 1 302.462 3.621 20 10 DHCDMO CN1CCC[C@H]1CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396346 1022709727 /nfs/dbraw/zinc/70/97/27/1022709727.db2.gz DKQXMMBWSNZKMS-KRWDZBQOSA-N 1 1 302.462 3.621 20 10 DHCDMO Cc1noc([C@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000068962495 1022829173 /nfs/dbraw/zinc/82/91/73/1022829173.db2.gz USUAREDCKOHUQX-HNNXBMFYSA-N 1 1 323.396 3.616 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(F)nc1)C1CCCC1 ZINC000189347749 1022848113 /nfs/dbraw/zinc/84/81/13/1022848113.db2.gz JKHDGYSKJHOGDD-UHFFFAOYSA-N 1 1 300.377 3.871 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000856804917 1022871270 /nfs/dbraw/zinc/87/12/70/1022871270.db2.gz HRDROSPKKYFFDH-ZETCQYMHSA-N 1 1 312.599 3.858 20 10 DHCDMO CC[N@@H+](Cc1sccc1OC)Cc1ccc(N(C)C)cc1 ZINC000768134710 1022902476 /nfs/dbraw/zinc/90/24/76/1022902476.db2.gz TTWHKCBVQSIBOE-UHFFFAOYSA-N 1 1 304.459 3.845 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@@H]1CC=CCC1 ZINC000768162062 1022908138 /nfs/dbraw/zinc/90/81/38/1022908138.db2.gz KGVAPDDWDAUUQL-SJLPKXTDSA-N 1 1 301.430 3.730 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1F ZINC000768200674 1022913712 /nfs/dbraw/zinc/91/37/12/1022913712.db2.gz OIAJANLTRNBEHU-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3sccc3[C@@H]2C)c1 ZINC000768206734 1022915662 /nfs/dbraw/zinc/91/56/62/1022915662.db2.gz DPUOONFPNRKCMG-LBPRGKRZSA-N 1 1 303.427 3.972 20 10 DHCDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1cc(C)c(C)cc1O ZINC000768198560 1022924908 /nfs/dbraw/zinc/92/49/08/1022924908.db2.gz VMEMGADPOGZRPG-UHFFFAOYSA-N 1 1 313.397 3.760 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)CCOc2ccccc2Cl)c1 ZINC000768212430 1022926275 /nfs/dbraw/zinc/92/62/75/1022926275.db2.gz IYVMEWIBYPQWSZ-UHFFFAOYSA-N 1 1 305.805 3.865 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)CCOc2ccccc2C)c(O)c1 ZINC000768214000 1022927831 /nfs/dbraw/zinc/92/78/31/1022927831.db2.gz XYDHSQBKOYIKIU-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000768261232 1022936022 /nfs/dbraw/zinc/93/60/22/1022936022.db2.gz AHTNLKADCVTLOK-WBVHZDCISA-N 1 1 320.452 3.673 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1CO ZINC000857061283 1022939834 /nfs/dbraw/zinc/93/98/34/1022939834.db2.gz NNNZKCDVUUCCDL-DNVCBOLYSA-N 1 1 311.425 3.510 20 10 DHCDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000768320396 1022944438 /nfs/dbraw/zinc/94/44/38/1022944438.db2.gz ULIPDCLOGGBURD-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCC=CO1 ZINC000191057024 1022946351 /nfs/dbraw/zinc/94/63/51/1022946351.db2.gz MTWNMULGWMSVNS-IBGZPJMESA-N 1 1 300.446 3.801 20 10 DHCDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000768317127 1022950762 /nfs/dbraw/zinc/95/07/62/1022950762.db2.gz FFEUOQXZUOIFEJ-KRWDZBQOSA-N 1 1 320.452 3.673 20 10 DHCDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc(OC)c(C)cc2O)C1 ZINC000768444647 1022968088 /nfs/dbraw/zinc/96/80/88/1022968088.db2.gz BAFVAKPBXHLAAC-OAHLLOKOSA-N 1 1 309.475 3.817 20 10 DHCDMO CCCCC[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768464018 1022972417 /nfs/dbraw/zinc/97/24/17/1022972417.db2.gz YZVPWDIUGBLWOV-HNNXBMFYSA-N 1 1 307.434 3.954 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@H]2CC(C)C)cc1OC ZINC000768462998 1022972541 /nfs/dbraw/zinc/97/25/41/1022972541.db2.gz DLGAKIBIBQXEPI-HNNXBMFYSA-N 1 1 307.434 3.810 20 10 DHCDMO COc1cc(C[N@H+]2CCSC3(CCCCC3)C2)c(O)cc1C ZINC000768463052 1022973667 /nfs/dbraw/zinc/97/36/67/1022973667.db2.gz FLWXKQWYZGQLDF-UHFFFAOYSA-N 1 1 321.486 3.961 20 10 DHCDMO CC[N@@H+](Cc1c(O)cccc1OC)[C@@H](C)c1cccc(OC)c1 ZINC000768519814 1022977903 /nfs/dbraw/zinc/97/79/03/1022977903.db2.gz IGWRVEGQJDMXJX-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 ZINC000768912648 1023055488 /nfs/dbraw/zinc/05/54/88/1023055488.db2.gz ATNOTDBFHWAYCJ-VBQJREDUSA-N 1 1 322.880 3.883 20 10 DHCDMO C[N@H+](Cc1cc(Cl)ccc1O)C[C@H]1OCCc2ccccc21 ZINC000769021458 1023070908 /nfs/dbraw/zinc/07/09/08/1023070908.db2.gz JTMAZRMKEYNHJN-GOSISDBHSA-N 1 1 317.816 3.791 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000769241049 1023106343 /nfs/dbraw/zinc/10/63/43/1023106343.db2.gz JMNPINRFVGXEAZ-CQSZACIVSA-N 1 1 310.235 3.919 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1O ZINC000769105160 1023085328 /nfs/dbraw/zinc/08/53/28/1023085328.db2.gz NBRUKCKNEJDYID-KRWDZBQOSA-N 1 1 313.397 3.834 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000769241049 1023106338 /nfs/dbraw/zinc/10/63/38/1023106338.db2.gz JMNPINRFVGXEAZ-CQSZACIVSA-N 1 1 310.235 3.919 20 10 DHCDMO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769311205 1023119779 /nfs/dbraw/zinc/11/97/79/1023119779.db2.gz ZQJZTBKKOYPINN-OXJNMPFZSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769326411 1023123096 /nfs/dbraw/zinc/12/30/96/1023123096.db2.gz LWORMTMEONCFKU-INIZCTEOSA-N 1 1 312.457 3.824 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCCc3sccc3C2)c1 ZINC000769386744 1023137593 /nfs/dbraw/zinc/13/75/93/1023137593.db2.gz GCHVBDDMYKZBKY-UHFFFAOYSA-N 1 1 303.427 3.801 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000769390559 1023139688 /nfs/dbraw/zinc/13/96/88/1023139688.db2.gz YXYBJDZXSKXZIK-LLVKDONJSA-N 1 1 322.202 3.737 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000769390559 1023139690 /nfs/dbraw/zinc/13/96/90/1023139690.db2.gz YXYBJDZXSKXZIK-LLVKDONJSA-N 1 1 322.202 3.737 20 10 DHCDMO C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769389499 1023140143 /nfs/dbraw/zinc/14/01/43/1023140143.db2.gz PJHDGUQHBJLCIG-CQSZACIVSA-N 1 1 303.406 3.569 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000769426286 1023146237 /nfs/dbraw/zinc/14/62/37/1023146237.db2.gz DXJBGXSIOFAEAO-UHFFFAOYSA-N 1 1 315.388 3.747 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000769481889 1023152560 /nfs/dbraw/zinc/15/25/60/1023152560.db2.gz ANRPKFDXLQNIKQ-YLJYHZDGSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCN(CC)C[C@H]2C)cc1 ZINC000769481889 1023152572 /nfs/dbraw/zinc/15/25/72/1023152572.db2.gz ANRPKFDXLQNIKQ-YLJYHZDGSA-N 1 1 317.521 3.695 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCN(CC)C[C@H]2C)cc1 ZINC000769481889 1023152578 /nfs/dbraw/zinc/15/25/78/1023152578.db2.gz ANRPKFDXLQNIKQ-YLJYHZDGSA-N 1 1 317.521 3.695 20 10 DHCDMO CC1(C)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000769488683 1023154421 /nfs/dbraw/zinc/15/44/21/1023154421.db2.gz IUAMQBDIVGKMQR-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769452267 1023157617 /nfs/dbraw/zinc/15/76/17/1023157617.db2.gz UVDQUBFFVYESRR-SJORKVTESA-N 1 1 302.462 3.534 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CC[C@@](C)(O)C2)cc1 ZINC000769541502 1023166753 /nfs/dbraw/zinc/16/67/53/1023166753.db2.gz CCTQFIQIFCGTKK-OAQYLSRUSA-N 1 1 324.468 3.670 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c(O)c1 ZINC000769499961 1023166980 /nfs/dbraw/zinc/16/69/80/1023166980.db2.gz YAADKMRHWLUSCP-NVXWUHKLSA-N 1 1 307.459 3.651 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c(O)c1 ZINC000769506227 1023168719 /nfs/dbraw/zinc/16/87/19/1023168719.db2.gz DULVUTFZXIGUTJ-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c1O ZINC000769508682 1023170932 /nfs/dbraw/zinc/17/09/32/1023170932.db2.gz UPABIXVUNGQLCT-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000769513565 1023171723 /nfs/dbraw/zinc/17/17/23/1023171723.db2.gz BQWFNCJLJWPRGI-RTBURBONSA-N 1 1 323.436 3.918 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC3(C2)CCOCC3)cc1F ZINC000769541270 1023175928 /nfs/dbraw/zinc/17/59/28/1023175928.db2.gz SXEKMBRYFWBXBW-UHFFFAOYSA-N 1 1 320.452 3.674 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc(Cl)c(C)cc1O)C2 ZINC000825893159 1033126348 /nfs/dbraw/zinc/12/63/48/1033126348.db2.gz QKPDBVRNKYCCQI-UHFFFAOYSA-N 1 1 309.837 3.745 20 10 DHCDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876738825 1033132423 /nfs/dbraw/zinc/13/24/23/1033132423.db2.gz BMDQEADJAMSODI-HXUWFJFHSA-N 1 1 316.489 3.658 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)C[C@H]3CCCCO3)c2c1 ZINC000125323438 1023476913 /nfs/dbraw/zinc/47/69/13/1023476913.db2.gz AWONDXOFYZQCAV-MRXNPFEDSA-N 1 1 315.413 3.555 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2c(O)cccc2OC)cc1 ZINC000771933504 1023489741 /nfs/dbraw/zinc/48/97/41/1023489741.db2.gz KLFMUWLCVYBGRW-QGZVFWFLSA-N 1 1 313.397 3.747 20 10 DHCDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876773054 1033139922 /nfs/dbraw/zinc/13/99/22/1033139922.db2.gz VJDVPDASXGJRBF-QGZVFWFLSA-N 1 1 316.489 3.660 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2ncc(C)s2)cc1 ZINC000772173863 1023528463 /nfs/dbraw/zinc/52/84/63/1023528463.db2.gz FOTVNQRWJGPCSN-UHFFFAOYSA-N 1 1 303.475 3.930 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ncc(C)s2)cc1 ZINC000772173863 1023528467 /nfs/dbraw/zinc/52/84/67/1023528467.db2.gz FOTVNQRWJGPCSN-UHFFFAOYSA-N 1 1 303.475 3.930 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@H+](C)CCc2cccs2)c1O ZINC000093269266 1023592298 /nfs/dbraw/zinc/59/22/98/1023592298.db2.gz SSARZLNCKSANDF-UHFFFAOYSA-N 1 1 323.845 3.984 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)CCc2cccs2)c1O ZINC000093269266 1023592303 /nfs/dbraw/zinc/59/23/03/1023592303.db2.gz SSARZLNCKSANDF-UHFFFAOYSA-N 1 1 323.845 3.984 20 10 DHCDMO CC[C@]1(C)C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000785985307 1023648664 /nfs/dbraw/zinc/64/86/64/1023648664.db2.gz UZVRDZWZTBZWLG-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO CC[C@H](CC(C)C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001172407131 1033156228 /nfs/dbraw/zinc/15/62/28/1033156228.db2.gz NGTNYOHDPVFEML-GOSISDBHSA-N 1 1 304.478 3.780 20 10 DHCDMO Cc1nc(F)ccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000787087269 1023755660 /nfs/dbraw/zinc/75/56/60/1023755660.db2.gz OOKKBUJSXZZGGM-UHFFFAOYSA-N 1 1 313.420 3.760 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(F)cn2)cc1 ZINC000787151586 1023764554 /nfs/dbraw/zinc/76/45/54/1023764554.db2.gz IEDBUAVKOUCZSI-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CC[C@@H]([NH2+]CCOc1cccc(F)c1)c1ccc(F)cc1O ZINC000796703314 1023884906 /nfs/dbraw/zinc/88/49/06/1023884906.db2.gz RPXIBDCSVDGWHQ-MRXNPFEDSA-N 1 1 307.340 3.790 20 10 DHCDMO C[C@H]([NH2+]CCCOCC1CC1)c1cccc(C(F)(F)F)c1O ZINC000788508313 1023897164 /nfs/dbraw/zinc/89/71/64/1023897164.db2.gz USPJGSPKKLSLQC-NSHDSACASA-N 1 1 317.351 3.878 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)CN1CCC[C@@H](C)C1)c1ccc(F)cc1O ZINC000796703174 1023898327 /nfs/dbraw/zinc/89/83/27/1023898327.db2.gz FQULDICZRXIWQV-KEYYUXOJSA-N 1 1 308.441 3.692 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000788600897 1023911640 /nfs/dbraw/zinc/91/16/40/1023911640.db2.gz FHQYPHYBACQHPH-MNOVXSKESA-N 1 1 319.367 3.859 20 10 DHCDMO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788606863 1023912128 /nfs/dbraw/zinc/91/21/28/1023912128.db2.gz AYKWASSFEOYNLP-IJLUTSLNSA-N 1 1 319.367 3.859 20 10 DHCDMO CO[C@@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788607734 1023912433 /nfs/dbraw/zinc/91/24/33/1023912433.db2.gz CFRNANOFVQWBSG-MFKMUULPSA-N 1 1 305.340 3.733 20 10 DHCDMO C[C@H]([NH2+]CC1(CO)CCCC1)c1cccc(C(F)(F)F)c1O ZINC000788754501 1023928767 /nfs/dbraw/zinc/92/87/67/1023928767.db2.gz PIGCOVUGFOMOKE-NSHDSACASA-N 1 1 317.351 3.614 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCSC1)c1cccc(C(F)(F)F)c1O ZINC000788795697 1023935843 /nfs/dbraw/zinc/93/58/43/1023935843.db2.gz BABYSCAQKGYBKF-VHSXEESVSA-N 1 1 305.365 3.815 20 10 DHCDMO COCC1(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)CCC1 ZINC000788820723 1023941255 /nfs/dbraw/zinc/94/12/55/1023941255.db2.gz DAORVQSKJMIREW-LLVKDONJSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cc(Cl)c(Cl)cc1O ZINC000278858267 1023968873 /nfs/dbraw/zinc/96/88/73/1023968873.db2.gz WEQGJDITEOVYHY-DTWKUNHWSA-N 1 1 314.216 3.844 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000882880081 1024156925 /nfs/dbraw/zinc/15/69/25/1024156925.db2.gz AWLXJRPYQYMZFA-AWEZNQCLSA-N 1 1 307.365 3.997 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000883084169 1024234717 /nfs/dbraw/zinc/23/47/17/1024234717.db2.gz JLHCBBLUQMZSSB-OAHLLOKOSA-N 1 1 323.314 3.813 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000883082164 1024234915 /nfs/dbraw/zinc/23/49/15/1024234915.db2.gz YRDFZKNFPDAAKE-CXAGYDPISA-N 1 1 319.351 3.538 20 10 DHCDMO COC[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000883319463 1024373359 /nfs/dbraw/zinc/37/33/59/1024373359.db2.gz CTPLDPOZLMZDQA-LPEHRKFASA-N 1 1 304.217 3.775 20 10 DHCDMO CC[NH+]1CCC([N@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000131563930 1024391750 /nfs/dbraw/zinc/39/17/50/1024391750.db2.gz VGWMBDFMIKLDHK-UHFFFAOYSA-N 1 1 317.260 3.615 20 10 DHCDMO CC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000131563930 1024391764 /nfs/dbraw/zinc/39/17/64/1024391764.db2.gz VGWMBDFMIKLDHK-UHFFFAOYSA-N 1 1 317.260 3.615 20 10 DHCDMO CN(C)[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000790947205 1024401692 /nfs/dbraw/zinc/40/16/92/1024401692.db2.gz LYIIASCUEYUOSM-HNNXBMFYSA-N 1 1 322.811 3.577 20 10 DHCDMO COc1ccc(C)cc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790949136 1024402197 /nfs/dbraw/zinc/40/21/97/1024402197.db2.gz JPZJIBUGFSKITD-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1c(F)cccc1F ZINC000790949764 1024402512 /nfs/dbraw/zinc/40/25/12/1024402512.db2.gz ZVJOMXIIFAYDKI-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO C[C@H](Cc1cccc(O)c1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790959483 1024403816 /nfs/dbraw/zinc/40/38/16/1024403816.db2.gz GPCSZXUMOXMXRR-SNVBAGLBSA-N 1 1 309.768 3.611 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1ccc(F)c(F)c1 ZINC000790992469 1024413888 /nfs/dbraw/zinc/41/38/88/1024413888.db2.gz KBEWYNFGDLGNQG-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790980696 1024423844 /nfs/dbraw/zinc/42/38/44/1024423844.db2.gz PQZVJCMYTRVPND-YGRLFVJLSA-N 1 1 315.816 3.868 20 10 DHCDMO OCC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790980180 1024423953 /nfs/dbraw/zinc/42/39/53/1024423953.db2.gz JPCXIWBVFLFTGL-CQSZACIVSA-N 1 1 315.816 3.606 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1cc2ccccc2[nH]1 ZINC000790980051 1024423962 /nfs/dbraw/zinc/42/39/62/1024423962.db2.gz CGJDRWHKFCMCDT-UHFFFAOYSA-N 1 1 318.779 3.998 20 10 DHCDMO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cccc(F)c1O ZINC000317310857 1024521079 /nfs/dbraw/zinc/52/10/79/1024521079.db2.gz VAOKUYQVELAORJ-ZDUSSCGKSA-N 1 1 303.377 3.603 20 10 DHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cccc(F)c1O ZINC000317310857 1024521085 /nfs/dbraw/zinc/52/10/85/1024521085.db2.gz VAOKUYQVELAORJ-ZDUSSCGKSA-N 1 1 303.377 3.603 20 10 DHCDMO CCC[N@@H+](Cc1nccn1-c1ccccc1)Cc1ccccc1O ZINC000792165222 1024641533 /nfs/dbraw/zinc/64/15/33/1024641533.db2.gz NEKXRWAERKETQG-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO Cc1cc2oc(=O)cc(C[N@@H+](C)Cc3ccccc3O)c2cc1C ZINC000109768981 1024695440 /nfs/dbraw/zinc/69/54/40/1024695440.db2.gz NOOLGKNVWMIBAS-UHFFFAOYSA-N 1 1 323.392 3.747 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccco2)c(C(F)(F)F)c1 ZINC000792777249 1024795428 /nfs/dbraw/zinc/79/54/28/1024795428.db2.gz MSGUFWDYIZEDAN-UHFFFAOYSA-N 1 1 312.335 3.996 20 10 DHCDMO COc1c(O)c(C[NH2+]CC2(C)CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000793289494 1024975013 /nfs/dbraw/zinc/97/50/13/1024975013.db2.gz RJRJBMQKRYKHPN-UHFFFAOYSA-N 1 1 322.405 3.615 20 10 DHCDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000793369501 1025009108 /nfs/dbraw/zinc/00/91/08/1025009108.db2.gz IYMUFVSCPJPUEA-GOSISDBHSA-N 1 1 316.489 3.781 20 10 DHCDMO CC[C@@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1ccc(N(C)C)cc1 ZINC000793567242 1025104770 /nfs/dbraw/zinc/10/47/70/1025104770.db2.gz IEBNHVMQXXJZIY-LJQANCHMSA-N 1 1 322.456 3.912 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1C[C@@]12CCOC2 ZINC000885940673 1025413022 /nfs/dbraw/zinc/41/30/22/1025413022.db2.gz OWEZCRFPMYDJHP-AZUAARDMSA-N 1 1 314.473 3.535 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cnc2onc(C)c2c1 ZINC000893872138 1025586262 /nfs/dbraw/zinc/58/62/62/1025586262.db2.gz PWBBHEMVFFEYEM-UHFFFAOYSA-N 1 1 324.428 3.619 20 10 DHCDMO COc1ccc(C[N@H+]2CCCC3(CCCC3)C2)c(O)c1OC ZINC000893887806 1025590871 /nfs/dbraw/zinc/59/08/71/1025590871.db2.gz OMRSXVKODDAXCK-UHFFFAOYSA-N 1 1 305.418 3.566 20 10 DHCDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(F)cc1F ZINC000886350531 1025600241 /nfs/dbraw/zinc/60/02/41/1025600241.db2.gz XXBRCIQTTZQBBV-UHFFFAOYSA-N 1 1 313.294 3.974 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1c(O)cccc1F ZINC000886489436 1025649278 /nfs/dbraw/zinc/64/92/78/1025649278.db2.gz ISLKTVMXJYBGNQ-HIFRSBDPSA-N 1 1 318.392 3.612 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1c(O)cccc1F ZINC000886496657 1025652798 /nfs/dbraw/zinc/65/27/98/1025652798.db2.gz BYFYFVZMDIFWAE-BXUZGUMPSA-N 1 1 308.422 3.546 20 10 DHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886496725 1025653972 /nfs/dbraw/zinc/65/39/72/1025653972.db2.gz FQJDXDCCYRXEGP-RYUDHWBXSA-N 1 1 316.376 3.902 20 10 DHCDMO CCOCc1ccccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886496732 1025654846 /nfs/dbraw/zinc/65/48/46/1025654846.db2.gz FSECVYDIPKQSBJ-ZDUSSCGKSA-N 1 1 303.377 3.919 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000886512345 1025667711 /nfs/dbraw/zinc/66/77/11/1025667711.db2.gz CQBSFXVUUGCPED-MNOVXSKESA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1c(O)cccc1F ZINC000886513196 1025668667 /nfs/dbraw/zinc/66/86/67/1025668667.db2.gz WJIQUVSMEACDPU-GFCCVEGCSA-N 1 1 313.376 3.691 20 10 DHCDMO COCc1cc(C[NH2+][C@H](C)c2c(O)cccc2F)ccc1F ZINC000886530638 1025681784 /nfs/dbraw/zinc/68/17/84/1025681784.db2.gz OBQKZXBWOWHLTF-LLVKDONJSA-N 1 1 307.340 3.668 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCOc2c(F)cccc21)c1c(O)cccc1F ZINC000886597085 1025730080 /nfs/dbraw/zinc/73/00/80/1025730080.db2.gz VXIPSANVUWPRDJ-QMTHXVAHSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610959 1025735996 /nfs/dbraw/zinc/73/59/96/1025735996.db2.gz OKTNFDGXOXBQJR-XHDPSFHLSA-N 1 1 323.795 3.959 20 10 DHCDMO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886615632 1025741475 /nfs/dbraw/zinc/74/14/75/1025741475.db2.gz KLMSOXUDPJZIGY-UWVGGRQHSA-N 1 1 309.303 3.539 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)cc1O ZINC000806179762 1025834694 /nfs/dbraw/zinc/83/46/94/1025834694.db2.gz GZVAGKISXPYGTR-QPUJVOFHSA-N 1 1 320.177 3.993 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1c(O)cccc1F ZINC000886776842 1025898910 /nfs/dbraw/zinc/89/89/10/1025898910.db2.gz QXRPSHNRZFCNFO-GUYCJALGSA-N 1 1 307.409 3.921 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000245711973 1026151896 /nfs/dbraw/zinc/15/18/96/1026151896.db2.gz GDUHADOYZBSRBI-AZUAARDMSA-N 1 1 314.473 3.678 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c1O ZINC000289744109 1026154854 /nfs/dbraw/zinc/15/48/54/1026154854.db2.gz QIHAGTJZELWBNR-VAMGGRTRSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1C ZINC000122123866 1026172189 /nfs/dbraw/zinc/17/21/89/1026172189.db2.gz ZSPRRPJCYMICQE-KRWDZBQOSA-N 1 1 303.427 3.644 20 10 DHCDMO Cc1ccnc([C@@H](C)[NH2+]Cc2cccc(Br)c2O)c1 ZINC000289793993 1026176500 /nfs/dbraw/zinc/17/65/00/1026176500.db2.gz RYFNEWGOSGYTEO-LLVKDONJSA-N 1 1 321.218 3.709 20 10 DHCDMO C[C@@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000808190857 1026221558 /nfs/dbraw/zinc/22/15/58/1026221558.db2.gz KHRUJEJBKZXHMG-DNVCBOLYSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1Cc1c(O)ccc2ccccc21 ZINC000808190857 1026221563 /nfs/dbraw/zinc/22/15/63/1026221563.db2.gz KHRUJEJBKZXHMG-DNVCBOLYSA-N 1 1 310.441 3.604 20 10 DHCDMO COc1cc(C)cc(C[N@@H+]2Cc3cccc(Cl)c3C2)c1O ZINC000808200897 1026224586 /nfs/dbraw/zinc/22/45/86/1026224586.db2.gz KQOYZYBRUJOGGX-UHFFFAOYSA-N 1 1 303.789 3.878 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2Cc3cccc(Cl)c3C2)c1O ZINC000808200897 1026224601 /nfs/dbraw/zinc/22/46/01/1026224601.db2.gz KQOYZYBRUJOGGX-UHFFFAOYSA-N 1 1 303.789 3.878 20 10 DHCDMO CCOC1CC([N@@H+](C)Cc2c(O)ccc3ccc(OC)cc32)C1 ZINC000808212047 1026234135 /nfs/dbraw/zinc/23/41/35/1026234135.db2.gz IINZPSOXINGQPG-UHFFFAOYSA-N 1 1 315.413 3.553 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)OCCc2sccc21)c1ccc(F)cc1O ZINC000289929200 1026238611 /nfs/dbraw/zinc/23/86/11/1026238611.db2.gz VJRSPDYFXFLCPW-GTNSWQLSSA-N 1 1 321.417 3.732 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc(Cl)cc(C)c1O)C2 ZINC000289953822 1026248898 /nfs/dbraw/zinc/24/88/98/1026248898.db2.gz YTALMUJTZBQNAX-UHFFFAOYSA-N 1 1 309.837 3.745 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)NCC[N@H+](C)C2CCCC2)c1O ZINC000808691517 1026349061 /nfs/dbraw/zinc/34/90/61/1026349061.db2.gz IRYYCFHKZKOLBU-ZDUSSCGKSA-N 1 1 310.869 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)NCC[N@@H+](C)C2CCCC2)c1O ZINC000808691517 1026349073 /nfs/dbraw/zinc/34/90/73/1026349073.db2.gz IRYYCFHKZKOLBU-ZDUSSCGKSA-N 1 1 310.869 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ncnn2C(C)(C)C)c1O ZINC000808717727 1026364088 /nfs/dbraw/zinc/36/40/88/1026364088.db2.gz MCQNLSDQVQJFOX-LLVKDONJSA-N 1 1 322.840 3.551 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccccc1)c1ccc(F)cc1O ZINC000808722096 1026368789 /nfs/dbraw/zinc/36/87/89/1026368789.db2.gz YVYUTAWGRZSKFZ-PUECVXPYSA-N 1 1 303.377 3.694 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2nccs2)c(C(F)(F)F)c1 ZINC000280043713 1026581375 /nfs/dbraw/zinc/58/13/75/1026581375.db2.gz VNGNOZLKHFURMH-UHFFFAOYSA-N 1 1 315.364 3.518 20 10 DHCDMO C[C@@H](CO)[N@H+](Cc1ccc(N2CCCCC2)cc1)CC1CCC1 ZINC000809664718 1026589016 /nfs/dbraw/zinc/58/90/16/1026589016.db2.gz JAZLTXWPBLZEEJ-KRWDZBQOSA-N 1 1 316.489 3.660 20 10 DHCDMO C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809755624 1026615822 /nfs/dbraw/zinc/61/58/22/1026615822.db2.gz AHVUSBVSJAODEF-HXUWFJFHSA-N 1 1 316.489 3.804 20 10 DHCDMO Cc1cccc2c1OC[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)C2 ZINC000810259777 1026720079 /nfs/dbraw/zinc/72/00/79/1026720079.db2.gz SELCVQOAAKVECN-SMDDNHRTSA-N 1 1 319.351 3.633 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1O ZINC000811518437 1027020519 /nfs/dbraw/zinc/02/05/19/1027020519.db2.gz KMHUVLYLQLKKHI-DOTOQJQBSA-N 1 1 321.848 3.888 20 10 DHCDMO CC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCOC(C)(C)C1 ZINC000811510993 1027027581 /nfs/dbraw/zinc/02/75/81/1027027581.db2.gz BRNXCYNMPDSFDC-NSHDSACASA-N 1 1 315.816 3.964 20 10 DHCDMO CC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCOC(C)(C)C1 ZINC000811510993 1027027587 /nfs/dbraw/zinc/02/75/87/1027027587.db2.gz BRNXCYNMPDSFDC-NSHDSACASA-N 1 1 315.816 3.964 20 10 DHCDMO Cn1c2ccccc2[nH+]c1NCc1c(O)ccc2c1CCCC2 ZINC000811808387 1027089328 /nfs/dbraw/zinc/08/93/28/1027089328.db2.gz HCWZOKQUEPCUKW-UHFFFAOYSA-N 1 1 307.397 3.770 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nccn2CC)cc1F ZINC000295262929 1027165033 /nfs/dbraw/zinc/16/50/33/1027165033.db2.gz RKDCGACPVPYGPI-AWEZNQCLSA-N 1 1 318.440 3.739 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000296285786 1027598586 /nfs/dbraw/zinc/59/85/86/1027598586.db2.gz HNGMHWHUWQYHHJ-INIZCTEOSA-N 1 1 302.462 3.676 20 10 DHCDMO Clc1cnc(C[NH2+]Cc2ccc(N3CCCC3)cc2)s1 ZINC000719443181 1027610658 /nfs/dbraw/zinc/61/06/58/1027610658.db2.gz TUMQFHWDIKYPOJ-UHFFFAOYSA-N 1 1 307.850 3.687 20 10 DHCDMO C[C@@H]([NH2+]CCC(C)(C)CO)c1cc(Cl)c(Cl)cc1O ZINC000296557367 1027667319 /nfs/dbraw/zinc/66/73/19/1027667319.db2.gz RZIGBGCMFIEBHO-SECBINFHSA-N 1 1 306.233 3.758 20 10 DHCDMO C[C@@H]1C[C@@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000778984774 1027712260 /nfs/dbraw/zinc/71/22/60/1027712260.db2.gz KIECYALTLWMBOT-MJGOQNOKSA-N 1 1 316.489 3.924 20 10 DHCDMO Cc1ccoc1C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000813791106 1027714375 /nfs/dbraw/zinc/71/43/75/1027714375.db2.gz SVQPHMGDIGGDDM-UHFFFAOYSA-N 1 1 310.191 3.654 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCO[C@H](C)C2)cc1 ZINC000778995554 1027732819 /nfs/dbraw/zinc/73/28/19/1027732819.db2.gz ZFVXCJANURKEJA-AEFFLSMTSA-N 1 1 304.478 3.780 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000778999470 1027744505 /nfs/dbraw/zinc/74/45/05/1027744505.db2.gz NAFMFXJRDVHSRR-SFHVURJKSA-N 1 1 315.388 3.713 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2ccc(C)o2)C1 ZINC000364621020 1027854310 /nfs/dbraw/zinc/85/43/10/1027854310.db2.gz GIDXNIKYJMJJQV-CRAIPNDOSA-N 1 1 301.386 3.818 20 10 DHCDMO COCC(C)(C)[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000814178287 1027914307 /nfs/dbraw/zinc/91/43/07/1027914307.db2.gz KRMBVAIUVDDKBK-UHFFFAOYSA-N 1 1 318.383 3.628 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)c1 ZINC000814177526 1027914398 /nfs/dbraw/zinc/91/43/98/1027914398.db2.gz FUHQKAHEQNOEKB-CQSZACIVSA-N 1 1 313.397 3.574 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c1O ZINC000814230447 1027966325 /nfs/dbraw/zinc/96/63/25/1027966325.db2.gz QSDKLKFIYVOWFK-GOSISDBHSA-N 1 1 312.413 3.687 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000365614510 1027981175 /nfs/dbraw/zinc/98/11/75/1027981175.db2.gz UMLMTZRKEKHVDW-UKRRQHHQSA-N 1 1 305.809 3.640 20 10 DHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@@H+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170759261 1028160028 /nfs/dbraw/zinc/16/00/28/1028160028.db2.gz BDPCSQBZRKOOIU-RBJNIJBHSA-N 1 1 324.468 3.980 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321745 1028166552 /nfs/dbraw/zinc/16/65/52/1028166552.db2.gz JNNIEGKTFRGLQV-SJLPKXTDSA-N 1 1 302.462 3.794 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321745 1028166566 /nfs/dbraw/zinc/16/65/66/1028166566.db2.gz JNNIEGKTFRGLQV-SJLPKXTDSA-N 1 1 302.462 3.794 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(Br)c1O)c1cccc(O)c1 ZINC000048797093 1028251746 /nfs/dbraw/zinc/25/17/46/1028251746.db2.gz HLZUMCYZUGDPRP-JTQLQIEISA-N 1 1 322.202 3.711 20 10 DHCDMO Cc1cc(C[N@@H+]2CCOC[C@H]2c2ccccc2)ccc1N(C)C ZINC000815055322 1028335236 /nfs/dbraw/zinc/33/52/36/1028335236.db2.gz WOYCITYRISTJNL-FQEVSTJZSA-N 1 1 310.441 3.635 20 10 DHCDMO Cc1cc(C[N@H+]2CCOC[C@H]2c2ccccc2)ccc1N(C)C ZINC000815055322 1028335255 /nfs/dbraw/zinc/33/52/55/1028335255.db2.gz WOYCITYRISTJNL-FQEVSTJZSA-N 1 1 310.441 3.635 20 10 DHCDMO Cc1cc(C[N@H+](C[C@@H](C)O)C2CCCCC2)ccc1N(C)C ZINC000815035016 1028339356 /nfs/dbraw/zinc/33/93/56/1028339356.db2.gz HBIHIAFDMOXUBF-MRXNPFEDSA-N 1 1 304.478 3.577 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](O)c2ccccc2C1 ZINC000368815695 1028412013 /nfs/dbraw/zinc/41/20/13/1028412013.db2.gz GEDJBJRUEKEWKL-NRFANRHFSA-N 1 1 319.404 3.985 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC3(CCOCC3)[C@@H]2C)c1O ZINC000368819703 1028413692 /nfs/dbraw/zinc/41/36/92/1028413692.db2.gz XBDKDTAELKUHBX-ZDUSSCGKSA-N 1 1 309.837 3.745 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(F)nc2)cc1 ZINC000779147620 1028430869 /nfs/dbraw/zinc/43/08/69/1028430869.db2.gz HBJYHRKKMQPYGF-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)c1cccc(C(F)(F)F)c1O ZINC000815582244 1028553281 /nfs/dbraw/zinc/55/32/81/1028553281.db2.gz AYKYIGTWFATLKE-SDDRHHMPSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cccc(C(F)(F)F)c1O ZINC000815582883 1028554820 /nfs/dbraw/zinc/55/48/20/1028554820.db2.gz RMMXGNLQWRSIGJ-WDMOLILDSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@H]([NH2+]CC1(CCO)CCC1)c1cccc(C(F)(F)F)c1O ZINC000815597057 1028560851 /nfs/dbraw/zinc/56/08/51/1028560851.db2.gz LKLXZLOQAOHKGO-NSHDSACASA-N 1 1 317.351 3.614 20 10 DHCDMO CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815574275 1028567708 /nfs/dbraw/zinc/56/77/08/1028567708.db2.gz KRXDWKKMQXAGKR-RYUDHWBXSA-N 1 1 318.383 3.792 20 10 DHCDMO CC(C)c1cnc(C[NH2+]Cc2ccc3c(c2)CCN3C)s1 ZINC000370427193 1028598481 /nfs/dbraw/zinc/59/84/81/1028598481.db2.gz CGRWYNOGVDZUKV-UHFFFAOYSA-N 1 1 301.459 3.549 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@H](c2nc(C)cs2)C1 ZINC000372597054 1028876134 /nfs/dbraw/zinc/87/61/34/1028876134.db2.gz WOBCUEVFFHHXHI-ZBFHGGJFSA-N 1 1 318.442 3.682 20 10 DHCDMO CN(C)c1ccc(C[N@H+](C)Cc2cccc(O)c2Cl)cc1 ZINC000816477771 1028889739 /nfs/dbraw/zinc/88/97/39/1028889739.db2.gz JQLYIABPFSUALF-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc(O)c2Cl)cc1 ZINC000816477771 1028889743 /nfs/dbraw/zinc/88/97/43/1028889743.db2.gz JQLYIABPFSUALF-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO C[NH+](C)CCC1CC[NH+](Cc2ccc3ccccc3c2[O-])CC1 ZINC000816495541 1028897292 /nfs/dbraw/zinc/89/72/92/1028897292.db2.gz ZFDHXCUDSPLRON-UHFFFAOYSA-N 1 1 312.457 3.709 20 10 DHCDMO Oc1c(C[N@@H+]2CCC[C@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816492903 1028898961 /nfs/dbraw/zinc/89/89/61/1028898961.db2.gz JBXUMVKEENPHHL-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816492903 1028898975 /nfs/dbraw/zinc/89/89/75/1028898975.db2.gz JBXUMVKEENPHHL-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO CC(C)Oc1ncccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816527882 1028936478 /nfs/dbraw/zinc/93/64/78/1028936478.db2.gz COUNKAHACQKFEB-UHFFFAOYSA-N 1 1 324.783 3.657 20 10 DHCDMO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816560198 1028945159 /nfs/dbraw/zinc/94/51/59/1028945159.db2.gz HTVNEGBTOQTUND-JTQLQIEISA-N 1 1 308.784 3.993 20 10 DHCDMO CC1(C)CC[N@H+](Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000816593681 1028952213 /nfs/dbraw/zinc/95/22/13/1028952213.db2.gz AFQNBYANCSWGOJ-UHFFFAOYSA-N 1 1 303.830 3.902 20 10 DHCDMO CC1(C)CC[N@@H+](Cc2cc(Cl)c(F)cc2O)CCS1 ZINC000816593681 1028952223 /nfs/dbraw/zinc/95/22/23/1028952223.db2.gz AFQNBYANCSWGOJ-UHFFFAOYSA-N 1 1 303.830 3.902 20 10 DHCDMO CCOC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCCC1 ZINC000816642983 1028973617 /nfs/dbraw/zinc/97/36/17/1028973617.db2.gz RDKBNNPCGXBEIP-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c(O)cc1C ZINC000817363514 1029145634 /nfs/dbraw/zinc/14/56/34/1029145634.db2.gz FCIWYFZEJCDMHA-GFCCVEGCSA-N 1 1 317.351 3.874 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)Cc2cn3c(n2)CCCC3)c1O ZINC000373881575 1029158726 /nfs/dbraw/zinc/15/87/26/1029158726.db2.gz LBHUWJBVODVABW-UHFFFAOYSA-N 1 1 319.836 3.519 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2cn3c(n2)CCCC3)c1O ZINC000373881575 1029158729 /nfs/dbraw/zinc/15/87/29/1029158729.db2.gz LBHUWJBVODVABW-UHFFFAOYSA-N 1 1 319.836 3.519 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000218476964 1029196572 /nfs/dbraw/zinc/19/65/72/1029196572.db2.gz XIOAUVFQNDUHCV-SFHVURJKSA-N 1 1 311.425 3.916 20 10 DHCDMO Cc1cc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000817938117 1029282854 /nfs/dbraw/zinc/28/28/54/1029282854.db2.gz DUQYPXKLKKDKBE-FZKQIMNGSA-N 1 1 317.502 3.782 20 10 DHCDMO Cc1cccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1C ZINC000817941104 1029283519 /nfs/dbraw/zinc/28/35/19/1029283519.db2.gz IUXTZEBIDQFUDN-UZLBHIALSA-N 1 1 311.473 3.720 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1F ZINC000817942947 1029288160 /nfs/dbraw/zinc/28/81/60/1029288160.db2.gz SABKXNXJRUVSRP-OALUTQOASA-N 1 1 315.436 3.632 20 10 DHCDMO CCC([NH3+])(CC)CN[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817959612 1029298411 /nfs/dbraw/zinc/29/84/11/1029298411.db2.gz DKKVGVWEVZQKER-MRXNPFEDSA-N 1 1 303.494 3.845 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccc(F)cc1O ZINC000817975329 1029313142 /nfs/dbraw/zinc/31/31/42/1029313142.db2.gz LACJEBXBRGPWBC-GFCCVEGCSA-N 1 1 300.377 3.740 20 10 DHCDMO CC[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817984666 1029321082 /nfs/dbraw/zinc/32/10/82/1029321082.db2.gz XDSWRKHTUSTGFF-AWEZNQCLSA-N 1 1 316.367 3.594 20 10 DHCDMO c1cc([C@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)n[nH]1 ZINC000121180280 1029539857 /nfs/dbraw/zinc/53/98/57/1029539857.db2.gz JMLHLIJVFCBPST-SFHVURJKSA-N 1 1 324.472 3.780 20 10 DHCDMO c1cc([C@H]2CCC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)[nH]n1 ZINC000121180280 1029539864 /nfs/dbraw/zinc/53/98/64/1029539864.db2.gz JMLHLIJVFCBPST-SFHVURJKSA-N 1 1 324.472 3.780 20 10 DHCDMO c1cc([C@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)[nH]n1 ZINC000121180280 1029539868 /nfs/dbraw/zinc/53/98/68/1029539868.db2.gz JMLHLIJVFCBPST-SFHVURJKSA-N 1 1 324.472 3.780 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c1 ZINC000819902609 1029623240 /nfs/dbraw/zinc/62/32/40/1029623240.db2.gz GIHBSJOVZLABQB-LJQANCHMSA-N 1 1 315.457 3.790 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)c1ccc(Cl)c(Cl)c1[O-] ZINC000530215824 1029785116 /nfs/dbraw/zinc/78/51/16/1029785116.db2.gz JLKGQSYPUOXNTL-CABZTGNLSA-N 1 1 315.244 3.634 20 10 DHCDMO CCc1nnc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)s1 ZINC000290154161 1029919598 /nfs/dbraw/zinc/91/95/98/1029919598.db2.gz LLLZXHSDIFHLBV-NSHDSACASA-N 1 1 317.458 3.536 20 10 DHCDMO CC[N@@H+](Cc1cncn1C(C)C)Cc1ccc(N(C)C)cc1 ZINC000822438650 1030022188 /nfs/dbraw/zinc/02/21/88/1030022188.db2.gz MERLWBLMMYWNBH-UHFFFAOYSA-N 1 1 300.450 3.552 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(Cl)cc1O ZINC000841759363 1030216504 /nfs/dbraw/zinc/21/65/04/1030216504.db2.gz YYISMYMESBFERS-VXGBXAGGSA-N 1 1 303.789 3.872 20 10 DHCDMO CC[N@@H+](Cc1cc2cccnc2o1)Cc1ccc(N(C)C)cc1 ZINC000823375434 1030271264 /nfs/dbraw/zinc/27/12/64/1030271264.db2.gz QWCRFEBVOFIUJI-UHFFFAOYSA-N 1 1 309.413 3.916 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1 ZINC000823439129 1030288109 /nfs/dbraw/zinc/28/81/09/1030288109.db2.gz ZIESZGIKRCNAFG-KRWDZBQOSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@@H](C)O[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000866446312 1030299903 /nfs/dbraw/zinc/29/99/03/1030299903.db2.gz FKRYJWRFCIMGGT-COMAGPEQSA-N 1 1 303.324 3.628 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000866518244 1030342105 /nfs/dbraw/zinc/34/21/05/1030342105.db2.gz VSPWEWFMJHLMAZ-CLXDAAKHSA-N 1 1 320.452 3.932 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)cc1[N+](=O)[O-] ZINC000866540845 1030360709 /nfs/dbraw/zinc/36/07/09/1030360709.db2.gz SEDSJQPSNSBVPB-JTQLQIEISA-N 1 1 322.311 3.738 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1n1ccnc1 ZINC000121626568 1030447736 /nfs/dbraw/zinc/44/77/36/1030447736.db2.gz SLIMOMTWXNTFOL-KXBFYZLASA-N 1 1 321.424 3.825 20 10 DHCDMO CCOc1cccc(C[N@@H+](CC)[C@H]2CCOC(C)(C)C2)c1O ZINC000291469568 1030516213 /nfs/dbraw/zinc/51/62/13/1030516213.db2.gz DTEDJPVREJDPQE-HNNXBMFYSA-N 1 1 307.434 3.570 20 10 DHCDMO CC[N@@H+](Cc1cc(COC)cs1)Cc1ccc(N(C)C)cc1 ZINC000824485037 1030564655 /nfs/dbraw/zinc/56/46/55/1030564655.db2.gz ZFPFIFONWJZFGH-UHFFFAOYSA-N 1 1 318.486 3.983 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824697032 1030602573 /nfs/dbraw/zinc/60/25/73/1030602573.db2.gz YANNKMKNHXJYID-ZMSDIMECSA-N 1 1 309.837 3.561 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824893092 1030661004 /nfs/dbraw/zinc/66/10/04/1030661004.db2.gz KBAVRHMIBQCXFN-ZBFHGGJFSA-N 1 1 321.848 3.827 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1Cl ZINC000824894554 1030661470 /nfs/dbraw/zinc/66/14/70/1030661470.db2.gz HOHHWAFXYSRFRZ-OAHLLOKOSA-N 1 1 322.880 3.518 20 10 DHCDMO COC[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000825321773 1030775804 /nfs/dbraw/zinc/77/58/04/1030775804.db2.gz NJHQWNIJAGGIGV-IBGZPJMESA-N 1 1 316.489 3.925 20 10 DHCDMO OCCC[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000825338065 1030780856 /nfs/dbraw/zinc/78/08/56/1030780856.db2.gz LAYVCCUMOIMASC-INIZCTEOSA-N 1 1 311.425 3.654 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C2CCC(C[NH+](C)C)CC2)cc1Cl ZINC000825371042 1030794627 /nfs/dbraw/zinc/79/46/27/1030794627.db2.gz SPQTVHRTQLXPBD-UHFFFAOYSA-N 1 1 310.869 3.564 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1ccc(Cl)cc1O ZINC000926961263 1031020067 /nfs/dbraw/zinc/02/00/67/1031020067.db2.gz XUSUQPUKYPQRKA-TVQRCGJNSA-N 1 1 324.774 3.579 20 10 DHCDMO Cc1nc2c(cccc2CC[NH2+][C@H](C)c2ccc(F)cc2O)o1 ZINC000926974456 1031021058 /nfs/dbraw/zinc/02/10/58/1031021058.db2.gz LKQFSPAUYKHYHL-LLVKDONJSA-N 1 1 314.360 3.874 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1OCCc2ccccc21)c1c(O)cccc1F ZINC000927113510 1031098458 /nfs/dbraw/zinc/09/84/58/1031098458.db2.gz ZNTNSOCGJORDLM-SCLBCKFNSA-N 1 1 315.388 3.886 20 10 DHCDMO CC[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144300215 1031431061 /nfs/dbraw/zinc/43/10/61/1031431061.db2.gz XNHWKHBQSKHKJJ-SNVBAGLBSA-N 1 1 302.187 3.668 20 10 DHCDMO CC[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144300215 1031431071 /nfs/dbraw/zinc/43/10/71/1031431071.db2.gz XNHWKHBQSKHKJJ-SNVBAGLBSA-N 1 1 302.187 3.668 20 10 DHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144298540 1031436601 /nfs/dbraw/zinc/43/66/01/1031436601.db2.gz GEGKGTFCRXUQOH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144298540 1031436615 /nfs/dbraw/zinc/43/66/15/1031436615.db2.gz GEGKGTFCRXUQOH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144298540 1031436626 /nfs/dbraw/zinc/43/66/26/1031436626.db2.gz GEGKGTFCRXUQOH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)[C@@H](O)c1ccccc1 ZINC000872134447 1031528399 /nfs/dbraw/zinc/52/83/99/1031528399.db2.gz WFWYLNNCBMDPDY-PUECVXPYSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000123990983 1031555362 /nfs/dbraw/zinc/55/53/62/1031555362.db2.gz IXIWVKMWRWYGJY-ZDUSSCGKSA-N 1 1 302.393 3.790 20 10 DHCDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000124021685 1031570413 /nfs/dbraw/zinc/57/04/13/1031570413.db2.gz UPOCOQFCWJTMEN-INIZCTEOSA-N 1 1 308.441 3.673 20 10 DHCDMO Cc1noc(C)c1[C@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293689843 1031573073 /nfs/dbraw/zinc/57/30/73/1031573073.db2.gz SDYTXXRELGDGQY-MRVPVSSYSA-N 1 1 312.772 3.683 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c(O)c1 ZINC001144509274 1031664247 /nfs/dbraw/zinc/66/42/47/1031664247.db2.gz RMPCDXYOYCJWLG-HNNXBMFYSA-N 1 1 319.788 3.794 20 10 DHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc4c(cc3O)CCC4)C2)n1 ZINC000872807513 1031664341 /nfs/dbraw/zinc/66/43/41/1031664341.db2.gz SUQVPFAAISMELQ-HNNXBMFYSA-N 1 1 314.454 3.635 20 10 DHCDMO CC[C@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144514857 1031672062 /nfs/dbraw/zinc/67/20/62/1031672062.db2.gz VDDYMVKKLDOSKN-UGSOOPFHSA-N 1 1 323.433 3.567 20 10 DHCDMO CCCOc1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C ZINC000873014454 1031692981 /nfs/dbraw/zinc/69/29/81/1031692981.db2.gz RONAPINCOHFKHW-QZTJIDSGSA-N 1 1 302.462 3.500 20 10 DHCDMO CCCOc1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C ZINC000873014454 1031692987 /nfs/dbraw/zinc/69/29/87/1031692987.db2.gz RONAPINCOHFKHW-QZTJIDSGSA-N 1 1 302.462 3.500 20 10 DHCDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3cccc(C)c3O)C2)s1 ZINC000361049923 1031697179 /nfs/dbraw/zinc/69/71/79/1031697179.db2.gz TXGRNPCCEQTALT-OAHLLOKOSA-N 1 1 302.443 3.845 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)c1 ZINC000930216372 1031738735 /nfs/dbraw/zinc/73/87/35/1031738735.db2.gz GJCLXIVQQJBKHA-NSHDSACASA-N 1 1 304.390 3.537 20 10 DHCDMO COc1cc(O)c(CNc2ccc(C3CCC3)c[nH+]2)cc1OC ZINC000294160571 1031836780 /nfs/dbraw/zinc/83/67/80/1031836780.db2.gz VXUKWLNSUJEJJF-UHFFFAOYSA-N 1 1 314.385 3.684 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(F)c(F)cc1[O-] ZINC001142527130 1031907780 /nfs/dbraw/zinc/90/77/80/1031907780.db2.gz LSSRNZXEACKRPT-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(F)c(F)cc1O ZINC001142527130 1031907792 /nfs/dbraw/zinc/90/77/92/1031907792.db2.gz LSSRNZXEACKRPT-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(F)c(F)cc1O ZINC001142527130 1031907799 /nfs/dbraw/zinc/90/77/99/1031907799.db2.gz LSSRNZXEACKRPT-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO C[C@H](COCC1CC1)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000846205378 1031908736 /nfs/dbraw/zinc/90/87/36/1031908736.db2.gz PGJMRXQAGGJGKP-GHMZBOCLSA-N 1 1 317.351 3.877 20 10 DHCDMO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001142527511 1031911513 /nfs/dbraw/zinc/91/15/13/1031911513.db2.gz XKWMBDZIFALVLG-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001142527511 1031911525 /nfs/dbraw/zinc/91/15/25/1031911525.db2.gz XKWMBDZIFALVLG-LLVKDONJSA-N 1 1 307.340 3.872 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000898319501 1032020529 /nfs/dbraw/zinc/02/05/29/1032020529.db2.gz GQFPVUSDHIUPLZ-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000898323180 1032023009 /nfs/dbraw/zinc/02/30/09/1032023009.db2.gz ZBVWWGFZYDJVNK-MRXNPFEDSA-N 1 1 306.768 3.821 20 10 DHCDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877508910 1033330105 /nfs/dbraw/zinc/33/01/05/1033330105.db2.gz FJZOKQHLMOCDNB-OXQOHEQNSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000877507970 1033331985 /nfs/dbraw/zinc/33/19/85/1033331985.db2.gz TWUFLSIOCFVSDH-UONOGXRCSA-N 1 1 300.229 3.716 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CCC(=O)OC(C)C ZINC001172762134 1033357102 /nfs/dbraw/zinc/35/71/02/1033357102.db2.gz IHHFXTXQJIUNSG-INIZCTEOSA-N 1 1 320.477 3.695 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC(C)(C)C1 ZINC000877590258 1033372168 /nfs/dbraw/zinc/37/21/68/1033372168.db2.gz VOZQDLQJBCNXCP-UHFFFAOYSA-N 1 1 316.489 3.658 20 10 DHCDMO CC1(C)OCc2cc(C[N@@H+]3Cc4cccc(O)c4C3)ccc2O1 ZINC000877703164 1033417818 /nfs/dbraw/zinc/41/78/18/1033417818.db2.gz UHKZMQADNUFSMW-UHFFFAOYSA-N 1 1 311.381 3.553 20 10 DHCDMO CC1(C)OCc2cc(C[N@H+]3Cc4cccc(O)c4C3)ccc2O1 ZINC000877703164 1033417824 /nfs/dbraw/zinc/41/78/24/1033417824.db2.gz UHKZMQADNUFSMW-UHFFFAOYSA-N 1 1 311.381 3.553 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](c3nc(C)cs3)C2)c1 ZINC000877814192 1033466663 /nfs/dbraw/zinc/46/66/63/1033466663.db2.gz VSQULXCNRURIEA-CYBMUJFWSA-N 1 1 318.442 3.545 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@@H](C(F)(F)F)O1 ZINC000877824117 1033473580 /nfs/dbraw/zinc/47/35/80/1033473580.db2.gz OVVLNYMMSORTJT-ZANVPECISA-N 1 1 323.742 3.587 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000777221949 1033719925 /nfs/dbraw/zinc/71/99/25/1033719925.db2.gz OKTMAFNNTNZINM-HXUWFJFHSA-N 1 1 309.409 3.670 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CCCCC(=O)OC ZINC001173459630 1033752760 /nfs/dbraw/zinc/75/27/60/1033752760.db2.gz DGOCQXLDVXSEKX-MRXNPFEDSA-N 1 1 320.477 3.696 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000862211139 1033781833 /nfs/dbraw/zinc/78/18/33/1033781833.db2.gz CRRDUMMDOPAEQJ-AWEZNQCLSA-N 1 1 321.218 3.820 20 10 DHCDMO CC1(CC(F)F)C[NH+](Cc2c(O)cccc2Br)C1 ZINC000862399871 1033841802 /nfs/dbraw/zinc/84/18/02/1033841802.db2.gz FRASEEJMSXUDEX-UHFFFAOYSA-N 1 1 320.177 3.632 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1F ZINC000862473131 1033863887 /nfs/dbraw/zinc/86/38/87/1033863887.db2.gz FODDLDAMYGQOMC-OLZOCXBDSA-N 1 1 312.429 3.501 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)c1 ZINC000862529166 1033873125 /nfs/dbraw/zinc/87/31/25/1033873125.db2.gz PCGHLPIPVSQEJM-ZYSHUDEJSA-N 1 1 309.409 3.636 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]3CC[C@@H](C1)S3)CCCC2 ZINC000863294489 1034058314 /nfs/dbraw/zinc/05/83/14/1034058314.db2.gz FCFUEIGFWFYXCR-SJORKVTESA-N 1 1 303.471 3.741 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1nc(Cc2ccccc2)no1 ZINC000879650960 1034074536 /nfs/dbraw/zinc/07/45/36/1034074536.db2.gz AACPIZSIMBKGKR-UONOGXRCSA-N 1 1 323.396 3.778 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000863543548 1034124110 /nfs/dbraw/zinc/12/41/10/1034124110.db2.gz QKAGCQFRUVPFDV-FRRDWIJNSA-N 1 1 317.260 3.880 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2F)cc1OC ZINC000179677343 1034325749 /nfs/dbraw/zinc/32/57/49/1034325749.db2.gz RJWPLUZCUAELLJ-LBPRGKRZSA-N 1 1 319.376 3.742 20 10 DHCDMO C[C@H](c1cnccn1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000184412189 1034473688 /nfs/dbraw/zinc/47/36/88/1034473688.db2.gz JTILBKMPDVFCIX-MRXNPFEDSA-N 1 1 310.445 3.660 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cc1O ZINC000185004982 1034519314 /nfs/dbraw/zinc/51/93/14/1034519314.db2.gz NUNMPMTZPAFYMI-CQSZACIVSA-N 1 1 314.404 3.982 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(F)cc1O ZINC000186354928 1034623780 /nfs/dbraw/zinc/62/37/80/1034623780.db2.gz VAVJYOITHPVARW-HWHUXHBOSA-N 1 1 305.393 3.530 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c(O)c1 ZINC000186809377 1034663968 /nfs/dbraw/zinc/66/39/68/1034663968.db2.gz ZMIRIJONFDMAEY-ZDUSSCGKSA-N 1 1 318.417 3.855 20 10 DHCDMO Cc1cc(O)c(CNC[C@H](C)[N@@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC001177278134 1035363081 /nfs/dbraw/zinc/36/30/81/1035363081.db2.gz RZUAPJAGRCYLCF-KBPBESRZSA-N 1 1 310.869 3.707 20 10 DHCDMO Cc1cc(O)c(CNC[C@H](C)[N@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC001177278134 1035363086 /nfs/dbraw/zinc/36/30/86/1035363086.db2.gz RZUAPJAGRCYLCF-KBPBESRZSA-N 1 1 310.869 3.707 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)cc1 ZINC000773750883 1035436336 /nfs/dbraw/zinc/43/63/36/1035436336.db2.gz FNQBCRFSNAQOEW-FQEVSTJZSA-N 1 1 312.457 3.698 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)CC)cc2)CC1 ZINC000773755439 1035438284 /nfs/dbraw/zinc/43/82/84/1035438284.db2.gz JITFUSTVMROHCY-LJQANCHMSA-N 1 1 304.478 3.924 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000773766724 1035442914 /nfs/dbraw/zinc/44/29/14/1035442914.db2.gz UWOIACXACMWWIW-GOSISDBHSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000773766724 1035442917 /nfs/dbraw/zinc/44/29/17/1035442917.db2.gz UWOIACXACMWWIW-GOSISDBHSA-N 1 1 316.470 3.778 20 10 DHCDMO COC[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232384 1035453164 /nfs/dbraw/zinc/45/31/64/1035453164.db2.gz BSWWYKPKSJVHMV-KRWDZBQOSA-N 1 1 312.457 3.907 20 10 DHCDMO c1cc(CNC[C@@H]2CC[N@@H+]2C2CCCCCC2)cc2c1OCC2 ZINC001179386947 1035476696 /nfs/dbraw/zinc/47/66/96/1035476696.db2.gz WPWDNCGPSHGMMR-IBGZPJMESA-N 1 1 314.473 3.508 20 10 DHCDMO c1cc(CNC[C@@H]2CC[N@H+]2C2CCCCCC2)cc2c1OCC2 ZINC001179386947 1035476697 /nfs/dbraw/zinc/47/66/97/1035476697.db2.gz WPWDNCGPSHGMMR-IBGZPJMESA-N 1 1 314.473 3.508 20 10 DHCDMO CCN(C)c1ccc(C[NH+]2CCC(c3cc(C)[nH]n3)CC2)cc1 ZINC000773819050 1035488069 /nfs/dbraw/zinc/48/80/69/1035488069.db2.gz NXSXVBBCEDYBQZ-UHFFFAOYSA-N 1 1 312.461 3.554 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2C2CCOCC2)cc1 ZINC000773837046 1035518733 /nfs/dbraw/zinc/51/87/33/1035518733.db2.gz XXNANYVLFXIWCJ-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(N(C)C)cc2C)CCO1 ZINC001180120240 1035605096 /nfs/dbraw/zinc/60/50/96/1035605096.db2.gz GJCDRICTQRVITL-NRFANRHFSA-N 1 1 324.468 3.943 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCN(C)c3ccccc3C2)cc1 ZINC001180213039 1035624313 /nfs/dbraw/zinc/62/43/13/1035624313.db2.gz NNHFNDNBHSZOHV-SREVYHEPSA-N 1 1 321.468 3.718 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCCC[C@H]2C(C)C)cc1OC ZINC001180331433 1035657617 /nfs/dbraw/zinc/65/76/17/1035657617.db2.gz GIJDWENRAYTXLN-HNNXBMFYSA-N 1 1 307.434 3.810 20 10 DHCDMO CCc1cc(C[N@@H+]2CC[C@H](CN(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144170 1035768004 /nfs/dbraw/zinc/76/80/04/1035768004.db2.gz ZWLAMTJYIIWUJM-MRXNPFEDSA-N 1 1 318.505 3.636 20 10 DHCDMO CCc1cc(C[N@H+]2CC[C@H](CN(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144170 1035768013 /nfs/dbraw/zinc/76/80/13/1035768013.db2.gz ZWLAMTJYIIWUJM-MRXNPFEDSA-N 1 1 318.505 3.636 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H](O)c1ccccc1 ZINC001181419302 1035905694 /nfs/dbraw/zinc/90/56/94/1035905694.db2.gz YVOBMYJTTBYGQK-AEFFLSMTSA-N 1 1 321.367 3.662 20 10 DHCDMO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(N(C)C)cc1C)CCO2 ZINC001181674267 1035963563 /nfs/dbraw/zinc/96/35/63/1035963563.db2.gz OWACEOSYDVQSBO-UHFFFAOYSA-N 1 1 310.441 3.764 20 10 DHCDMO CN(C)c1ccc(/C=C/CN2CC[N@@H+](C)Cc3ccccc32)cc1 ZINC001181988223 1036059921 /nfs/dbraw/zinc/05/99/21/1036059921.db2.gz XINBSTNKGWRUDY-VOTSOKGWSA-N 1 1 321.468 3.718 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccco1)c1cc(Cl)c(Cl)cc1O ZINC000774115005 1036157409 /nfs/dbraw/zinc/15/74/09/1036157409.db2.gz JJDFBXIYULBZEV-AMIZOPFISA-N 1 1 316.184 3.676 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCC[C@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000774189439 1036215707 /nfs/dbraw/zinc/21/57/07/1036215707.db2.gz XMJAHRBYHJXNDL-ZEGGKSINSA-N 1 1 304.217 3.653 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207488 1036230011 /nfs/dbraw/zinc/23/00/11/1036230011.db2.gz VUYBQELILONETQ-OUAUKWLOSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207488 1036230029 /nfs/dbraw/zinc/23/00/29/1036230029.db2.gz VUYBQELILONETQ-OUAUKWLOSA-N 1 1 317.260 3.832 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2cccc(F)c2)C(C)C)c1 ZINC000775652669 1036244698 /nfs/dbraw/zinc/24/46/98/1036244698.db2.gz PFJSIQOJKRBFFX-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1cn[nH]c1 ZINC000774267088 1036269704 /nfs/dbraw/zinc/26/97/04/1036269704.db2.gz SKJDMZFGFXVMSL-YUMQZZPRSA-N 1 1 300.189 3.834 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCc3ccc(O)cc3CC2)c1O ZINC000775666350 1036298942 /nfs/dbraw/zinc/29/89/42/1036298942.db2.gz WFCFYYJXVVQKSN-UHFFFAOYSA-N 1 1 317.816 3.660 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@H]2C2CCC2)c1O ZINC001195825261 1036360436 /nfs/dbraw/zinc/36/04/36/1036360436.db2.gz FERBSCJUMGNIAD-KRWDZBQOSA-N 1 1 305.393 3.889 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@H]2C2CCC2)c1O ZINC001195825261 1036360455 /nfs/dbraw/zinc/36/04/55/1036360455.db2.gz FERBSCJUMGNIAD-KRWDZBQOSA-N 1 1 305.393 3.889 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000774497385 1036361454 /nfs/dbraw/zinc/36/14/54/1036361454.db2.gz OFTLJKNLRNCVMS-WBMJQRKESA-N 1 1 318.436 3.544 20 10 DHCDMO Cc1cccc(C[N@@H+]2CC[C@H](C)N(Cc3ccccc3)CC2)c1O ZINC000775727008 1036573179 /nfs/dbraw/zinc/57/31/79/1036573179.db2.gz DXVNSHQNEURCTN-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)c1O ZINC000775727008 1036573188 /nfs/dbraw/zinc/57/31/88/1036573188.db2.gz DXVNSHQNEURCTN-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)c1O ZINC000775727008 1036573200 /nfs/dbraw/zinc/57/32/00/1036573200.db2.gz DXVNSHQNEURCTN-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1O ZINC000775726669 1036576952 /nfs/dbraw/zinc/57/69/52/1036576952.db2.gz WBGVHWHMTCOMSQ-CQSZACIVSA-N 1 1 309.837 3.603 20 10 DHCDMO CCC(O)(CC)C[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001196684940 1036597088 /nfs/dbraw/zinc/59/70/88/1036597088.db2.gz QNOYLOKGOIMOIR-UHFFFAOYSA-N 1 1 318.505 3.968 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@@H]3CC=CC[C@@H]3C2)c1[O-] ZINC001197020908 1036673175 /nfs/dbraw/zinc/67/31/75/1036673175.db2.gz LTQYEMOUIVMPKD-BETUJISGSA-N 1 1 305.805 3.646 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)c1O ZINC001197020908 1036673187 /nfs/dbraw/zinc/67/31/87/1036673187.db2.gz LTQYEMOUIVMPKD-BETUJISGSA-N 1 1 305.805 3.646 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@@H]3CC=CC[C@@H]3C2)c1O ZINC001197020908 1036673195 /nfs/dbraw/zinc/67/31/95/1036673195.db2.gz LTQYEMOUIVMPKD-BETUJISGSA-N 1 1 305.805 3.646 20 10 DHCDMO C[C@H](CCOCc1ccccc1)[NH2+]Cc1c(O)cccc1F ZINC001183918703 1036712578 /nfs/dbraw/zinc/71/25/78/1036712578.db2.gz BUAMFNYGIVJQES-CQSZACIVSA-N 1 1 303.377 3.616 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H]2CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774863513 1037131692 /nfs/dbraw/zinc/13/16/92/1037131692.db2.gz OEYKXMZNVWQFHC-CYBMUJFWSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H]2CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774863513 1037131697 /nfs/dbraw/zinc/13/16/97/1037131697.db2.gz OEYKXMZNVWQFHC-CYBMUJFWSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774886892 1037168193 /nfs/dbraw/zinc/16/81/93/1037168193.db2.gz XZHYYLVVNCKWEG-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@H](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774886892 1037168197 /nfs/dbraw/zinc/16/81/97/1037168197.db2.gz XZHYYLVVNCKWEG-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO CCC[C@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774906290 1037199305 /nfs/dbraw/zinc/19/93/05/1037199305.db2.gz WZRHRWGDWKSFIB-QGZVFWFLSA-N 1 1 322.405 3.711 20 10 DHCDMO CCC[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000774906290 1037199315 /nfs/dbraw/zinc/19/93/15/1037199315.db2.gz WZRHRWGDWKSFIB-QGZVFWFLSA-N 1 1 322.405 3.711 20 10 DHCDMO C[C@H]1CCCC[C@@H]1OCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001199275763 1037240855 /nfs/dbraw/zinc/24/08/55/1037240855.db2.gz MDLVDVIQOSLKNC-NHYWBVRUSA-N 1 1 315.816 3.870 20 10 DHCDMO CC[C@]1(C)COCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775982012 1037280239 /nfs/dbraw/zinc/28/02/39/1037280239.db2.gz XHMOYFRNSWPGPB-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000776014251 1037300355 /nfs/dbraw/zinc/30/03/55/1037300355.db2.gz QQNQWGWHDSWUSP-ZWNOBZJWSA-N 1 1 303.324 3.564 20 10 DHCDMO CCOc1ccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c(O)c1 ZINC000776015048 1037309274 /nfs/dbraw/zinc/30/92/74/1037309274.db2.gz TTWVSLASMZFGPY-UHFFFAOYSA-N 1 1 309.409 3.838 20 10 DHCDMO Cc1c2ccccc2n(C)c1CNC1CC[NH+](C2CCC2)CC1 ZINC001199784757 1037337691 /nfs/dbraw/zinc/33/76/91/1037337691.db2.gz VVBOPZKSCGNFSJ-UHFFFAOYSA-N 1 1 311.473 3.593 20 10 DHCDMO Cc1c2ccccc2n(C)c1C[NH2+]C1CCN(C2CCC2)CC1 ZINC001199784757 1037337701 /nfs/dbraw/zinc/33/77/01/1037337701.db2.gz VVBOPZKSCGNFSJ-UHFFFAOYSA-N 1 1 311.473 3.593 20 10 DHCDMO C[C@H]1CCC[N@@H+](C(C)(C)CNCc2c(O)cccc2Cl)C1 ZINC000776044007 1037400583 /nfs/dbraw/zinc/40/05/83/1037400583.db2.gz YWZUNPQSOOMCOG-ZDUSSCGKSA-N 1 1 310.869 3.646 20 10 DHCDMO C[C@H]1CCC[N@H+](C(C)(C)CNCc2c(O)cccc2Cl)C1 ZINC000776044007 1037400594 /nfs/dbraw/zinc/40/05/94/1037400594.db2.gz YWZUNPQSOOMCOG-ZDUSSCGKSA-N 1 1 310.869 3.646 20 10 DHCDMO COc1c(O)c(C[NH2+]CCC2=CCCCCC2)ccc1[N+](=O)[O-] ZINC000775068258 1037543439 /nfs/dbraw/zinc/54/34/39/1037543439.db2.gz JQJVATAAJNKGOE-UHFFFAOYSA-N 1 1 320.389 3.679 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cc(C)ccc2F)c(O)c1 ZINC000775168211 1037915480 /nfs/dbraw/zinc/91/54/80/1037915480.db2.gz NKNRFTFWWSFAOU-UHFFFAOYSA-N 1 1 303.377 3.870 20 10 DHCDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775175332 1037917822 /nfs/dbraw/zinc/91/78/22/1037917822.db2.gz HIXWLHXEJBLYBW-FQEVSTJZSA-N 1 1 316.489 3.804 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ncccc2C(F)(F)F)cc1 ZINC000156469633 1038122628 /nfs/dbraw/zinc/12/26/28/1038122628.db2.gz YQGQKFTXZBMWGE-UHFFFAOYSA-N 1 1 323.362 3.798 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000917073898 1038160850 /nfs/dbraw/zinc/16/08/50/1038160850.db2.gz HAUBHROTRIELID-UHFFFAOYSA-N 1 1 310.441 3.926 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cc1 ZINC000917073964 1038162044 /nfs/dbraw/zinc/16/20/44/1038162044.db2.gz KDIYIJPCGZUILX-UHFFFAOYSA-N 1 1 310.441 3.926 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCOC3(CCCC3)C2)c1 ZINC000164520639 1038204676 /nfs/dbraw/zinc/20/46/76/1038204676.db2.gz ZHYPZSPZZHLVNF-UHFFFAOYSA-N 1 1 319.445 3.540 20 10 DHCDMO COc1cc(C)cc(C[N@@H+]2CCc3c(F)cc(F)cc3C2)c1O ZINC000164522999 1038205304 /nfs/dbraw/zinc/20/53/04/1038205304.db2.gz XHSSAERDYQKXNK-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCc3c(F)cc(F)cc3C2)c1O ZINC000164522999 1038205316 /nfs/dbraw/zinc/20/53/16/1038205316.db2.gz XHSSAERDYQKXNK-UHFFFAOYSA-N 1 1 319.351 3.546 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nccn2CC(C)C)cc1 ZINC000164771260 1038304381 /nfs/dbraw/zinc/30/43/81/1038304381.db2.gz ULEFOGGYNYQVBB-INIZCTEOSA-N 1 1 314.477 3.846 20 10 DHCDMO Cc1nsc(C)c1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001190444768 1038311261 /nfs/dbraw/zinc/31/12/61/1038311261.db2.gz CFWFYGYSKNSQNX-UHFFFAOYSA-N 1 1 315.486 3.991 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCC(C)(C)O1 ZINC001190436924 1038315963 /nfs/dbraw/zinc/31/59/63/1038315963.db2.gz OLALPACYQFBINT-GOSISDBHSA-N 1 1 304.478 3.921 20 10 DHCDMO CC[C@H]([NH2+]Cc1csc(N(C)C)n1)c1ccc(N(C)C)cc1 ZINC000157096344 1038505836 /nfs/dbraw/zinc/50/58/36/1038505836.db2.gz DEFXDADFADAODN-INIZCTEOSA-N 1 1 318.490 3.516 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273491833 130128516 /nfs/dbraw/zinc/12/85/16/130128516.db2.gz NKXPKYACSRHRPX-HKUYNNGSSA-N 1 1 315.388 3.883 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc2ccccc2c1O ZINC000273515507 130130771 /nfs/dbraw/zinc/13/07/71/130130771.db2.gz SNAOSQWFAQVIJL-PXAZEXFGSA-N 1 1 307.397 3.997 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(NC(C)=O)cc1)c1ccc(F)cc1O ZINC000285543438 131179714 /nfs/dbraw/zinc/17/97/14/131179714.db2.gz GBDNYTQPDBQETB-KRWDZBQOSA-N 1 1 316.376 3.731 20 10 DHCDMO CCOCc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000184990046 333203262 /nfs/dbraw/zinc/20/32/62/333203262.db2.gz RYNUAUCFEHLMRS-ZDUSSCGKSA-N 1 1 303.377 3.919 20 10 DHCDMO C[C@H](CCO)CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000297269542 335152241 /nfs/dbraw/zinc/15/22/41/335152241.db2.gz KQPFMRVRQYEKIF-UWVGGRQHSA-N 1 1 306.233 3.758 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc([N+](=O)[O-])cc1 ZINC000297255474 335152258 /nfs/dbraw/zinc/15/22/58/335152258.db2.gz JOSHWXUHRQEIQQ-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO CC[C@@H]([NH2+]C[C@](C)(O)c1ccsc1)c1ccc(F)cc1O ZINC000286244421 334152139 /nfs/dbraw/zinc/15/21/39/334152139.db2.gz UCTZUHMYANZRCD-ZBFHGGJFSA-N 1 1 309.406 3.541 20 10 DHCDMO c1ccc2[nH+]c(NCc3ccc(N4CCSCC4)cc3)[nH]c2c1 ZINC000301849661 336333939 /nfs/dbraw/zinc/33/39/39/336333939.db2.gz AKWMFGFDJQWTTF-UHFFFAOYSA-N 1 1 324.453 3.728 20 10 DHCDMO C[C@H](Nc1[nH]c2ccccc2[nH+]1)c1ccc(N2CCOCC2)cc1 ZINC000301873851 336335537 /nfs/dbraw/zinc/33/55/37/336335537.db2.gz JNFGGYTZAOGGGR-AWEZNQCLSA-N 1 1 322.412 3.573 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000375255467 337006680 /nfs/dbraw/zinc/00/66/80/337006680.db2.gz GNAJJCICETUFCD-RDJZCZTQSA-N 1 1 313.445 3.532 20 10 DHCDMO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)n1 ZINC000375354556 337008991 /nfs/dbraw/zinc/00/89/91/337008991.db2.gz SZMMDQBOKIHVNN-SFHVURJKSA-N 1 1 310.445 3.737 20 10 DHCDMO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCCCC3)cc2)n1 ZINC000375354556 337008992 /nfs/dbraw/zinc/00/89/92/337008992.db2.gz SZMMDQBOKIHVNN-SFHVURJKSA-N 1 1 310.445 3.737 20 10 DHCDMO COc1cccc(C[N@H+]2CCSC[C@H]2c2cccs2)c1O ZINC000377251314 337049474 /nfs/dbraw/zinc/04/94/74/337049474.db2.gz PXTPPXHJJBQZSF-ZDUSSCGKSA-N 1 1 321.467 3.752 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000377615652 337056364 /nfs/dbraw/zinc/05/63/64/337056364.db2.gz MZDWLXVAXLBXMD-LSDHHAIUSA-N 1 1 301.390 3.762 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000377615652 337056365 /nfs/dbraw/zinc/05/63/65/337056365.db2.gz MZDWLXVAXLBXMD-LSDHHAIUSA-N 1 1 301.390 3.762 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000377615651 337056374 /nfs/dbraw/zinc/05/63/74/337056374.db2.gz MZDWLXVAXLBXMD-HUUCEWRRSA-N 1 1 301.390 3.762 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000377615651 337056375 /nfs/dbraw/zinc/05/63/75/337056375.db2.gz MZDWLXVAXLBXMD-HUUCEWRRSA-N 1 1 301.390 3.762 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@@H+](C)[C@H]2CCCc3cccnc32)c1 ZINC000377690677 337058535 /nfs/dbraw/zinc/05/85/35/337058535.db2.gz DMOVQCHGKMYQQO-GUYCJALGSA-N 1 1 312.413 3.866 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000377835782 337062014 /nfs/dbraw/zinc/06/20/14/337062014.db2.gz WLVGGUYVJYCQJA-ARFHVFGLSA-N 1 1 319.445 3.600 20 10 DHCDMO c1[nH]nc2c1CCC[C@@H]2[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000378164322 337067523 /nfs/dbraw/zinc/06/75/23/337067523.db2.gz NLWGIRZNNPRQLF-SFHVURJKSA-N 1 1 310.445 3.567 20 10 DHCDMO CCOCc1cc(C[NH2+][C@@H](C)c2ncccc2F)ccc1OC ZINC000527827086 337767236 /nfs/dbraw/zinc/76/72/36/337767236.db2.gz ZTBODHLZKSQAPT-ZDUSSCGKSA-N 1 1 318.392 3.617 20 10 DHCDMO C[C@H]([NH2+]CC12CC(C1)CO2)c1cc(Cl)c(Cl)cc1O ZINC000527983836 337777618 /nfs/dbraw/zinc/77/76/18/337777618.db2.gz VDIHAMHKKMZQQC-JUXJKVCFSA-N 1 1 302.201 3.529 20 10 DHCDMO COC(C[N@@H+](Cc1ccccc1O)[C@H](C)c1ccccc1)OC ZINC000162153332 522529906 /nfs/dbraw/zinc/52/99/06/522529906.db2.gz RAFDCXUSYSEONE-OAHLLOKOSA-N 1 1 315.413 3.574 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccccc2)cc1OC ZINC000159623517 522774324 /nfs/dbraw/zinc/77/43/24/522774324.db2.gz FRYASCDUIMGNIY-INIZCTEOSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@H]2C(=O)Nc2ccc(N)cc2)c1 ZINC000364886439 524394061 /nfs/dbraw/zinc/39/40/61/524394061.db2.gz SENNNQSPRWJZPD-IBGZPJMESA-N 1 1 323.440 3.570 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000180257738 526348252 /nfs/dbraw/zinc/34/82/52/526348252.db2.gz SAVNRMAIKCAMNX-GDBMZVCRSA-N 1 1 321.417 3.681 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(F)ccc1OC)c1ccc(F)cc1O ZINC000287357888 535805523 /nfs/dbraw/zinc/80/55/23/535805523.db2.gz HEJNPNZGRHLVGY-OAHLLOKOSA-N 1 1 307.340 3.920 20 10 DHCDMO COCC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(C)o1 ZINC000273478307 536807774 /nfs/dbraw/zinc/80/77/74/536807774.db2.gz TZDSSGKSFYJQQY-SWLSCSKDSA-N 1 1 307.365 3.861 20 10 DHCDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000294088073 1013124649 /nfs/dbraw/zinc/12/46/49/1013124649.db2.gz ZLXZFUOYSTYWEC-UHFFFAOYSA-N 1 1 312.772 3.814 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+]Cc1cccc(F)c1 ZINC000042411861 1013203976 /nfs/dbraw/zinc/20/39/76/1013203976.db2.gz OEUIXKYOKJTUNX-UHFFFAOYSA-N 1 1 310.166 3.584 20 10 DHCDMO CCC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)CC1CC1 ZINC000296488392 1013208295 /nfs/dbraw/zinc/20/82/95/1013208295.db2.gz KXBRZUYAYVBZEE-UHFFFAOYSA-N 1 1 316.489 3.924 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000894431160 1013357843 /nfs/dbraw/zinc/35/78/43/1013357843.db2.gz NQJONHXJOVQTBP-WCQYABFASA-N 1 1 317.351 3.872 20 10 DHCDMO COc1cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(O)cc1C ZINC000160383512 1014037164 /nfs/dbraw/zinc/03/71/64/1014037164.db2.gz KSXPHGRUMMXLFQ-WMLDXEAASA-N 1 1 307.459 3.569 20 10 DHCDMO Cc1cc(N(Cc2ccco2)Cc2ccccc2O)nc(C)[nH+]1 ZINC000133776208 1014314995 /nfs/dbraw/zinc/31/49/95/1014314995.db2.gz OQQSRTYTVBHSPP-UHFFFAOYSA-N 1 1 309.369 3.599 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2cc(F)cc(F)c2O)CC2CC2)cn1 ZINC000895079268 1014324032 /nfs/dbraw/zinc/32/40/32/1014324032.db2.gz WMQRNLMMHWYQMY-UHFFFAOYSA-N 1 1 318.367 3.786 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2cc(F)cc(F)c2O)CC2CC2)cn1 ZINC000895079268 1014324046 /nfs/dbraw/zinc/32/40/46/1014324046.db2.gz WMQRNLMMHWYQMY-UHFFFAOYSA-N 1 1 318.367 3.786 20 10 DHCDMO CCCn1c2ccccc2nc1C[N@H+](C)Cc1ccccc1O ZINC000091956701 1014416452 /nfs/dbraw/zinc/41/64/52/1014416452.db2.gz ZFBIMYAFIADMIH-UHFFFAOYSA-N 1 1 309.413 3.784 20 10 DHCDMO CCCn1c2ccccc2nc1C[N@@H+](C)Cc1ccccc1O ZINC000091956701 1014416457 /nfs/dbraw/zinc/41/64/57/1014416457.db2.gz ZFBIMYAFIADMIH-UHFFFAOYSA-N 1 1 309.413 3.784 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Br)ccc2O)o1 ZINC000160841260 1014686302 /nfs/dbraw/zinc/68/63/02/1014686302.db2.gz BVAAMYSWSIQPFG-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(F)cc(F)c1O ZINC000834883796 1014938591 /nfs/dbraw/zinc/93/85/91/1014938591.db2.gz HOSRIDXEDMUNTR-JVXZTZIISA-N 1 1 310.171 3.905 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(F)cc(F)c1O ZINC000834883795 1014939352 /nfs/dbraw/zinc/93/93/52/1014939352.db2.gz HOSRIDXEDMUNTR-JMCQJSRRSA-N 1 1 310.171 3.905 20 10 DHCDMO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(N(C)C)cc1 ZINC000163173045 1015000889 /nfs/dbraw/zinc/00/08/89/1015000889.db2.gz LDVNYYJXORWLLO-INIZCTEOSA-N 1 1 320.440 3.789 20 10 DHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001167474148 1015056238 /nfs/dbraw/zinc/05/62/38/1015056238.db2.gz PYYOFLGPJOKZQR-MSOLQXFVSA-N 1 1 304.478 3.778 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000707157312 1015133945 /nfs/dbraw/zinc/13/39/45/1015133945.db2.gz MWBWEKAXCWLRBS-QMMMGPOBSA-N 1 1 324.140 3.539 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895584950 1015211173 /nfs/dbraw/zinc/21/11/73/1015211173.db2.gz VZRKZDLZIAXIKL-OAHLLOKOSA-N 1 1 301.459 3.507 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](c3nccs3)C2)c1O ZINC000895580963 1015216089 /nfs/dbraw/zinc/21/60/89/1015216089.db2.gz JOODQHMSGQCWAM-SNVBAGLBSA-N 1 1 324.833 3.500 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895654565 1015241448 /nfs/dbraw/zinc/24/14/48/1015241448.db2.gz UCRPIFNZOCWRQN-UHFFFAOYSA-N 1 1 313.800 3.720 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895846535 1015330788 /nfs/dbraw/zinc/33/07/88/1015330788.db2.gz PWGMHKZRQGFHDH-QUCCMNQESA-N 1 1 314.473 3.678 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)c(O)c1OC ZINC000891536381 1015363769 /nfs/dbraw/zinc/36/37/69/1015363769.db2.gz IKYUYTLLLRWEBR-GFCCVEGCSA-N 1 1 319.376 3.742 20 10 DHCDMO C[N@@H+](Cc1cnc(-c2ccccn2)s1)Cc1ccccc1O ZINC000091974745 1015741135 /nfs/dbraw/zinc/74/11/35/1015741135.db2.gz PVDMAFNEBIMAQV-UHFFFAOYSA-N 1 1 311.410 3.543 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1nccn1C1CC1)C1CCCC1 ZINC000892013712 1016108422 /nfs/dbraw/zinc/10/84/22/1016108422.db2.gz VZIZROHZWCNIRD-UHFFFAOYSA-N 1 1 311.429 3.868 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2CC=CCC2)c1 ZINC001177542835 1035379373 /nfs/dbraw/zinc/37/93/73/1035379373.db2.gz TZJWKJSBIOVMCR-LBPRGKRZSA-N 1 1 310.235 3.909 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc(F)cc1O ZINC000185032498 1016503647 /nfs/dbraw/zinc/50/36/47/1016503647.db2.gz YBVSTSBMSFWDEX-ZDUSSCGKSA-N 1 1 311.360 3.568 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896939243 1016945389 /nfs/dbraw/zinc/94/53/89/1016945389.db2.gz CTQXJPAQZWTUCI-UHFFFAOYSA-N 1 1 319.408 3.635 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896939243 1016945394 /nfs/dbraw/zinc/94/53/94/1016945394.db2.gz CTQXJPAQZWTUCI-UHFFFAOYSA-N 1 1 319.408 3.635 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000897072628 1017023164 /nfs/dbraw/zinc/02/31/64/1017023164.db2.gz WVKGJUULHZVAKX-AWEZNQCLSA-N 1 1 306.768 3.747 20 10 DHCDMO CCC1([NH+]2CCCC2)CCN(Cc2cc(C)ccc2O)CC1 ZINC000877673980 1033408302 /nfs/dbraw/zinc/40/83/02/1033408302.db2.gz KPTQJALFUANMBZ-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO Oc1cc2ccccc2cc1CNc1nc(NCC2CC2)cc[nH+]1 ZINC001171394952 1032578514 /nfs/dbraw/zinc/57/85/14/1032578514.db2.gz AJUCFGNIQKZFSC-UHFFFAOYSA-N 1 1 320.396 3.769 20 10 DHCDMO CC[C@H]([NH2+]CCc1ccc(OC)cc1)c1ccc(F)cc1O ZINC000796662179 1017132315 /nfs/dbraw/zinc/13/23/15/1017132315.db2.gz AEOHFYPRKIIZKF-KRWDZBQOSA-N 1 1 303.377 3.823 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000840941613 1017521032 /nfs/dbraw/zinc/52/10/32/1017521032.db2.gz DJPIJDJQXWBBMN-ZDUSSCGKSA-N 1 1 300.368 3.835 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926914328 1032716080 /nfs/dbraw/zinc/71/60/80/1032716080.db2.gz HPUYBXLJOKJBTN-CWSCBRNRSA-N 1 1 321.314 3.682 20 10 DHCDMO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccccc1O ZINC000114721346 1018185694 /nfs/dbraw/zinc/18/56/94/1018185694.db2.gz HYIJGUJHNJOYPV-ZDUSSCGKSA-N 1 1 309.369 3.635 20 10 DHCDMO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccccc1O ZINC000114721346 1018185699 /nfs/dbraw/zinc/18/56/99/1018185699.db2.gz HYIJGUJHNJOYPV-ZDUSSCGKSA-N 1 1 309.369 3.635 20 10 DHCDMO CC[C@H]([NH2+]C[C@](C)(O)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000796845883 1018186974 /nfs/dbraw/zinc/18/69/74/1018186974.db2.gz MKFKUCSSGGEEBM-WMZOPIPTSA-N 1 1 321.367 3.619 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171544168 1032758755 /nfs/dbraw/zinc/75/87/55/1032758755.db2.gz RLYGUTZPKYMWJL-ZDUSSCGKSA-N 1 1 321.342 3.799 20 10 DHCDMO CC[C@H](CN[C@@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868803 1018409986 /nfs/dbraw/zinc/40/99/86/1018409986.db2.gz JBQKSOCVNMNEBZ-FUHWJXTLSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)Cn1ccnc1)c1cc(Cl)c(Cl)cc1O ZINC000278257993 1018469562 /nfs/dbraw/zinc/46/95/62/1018469562.db2.gz NKLUOLZNMMTCGA-VHSXEESVSA-N 1 1 314.216 3.635 20 10 DHCDMO CC(C)c1nnc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000263753288 1032771175 /nfs/dbraw/zinc/77/11/75/1032771175.db2.gz KGOHYRZQNWYLTP-UHFFFAOYSA-N 1 1 316.449 3.670 20 10 DHCDMO CC(C)c1nnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000263753288 1032771183 /nfs/dbraw/zinc/77/11/83/1032771183.db2.gz KGOHYRZQNWYLTP-UHFFFAOYSA-N 1 1 316.449 3.670 20 10 DHCDMO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(N(C)C)cc1 ZINC000765935975 1018896639 /nfs/dbraw/zinc/89/66/39/1018896639.db2.gz OWGYIGNJNIYJAJ-GFCCVEGCSA-N 1 1 301.459 3.937 20 10 DHCDMO c1cn(C2CCCC2)nc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921864298 1019016685 /nfs/dbraw/zinc/01/66/85/1019016685.db2.gz ULXCRKWGGNSNRF-UHFFFAOYSA-N 1 1 311.429 3.613 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1cc(Cl)c(Cl)cc1O ZINC000278728125 1019097329 /nfs/dbraw/zinc/09/73/29/1019097329.db2.gz MMKCVQRVSCUGSF-RBZYPMLTSA-N 1 1 318.244 3.901 20 10 DHCDMO C[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)COCc1ccccc1 ZINC000708517357 1019099847 /nfs/dbraw/zinc/09/98/47/1019099847.db2.gz OAXLUBXTWPHIFY-ZDUSSCGKSA-N 1 1 321.367 3.613 20 10 DHCDMO CC(C)(C)c1cccc(C[N@H+]2CC(C)(C)C[C@@]2(C)CO)c1O ZINC001143104312 1019376667 /nfs/dbraw/zinc/37/66/67/1019376667.db2.gz RVMJMNCDBKJAIP-IBGZPJMESA-N 1 1 305.462 3.673 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(F)cc1O ZINC000170789227 1019434295 /nfs/dbraw/zinc/43/42/95/1019434295.db2.gz RNPVKFWRNYJRAZ-NWDGAFQWSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000170789545 1019438407 /nfs/dbraw/zinc/43/84/07/1019438407.db2.gz JBASYHLQBAKUDM-GHMZBOCLSA-N 1 1 304.321 3.851 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000129913198 1032861159 /nfs/dbraw/zinc/86/11/59/1032861159.db2.gz TUHMNSUVNDXGFT-SFHVURJKSA-N 1 1 314.473 3.678 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC001171760092 1032864798 /nfs/dbraw/zinc/86/47/98/1032864798.db2.gz QMRYLPUTXQHILR-PXNSSMCTSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171760092 1032864809 /nfs/dbraw/zinc/86/48/09/1032864809.db2.gz QMRYLPUTXQHILR-PXNSSMCTSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171760092 1032864821 /nfs/dbraw/zinc/86/48/21/1032864821.db2.gz QMRYLPUTXQHILR-PXNSSMCTSA-N 1 1 324.468 3.877 20 10 DHCDMO CCC[N@H+](Cc1c(O)ccc2ccncc21)C[C@H]1CCCCO1 ZINC000730256023 1019968438 /nfs/dbraw/zinc/96/84/38/1019968438.db2.gz QRYCSLXZYOWERJ-MRXNPFEDSA-N 1 1 314.429 3.722 20 10 DHCDMO CCC[N@H+](Cc1cc2c(cc1O)CCC2)C[C@@H]1CCCCO1 ZINC000730256129 1019968940 /nfs/dbraw/zinc/96/89/40/1019968940.db2.gz VCCUEXJHNSGGGE-SFHVURJKSA-N 1 1 303.446 3.662 20 10 DHCDMO CC(C)c1nnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000731847757 1020157692 /nfs/dbraw/zinc/15/76/92/1020157692.db2.gz NPBZJYIKFMFRLR-UHFFFAOYSA-N 1 1 315.417 3.843 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000732182558 1020206304 /nfs/dbraw/zinc/20/63/04/1020206304.db2.gz UEHQXGKQBHKCOC-CYBMUJFWSA-N 1 1 315.413 3.978 20 10 DHCDMO Cc1cc(C[N@H+](C)[C@@H]2CCN(C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189155 1020206326 /nfs/dbraw/zinc/20/63/26/1020206326.db2.gz POUIYSCUKYQLGO-QGZVFWFLSA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN(C)[C@@H]2CC[N@@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189155 1020206333 /nfs/dbraw/zinc/20/63/33/1020206333.db2.gz POUIYSCUKYQLGO-QGZVFWFLSA-N 1 1 316.489 3.667 20 10 DHCDMO Cc1cc(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000732189155 1020206348 /nfs/dbraw/zinc/20/63/48/1020206348.db2.gz POUIYSCUKYQLGO-QGZVFWFLSA-N 1 1 316.489 3.667 20 10 DHCDMO CC1([NH+]2CCC2)CCC([NH2+]Cc2c([O-])cccc2Cl)CC1 ZINC000922846686 1020304181 /nfs/dbraw/zinc/30/41/81/1020304181.db2.gz FREGDUPFNSUNGC-UHFFFAOYSA-N 1 1 308.853 3.542 20 10 DHCDMO Cc1nc(C[NH2+]Cc2ccc3c(c2)CCCO3)nc2ccccc12 ZINC000921652492 1020317001 /nfs/dbraw/zinc/31/70/01/1020317001.db2.gz CMMXMYXRGQXFDX-UHFFFAOYSA-N 1 1 319.408 3.553 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310081245 1020329397 /nfs/dbraw/zinc/32/93/97/1020329397.db2.gz JLBRBZKNMDZVKV-DYESRHJHSA-N 1 1 324.468 3.955 20 10 DHCDMO COc1ccc(N(c2ccc(N)cc2)c2ccc[nH+]c2N)cc1 ZINC001212404008 1020342307 /nfs/dbraw/zinc/34/23/07/1020342307.db2.gz HEAQSZGBVLOBDP-UHFFFAOYSA-N 1 1 306.369 3.724 20 10 DHCDMO Nc1[nH+]cccc1Nc1ccc(Cl)cc1C(=O)c1ccccn1 ZINC001212408758 1020364780 /nfs/dbraw/zinc/36/47/80/1020364780.db2.gz LVNSEPZKDZWMED-UHFFFAOYSA-N 1 1 324.771 3.687 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)[C@H](C)c1nnc(C)s1 ZINC000282412770 1020369856 /nfs/dbraw/zinc/36/98/56/1020369856.db2.gz ISBQGDABJDCFGM-GFCCVEGCSA-N 1 1 305.447 3.915 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nnc(C)s1 ZINC000282412770 1020369872 /nfs/dbraw/zinc/36/98/72/1020369872.db2.gz ISBQGDABJDCFGM-GFCCVEGCSA-N 1 1 305.447 3.915 20 10 DHCDMO CC[N@@H+](Cc1ccc(O)c(C)c1O)Cc1cccc(F)c1F ZINC001140747652 1020596876 /nfs/dbraw/zinc/59/68/76/1020596876.db2.gz HSYSNCFFIMYWEO-UHFFFAOYSA-N 1 1 307.340 3.707 20 10 DHCDMO COC1CCC([N@@H+](C)Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000734476015 1020615972 /nfs/dbraw/zinc/61/59/72/1020615972.db2.gz BBXXKLHKUICAFB-UHFFFAOYSA-N 1 1 321.461 3.785 20 10 DHCDMO CCC(F)(F)C[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000858507240 1032926492 /nfs/dbraw/zinc/92/64/92/1032926492.db2.gz NEFKSXXHCJKYSS-MRVPVSSYSA-N 1 1 308.166 3.851 20 10 DHCDMO CCc1cc(C[N@@H+](CC)CCC(=O)OC)c(O)c(C(C)(C)C)c1 ZINC000738096313 1020860115 /nfs/dbraw/zinc/86/01/15/1020860115.db2.gz IJPUWOREEYOIFE-UHFFFAOYSA-N 1 1 321.461 3.637 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](OCC(F)(F)F)C2)cc1C ZINC000742367057 1021107570 /nfs/dbraw/zinc/10/75/70/1021107570.db2.gz HOUYYOAKYXTNJL-CQSZACIVSA-N 1 1 317.351 3.552 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCN(C)[C@H](C)C2)cc1 ZINC000742374849 1021114624 /nfs/dbraw/zinc/11/46/24/1021114624.db2.gz IBRRLGJRAYCAFI-MJGOQNOKSA-N 1 1 317.521 3.885 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H]3CCCC[C@H]32)cc1C(C)C ZINC000917473488 1021270451 /nfs/dbraw/zinc/27/04/51/1021270451.db2.gz PWYUFVYPDXKFAE-MJGOQNOKSA-N 1 1 303.446 3.967 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000743402691 1021284195 /nfs/dbraw/zinc/28/41/95/1021284195.db2.gz MIFWJIMBUMZHCX-LJQANCHMSA-N 1 1 320.392 3.514 20 10 DHCDMO CCCC[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccccc1O ZINC000801599498 1021292558 /nfs/dbraw/zinc/29/25/58/1021292558.db2.gz QDIMNYIPNXZIAX-UHFFFAOYSA-N 1 1 307.434 3.726 20 10 DHCDMO CC(C)CCOCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917972918 1021411137 /nfs/dbraw/zinc/41/11/37/1021411137.db2.gz HIIBYGPGUVHBMX-UHFFFAOYSA-N 1 1 304.478 3.780 20 10 DHCDMO CCCCOCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000918020230 1021427691 /nfs/dbraw/zinc/42/76/91/1021427691.db2.gz ZFOIEFZGQPCHCR-UHFFFAOYSA-N 1 1 304.478 3.925 20 10 DHCDMO CCOCc1cc(C[NH2+][C@H](C)c2cscn2)ccc1OC ZINC000850359866 1021485531 /nfs/dbraw/zinc/48/55/31/1021485531.db2.gz UUROWIPIVSBOLN-GFCCVEGCSA-N 1 1 306.431 3.539 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Cl)c(Cl)cc1O ZINC000850482617 1021556755 /nfs/dbraw/zinc/55/67/55/1021556755.db2.gz QCXPYNRKCOJFSP-RKDXNWHRSA-N 1 1 304.217 3.917 20 10 DHCDMO C[C@H]([NH2+][C@@H]1COC(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000850481248 1021557720 /nfs/dbraw/zinc/55/77/20/1021557720.db2.gz FGYNIEKKNUQWGP-UWVGGRQHSA-N 1 1 303.324 3.629 20 10 DHCDMO C[C@@H](N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537872 1021592232 /nfs/dbraw/zinc/59/22/32/1021592232.db2.gz ASYDIFTXLGSBTN-UKRRQHHQSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537872 1021592241 /nfs/dbraw/zinc/59/22/41/1021592241.db2.gz ASYDIFTXLGSBTN-UKRRQHHQSA-N 1 1 306.425 3.589 20 10 DHCDMO Cc1ccc(O)c([C@H](C)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC000850538570 1021593352 /nfs/dbraw/zinc/59/33/52/1021593352.db2.gz IBQHCBHLEAAMGO-JKSUJKDBSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc(O)c([C@H](C)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC000850538570 1021593359 /nfs/dbraw/zinc/59/33/59/1021593359.db2.gz IBQHCBHLEAAMGO-JKSUJKDBSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1cc(F)cc(F)c1O ZINC000850549782 1021597251 /nfs/dbraw/zinc/59/72/51/1021597251.db2.gz JWEZJPLQZCOALN-SNVBAGLBSA-N 1 1 321.371 3.522 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@H](O)C12CCC2)c1cc(Cl)c(Cl)cc1O ZINC000850548140 1021598189 /nfs/dbraw/zinc/59/81/89/1021598189.db2.gz ZEWGTIBVUZVZSG-PCTYZZJISA-N 1 1 316.228 3.653 20 10 DHCDMO C[C@@H]([NH2+]CC1(C(=O)OC(C)(C)C)CCC1)c1ccc(F)cc1O ZINC000850573961 1021616564 /nfs/dbraw/zinc/61/65/64/1021616564.db2.gz UIKVMJHBMQMINF-GFCCVEGCSA-N 1 1 323.408 3.694 20 10 DHCDMO Cc1ncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)s1 ZINC000109761363 1021743847 /nfs/dbraw/zinc/74/38/47/1021743847.db2.gz FHYMSZUFYDOMIX-UHFFFAOYSA-N 1 1 314.410 3.953 20 10 DHCDMO Cc1ncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)s1 ZINC000109761363 1021743863 /nfs/dbraw/zinc/74/38/63/1021743863.db2.gz FHYMSZUFYDOMIX-UHFFFAOYSA-N 1 1 314.410 3.953 20 10 DHCDMO COc1ccc(-c2nc(C[N@H+](C)Cc3ccccc3O)co2)cc1 ZINC000109769284 1021746005 /nfs/dbraw/zinc/74/60/05/1021746005.db2.gz MLNLUAOAFIMVEO-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO COc1ccc(-c2nc(C[N@@H+](C)Cc3ccccc3O)co2)cc1 ZINC000109769284 1021746020 /nfs/dbraw/zinc/74/60/20/1021746020.db2.gz MLNLUAOAFIMVEO-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1cc2c(cc1O)CCC2)c1nccs1 ZINC000182844378 1021829585 /nfs/dbraw/zinc/82/95/85/1021829585.db2.gz HAJKWDXEPKLGCZ-LBPRGKRZSA-N 1 1 302.443 3.573 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000746154123 1021879373 /nfs/dbraw/zinc/87/93/73/1021879373.db2.gz YXUNLJJOEHUXLP-IBGZPJMESA-N 1 1 302.462 3.676 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccc(F)n1 ZINC000851717317 1021971270 /nfs/dbraw/zinc/97/12/70/1021971270.db2.gz WPFZHDLKSMQOMV-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)n1 ZINC000851731754 1021976517 /nfs/dbraw/zinc/97/65/17/1021976517.db2.gz BJOWYALVWUDSKS-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO CO[C@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C1CCC1 ZINC000851840374 1022019079 /nfs/dbraw/zinc/01/90/79/1022019079.db2.gz DYKMNPJQBRXTLU-LJQANCHMSA-N 1 1 315.413 3.803 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cccc(F)c1OC(F)F ZINC000851840887 1022020158 /nfs/dbraw/zinc/02/01/58/1022020158.db2.gz KWCJUCNQHPTCBS-UHFFFAOYSA-N 1 1 311.303 3.765 20 10 DHCDMO C[C@H](NCC[N@@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384002 1022084426 /nfs/dbraw/zinc/08/44/26/1022084426.db2.gz VDZKUCNJXYFNOQ-ROUUACIJSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@H](NCC[N@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384002 1022084441 /nfs/dbraw/zinc/08/44/41/1022084441.db2.gz VDZKUCNJXYFNOQ-ROUUACIJSA-N 1 1 315.505 3.669 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]3COC[C@@H]3C1)oc1ccccc12 ZINC000853586618 1022296053 /nfs/dbraw/zinc/29/60/53/1022296053.db2.gz VCNLZHICIVBWCP-ZFWWWQNUSA-N 1 1 323.392 3.760 20 10 DHCDMO COCCCCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000103225793 1022406402 /nfs/dbraw/zinc/40/64/02/1022406402.db2.gz OYVQWKZHZILMBZ-UHFFFAOYSA-N 1 1 304.478 3.925 20 10 DHCDMO COc1ccccc1O[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185580029 1022502864 /nfs/dbraw/zinc/50/28/64/1022502864.db2.gz PCXJHBLLOBOABQ-CHWSQXEVSA-N 1 1 319.376 3.658 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000272900412 1022516873 /nfs/dbraw/zinc/51/68/73/1022516873.db2.gz UZWNTZWZAQVWAO-JENIJYKNSA-N 1 1 324.468 3.953 20 10 DHCDMO CCC1([NH2+]Cc2ccc(N3CCN(C)CC3)cc2)CCCCC1 ZINC001202494294 1022656130 /nfs/dbraw/zinc/65/61/30/1022656130.db2.gz JMFBBIMJNNNXOY-UHFFFAOYSA-N 1 1 315.505 3.641 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC3(CCCCC3)C2)c1 ZINC000180494129 1022745408 /nfs/dbraw/zinc/74/54/08/1022745408.db2.gz DPCIKNLUFGAFKS-UHFFFAOYSA-N 1 1 307.459 3.653 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)c1cscn1 ZINC000768091832 1022878546 /nfs/dbraw/zinc/87/85/46/1022878546.db2.gz AZXYBTRVKAZIOI-CYBMUJFWSA-N 1 1 319.499 3.547 20 10 DHCDMO C[N@H+](Cc1cccc(F)c1)Cc1cccc(Br)c1O ZINC000768161328 1022906274 /nfs/dbraw/zinc/90/62/74/1022906274.db2.gz YCYRVDNXZGOBLG-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1cccc(Br)c1O ZINC000768161328 1022906290 /nfs/dbraw/zinc/90/62/90/1022906290.db2.gz YCYRVDNXZGOBLG-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccc(COC)o2)cc1 ZINC000768207855 1022915912 /nfs/dbraw/zinc/91/59/12/1022915912.db2.gz KAKGECLEPVEWEF-UHFFFAOYSA-N 1 1 316.445 3.904 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000768248989 1022934114 /nfs/dbraw/zinc/93/41/14/1022934114.db2.gz NBNDFLNTKVYVQI-MRXNPFEDSA-N 1 1 315.438 3.691 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)cc1F ZINC000768263813 1022935704 /nfs/dbraw/zinc/93/57/04/1022935704.db2.gz WESOGRPWDGLXJK-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO COc1cccc(O)c1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000768258128 1022935998 /nfs/dbraw/zinc/93/59/98/1022935998.db2.gz PNCAUCUMCIOBML-UHFFFAOYSA-N 1 1 319.351 3.844 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000768258128 1022936007 /nfs/dbraw/zinc/93/60/07/1022936007.db2.gz PNCAUCUMCIOBML-UHFFFAOYSA-N 1 1 319.351 3.844 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H]1CO ZINC000857061285 1022940862 /nfs/dbraw/zinc/94/08/62/1022940862.db2.gz NNNZKCDVUUCCDL-KXBFYZLASA-N 1 1 311.425 3.510 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000768320415 1022946046 /nfs/dbraw/zinc/94/60/46/1022946046.db2.gz UNFZHXKXPXIGNG-QGZVFWFLSA-N 1 1 311.425 3.998 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ccccc1C ZINC000768336857 1022947259 /nfs/dbraw/zinc/94/72/59/1022947259.db2.gz ZFPJPDVXLOCHSA-UHFFFAOYSA-N 1 1 324.468 3.854 20 10 DHCDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc(N2CCOCC2)cc1 ZINC000768334420 1022948013 /nfs/dbraw/zinc/94/80/13/1022948013.db2.gz JKVZLHDYMOTILJ-UHFFFAOYSA-N 1 1 324.468 3.854 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(O)cc1C ZINC000768438255 1022965398 /nfs/dbraw/zinc/96/53/98/1022965398.db2.gz QOYUCVTWVYUYOW-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876580056 1033094791 /nfs/dbraw/zinc/09/47/91/1033094791.db2.gz QDKBIRLKBCGYJD-IBGZPJMESA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000768919065 1023055914 /nfs/dbraw/zinc/05/59/14/1023055914.db2.gz PDGQMODEWOICJI-GOSISDBHSA-N 1 1 321.424 3.924 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3cc(C)oc3C)CC2)cc1 ZINC000768997958 1023075127 /nfs/dbraw/zinc/07/51/27/1023075127.db2.gz JFIKJKYTKSJSOW-UHFFFAOYSA-N 1 1 314.429 3.617 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000769241048 1023105550 /nfs/dbraw/zinc/10/55/50/1023105550.db2.gz JMNPINRFVGXEAZ-AWEZNQCLSA-N 1 1 310.235 3.919 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000769241048 1023105556 /nfs/dbraw/zinc/10/55/56/1023105556.db2.gz JMNPINRFVGXEAZ-AWEZNQCLSA-N 1 1 310.235 3.919 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2Cc2ccc(C)cc2)c1O ZINC000769319116 1023120535 /nfs/dbraw/zinc/12/05/35/1023120535.db2.gz PZKTVFASHJAVKY-SFHVURJKSA-N 1 1 311.425 3.916 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccc(C)cc2)c1O ZINC000769319115 1023120912 /nfs/dbraw/zinc/12/09/12/1023120912.db2.gz PZKTVFASHJAVKY-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000769390305 1023139295 /nfs/dbraw/zinc/13/92/95/1023139295.db2.gz UOGNKVQMGAQEMW-GFCCVEGCSA-N 1 1 305.805 3.814 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000769390348 1023140006 /nfs/dbraw/zinc/14/00/06/1023140006.db2.gz VJKVITPRKZHWIW-AWEZNQCLSA-N 1 1 315.413 3.560 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000769388801 1023140069 /nfs/dbraw/zinc/14/00/69/1023140069.db2.gz HVBDZSRJDSXZLQ-LLVKDONJSA-N 1 1 322.202 3.737 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCCC[C@H](SCC)C2)c(O)c1 ZINC000769403957 1023141138 /nfs/dbraw/zinc/14/11/38/1023141138.db2.gz LBJFMVIHNRFKTN-INIZCTEOSA-N 1 1 309.475 3.899 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000769403922 1023141637 /nfs/dbraw/zinc/14/16/37/1023141637.db2.gz KBWWJGICMXVNCG-AWEZNQCLSA-N 1 1 318.442 3.675 20 10 DHCDMO CC1(C)CC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000769447244 1023154437 /nfs/dbraw/zinc/15/44/37/1023154437.db2.gz XPNZFJLDCKTOJR-UHFFFAOYSA-N 1 1 303.406 3.569 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000769464788 1023159142 /nfs/dbraw/zinc/15/91/42/1023159142.db2.gz ANVMVIRFNUYCII-UKRRQHHQSA-N 1 1 315.388 3.918 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCN(CC)[C@@H](C)C2)cc1 ZINC000769470649 1023160774 /nfs/dbraw/zinc/16/07/74/1023160774.db2.gz NEBXSSDZPTXTAB-PXNSSMCTSA-N 1 1 317.521 3.837 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCN(CC)[C@@H](C)C2)cc1 ZINC000769470649 1023160778 /nfs/dbraw/zinc/16/07/78/1023160778.db2.gz NEBXSSDZPTXTAB-PXNSSMCTSA-N 1 1 317.521 3.837 20 10 DHCDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2c(O)cccc2OC)s1 ZINC000769471976 1023162971 /nfs/dbraw/zinc/16/29/71/1023162971.db2.gz ZOFOKPIBBBGYFK-LBPRGKRZSA-N 1 1 320.458 3.921 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cc1F ZINC000769538082 1023176179 /nfs/dbraw/zinc/17/61/79/1023176179.db2.gz RGGFTNWLOGNVJF-LJQANCHMSA-N 1 1 315.436 3.957 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000770285998 1023291372 /nfs/dbraw/zinc/29/13/72/1023291372.db2.gz NLTRIMPAFZFVSY-AZUAARDMSA-N 1 1 314.473 3.678 20 10 DHCDMO COc1cc2c(cc1CNc1ccc3c(c1)[nH+]cn3C)O[C@@H](C)C2 ZINC000770589376 1023326987 /nfs/dbraw/zinc/32/69/87/1023326987.db2.gz QHUOIZFZQZQRBI-LBPRGKRZSA-N 1 1 323.396 3.517 20 10 DHCDMO Cc1nc(CC[NH2+][C@@H](C)c2cc(F)cc(F)c2O)sc1C ZINC000756657650 1023351207 /nfs/dbraw/zinc/35/12/07/1023351207.db2.gz DYYMRGXNCYSURO-VIFPVBQESA-N 1 1 312.385 3.637 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000876770204 1033141762 /nfs/dbraw/zinc/14/17/62/1033141762.db2.gz KAUUVSCGLDJAHR-GOSISDBHSA-N 1 1 311.425 3.739 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCSC1 ZINC000787039455 1023751122 /nfs/dbraw/zinc/75/11/22/1023751122.db2.gz JDNNUMKRVKVKPF-QGZVFWFLSA-N 1 1 304.503 3.862 20 10 DHCDMO Cc1ccc(C)n1-c1ccc(NCc2ccc(N)[nH+]c2C)cc1 ZINC001167786699 1023882101 /nfs/dbraw/zinc/88/21/01/1023882101.db2.gz VZYAHIZULBBLFI-UHFFFAOYSA-N 1 1 306.413 3.992 20 10 DHCDMO CCOCCCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788549259 1023903996 /nfs/dbraw/zinc/90/39/96/1023903996.db2.gz UZUBOZCGBLJJCM-NSHDSACASA-N 1 1 305.340 3.878 20 10 DHCDMO C[C@@H]([NH2+]CCCCCCO)c1cccc(C(F)(F)F)c1O ZINC000788694500 1023927352 /nfs/dbraw/zinc/92/73/52/1023927352.db2.gz UZPOQMVFXGSHKU-LLVKDONJSA-N 1 1 305.340 3.614 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](C)N1CCCC[C@@H]1C)c1ccc(F)cc1O ZINC000796693477 1023932183 /nfs/dbraw/zinc/93/21/83/1023932183.db2.gz JFBNEBBBHPZDOC-ZQIUZPCESA-N 1 1 308.441 3.835 20 10 DHCDMO C[C@H]1CC[C@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)O1 ZINC000789306485 1024042770 /nfs/dbraw/zinc/04/27/70/1024042770.db2.gz OYADKLYAJXCICS-QFBILLFUSA-N 1 1 302.462 3.676 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCC2CCOCC2)cc1 ZINC000129691990 1024058642 /nfs/dbraw/zinc/05/86/42/1024058642.db2.gz RLRKXCPCAQIDFI-UHFFFAOYSA-N 1 1 304.478 3.781 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2c(O)ccc3ccccc32)s1 ZINC000165199231 1024087204 /nfs/dbraw/zinc/08/72/04/1024087204.db2.gz RHZRTPVZKXCEKJ-UHFFFAOYSA-N 1 1 312.438 3.985 20 10 DHCDMO CC[C@]1(CO)CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000789568473 1024117999 /nfs/dbraw/zinc/11/79/99/1024117999.db2.gz XAHHUWFNKWFIMH-HXUWFJFHSA-N 1 1 311.425 3.796 20 10 DHCDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000789586290 1024120707 /nfs/dbraw/zinc/12/07/07/1024120707.db2.gz JZQMQCXJIQCQAF-OWCLPIDISA-N 1 1 320.452 3.529 20 10 DHCDMO CC(C)OCc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000882882335 1024158483 /nfs/dbraw/zinc/15/84/83/1024158483.db2.gz FYVZDGZUEJMITH-UHFFFAOYSA-N 1 1 321.367 3.885 20 10 DHCDMO Cc1nc(C(C)(C)[NH2+]Cc2cc(F)cc(F)c2O)sc1C ZINC000883016219 1024213892 /nfs/dbraw/zinc/21/38/92/1024213892.db2.gz QXUJWAPXOBNVJB-UHFFFAOYSA-N 1 1 312.385 3.769 20 10 DHCDMO Cc1nc2c(s1)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)CCC2 ZINC000883084524 1024236050 /nfs/dbraw/zinc/23/60/50/1024236050.db2.gz UFMMQUGCXIKLMV-GFCCVEGCSA-N 1 1 310.369 3.603 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCOc2c(F)cccc21 ZINC000883084557 1024236521 /nfs/dbraw/zinc/23/65/21/1024236521.db2.gz VFCJOPMPHAICFX-OAHLLOKOSA-N 1 1 323.314 3.813 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCS[C@H]3COCC[C@@H]32)cc1C(C)C ZINC000131066953 1024254781 /nfs/dbraw/zinc/25/47/81/1024254781.db2.gz SGCQIFFZNDCNQC-WMZOPIPTSA-N 1 1 321.486 3.530 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCO[C@H](C(C)(C)C)C2)c1 ZINC000790416246 1024298266 /nfs/dbraw/zinc/29/82/66/1024298266.db2.gz OSCKWQUITHEBMF-INIZCTEOSA-N 1 1 321.461 3.642 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]C2(c3ncccn3)CCC2)c1O ZINC000883311788 1024362024 /nfs/dbraw/zinc/36/20/24/1024362024.db2.gz KYZFINMKVIPKJZ-LBPRGKRZSA-N 1 1 317.820 3.874 20 10 DHCDMO CN(C)[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000790947207 1024402836 /nfs/dbraw/zinc/40/28/36/1024402836.db2.gz LYIIASCUEYUOSM-OAHLLOKOSA-N 1 1 322.811 3.577 20 10 DHCDMO Oc1ccc(CCC[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790968119 1024409378 /nfs/dbraw/zinc/40/93/78/1024409378.db2.gz NGAOLIDFADQGAZ-UHFFFAOYSA-N 1 1 309.768 3.613 20 10 DHCDMO C[C@@](CO)([NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790967189 1024409413 /nfs/dbraw/zinc/40/94/13/1024409413.db2.gz GJGPXEDMPDFNCW-INIZCTEOSA-N 1 1 315.816 3.606 20 10 DHCDMO CN(C)c1ccccc1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790966851 1024409833 /nfs/dbraw/zinc/40/98/33/1024409833.db2.gz WMPKZOUISCMLAW-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO CS[C@@H]1CCC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790966744 1024410214 /nfs/dbraw/zinc/41/02/14/1024410214.db2.gz VOLUBCKQOZGXLO-VHSXEESVSA-N 1 1 303.830 3.949 20 10 DHCDMO COc1cccc(O)c1C[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC000883383014 1024416087 /nfs/dbraw/zinc/41/60/87/1024416087.db2.gz RMQZTNYTIFLYFJ-CRAIPNDOSA-N 1 1 301.361 3.516 20 10 DHCDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C12CCC2 ZINC000790972048 1024420245 /nfs/dbraw/zinc/42/02/45/1024420245.db2.gz FCERATQPZHJNFP-ZIAGYGMSSA-N 1 1 313.800 3.622 20 10 DHCDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790980668 1024424036 /nfs/dbraw/zinc/42/40/36/1024424036.db2.gz BOZJVLXOCLJIEI-SNVBAGLBSA-N 1 1 308.784 3.993 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCc2c(F)cccc21 ZINC001202611810 1024601229 /nfs/dbraw/zinc/60/12/29/1024601229.db2.gz MWOCQCUVGOJNSL-INIZCTEOSA-N 1 1 307.315 3.977 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000792173382 1024640475 /nfs/dbraw/zinc/64/04/75/1024640475.db2.gz FGDMEUBIOROKGI-CYBMUJFWSA-N 1 1 320.795 3.644 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000792173382 1024640481 /nfs/dbraw/zinc/64/04/81/1024640481.db2.gz FGDMEUBIOROKGI-CYBMUJFWSA-N 1 1 320.795 3.644 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1SC ZINC000109769770 1024696131 /nfs/dbraw/zinc/69/61/31/1024696131.db2.gz KJWVWTLWDZGBGK-UHFFFAOYSA-N 1 1 303.427 3.755 20 10 DHCDMO CCc1cc(C[N@H+]2CCCOC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000772822310 1024812779 /nfs/dbraw/zinc/81/27/79/1024812779.db2.gz PFYOJNMXEVQLHJ-CQSZACIVSA-N 1 1 305.462 3.863 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](Cc2cccnc2)C2CC2)cc1Cl ZINC000825935372 1033245575 /nfs/dbraw/zinc/24/55/75/1033245575.db2.gz RUBJQXGQXOJOQM-UHFFFAOYSA-N 1 1 302.805 3.914 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC(C)(C)C1 ZINC000793355279 1024998663 /nfs/dbraw/zinc/99/86/63/1024998663.db2.gz BWAIZSSQLMGSER-MRXNPFEDSA-N 1 1 320.452 3.673 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1 ZINC000793576051 1025113201 /nfs/dbraw/zinc/11/32/01/1025113201.db2.gz XEPDYRQWNGXHDO-HNNXBMFYSA-N 1 1 322.456 3.912 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCOC[C@H](C3CCC3)C1)CCCC2 ZINC000793742610 1025159263 /nfs/dbraw/zinc/15/92/63/1025159263.db2.gz BXLDYUBPXZMVQY-LJQANCHMSA-N 1 1 315.457 3.520 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000793745818 1025160478 /nfs/dbraw/zinc/16/04/78/1025160478.db2.gz TZRUDCMJCDJQBJ-KRWDZBQOSA-N 1 1 311.425 3.794 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1cccc(F)c1O)[C@H](O)c1ccccc1 ZINC000279698803 1025165714 /nfs/dbraw/zinc/16/57/14/1025165714.db2.gz QXHNPGPGJUMHTG-SJLPKXTDSA-N 1 1 303.377 3.523 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@H](CCF)C2)ccc1N1CCCCC1 ZINC000859909259 1033266924 /nfs/dbraw/zinc/26/69/24/1033266924.db2.gz UJGFNKWNVISZGI-GOSISDBHSA-N 1 1 320.452 3.546 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@H](CCF)C2)ccc1N1CCCCC1 ZINC000859909259 1033266936 /nfs/dbraw/zinc/26/69/36/1033266936.db2.gz UJGFNKWNVISZGI-GOSISDBHSA-N 1 1 320.452 3.546 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)c1ccncc1OC)c1ccc(F)cc1O ZINC000796959434 1025237084 /nfs/dbraw/zinc/23/70/84/1025237084.db2.gz NXMDXIBRGQURSU-XHDPSFHLSA-N 1 1 304.365 3.737 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)[C@@H](C)c2cnc(C)cn2)cc1 ZINC000794257967 1025242605 /nfs/dbraw/zinc/24/26/05/1025242605.db2.gz PKBGEYCKDBISJA-INIZCTEOSA-N 1 1 312.461 3.824 20 10 DHCDMO CSCC[C@H](C)[N@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135821345 1025287046 /nfs/dbraw/zinc/28/70/46/1025287046.db2.gz CSNBQRUUIOBHKJ-JTQLQIEISA-N 1 1 315.866 3.822 20 10 DHCDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135821345 1025287059 /nfs/dbraw/zinc/28/70/59/1025287059.db2.gz CSNBQRUUIOBHKJ-JTQLQIEISA-N 1 1 315.866 3.822 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1c(O)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000886512344 1025668471 /nfs/dbraw/zinc/66/84/71/1025668471.db2.gz CQBSFXVUUGCPED-GHMZBOCLSA-N 1 1 304.321 3.851 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cn1 ZINC000886524468 1025674757 /nfs/dbraw/zinc/67/47/57/1025674757.db2.gz LAZOTGXSUJFFLQ-GFCCVEGCSA-N 1 1 304.365 3.566 20 10 DHCDMO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886540313 1025687098 /nfs/dbraw/zinc/68/70/98/1025687098.db2.gz CMWCWAWXDYFDIL-OFQRWUPVSA-N 1 1 317.404 3.737 20 10 DHCDMO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886543456 1025690465 /nfs/dbraw/zinc/69/04/65/1025690465.db2.gz PDMAKGLRTIITNU-SUNKGSAMSA-N 1 1 309.406 3.756 20 10 DHCDMO Cc1c(C[NH2+][C@@H](C)c2c(O)cccc2F)cccc1[N+](=O)[O-] ZINC000886598496 1025729606 /nfs/dbraw/zinc/72/96/06/1025729606.db2.gz BVCNYMGWGWQQSK-NSHDSACASA-N 1 1 304.321 3.599 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Br)ccc1O ZINC000806179221 1025833975 /nfs/dbraw/zinc/83/39/75/1025833975.db2.gz BJYVSPBJVKMNEL-PELKAZGASA-N 1 1 320.177 3.993 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c1 ZINC000093684201 1026124784 /nfs/dbraw/zinc/12/47/84/1026124784.db2.gz YZDZBFFOOBNCIE-SFHVURJKSA-N 1 1 311.425 3.739 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](N3CCCC3)[C@@H]2C)cc1C(C)C ZINC000808191518 1026225172 /nfs/dbraw/zinc/22/51/72/1026225172.db2.gz MSIJMAXQWMIBTI-QFBILLFUSA-N 1 1 316.489 3.883 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](N3CCCC3)[C@@H]2C)cc1C(C)C ZINC000808191518 1026225186 /nfs/dbraw/zinc/22/51/86/1026225186.db2.gz MSIJMAXQWMIBTI-QFBILLFUSA-N 1 1 316.489 3.883 20 10 DHCDMO CC[NH+]1CCC(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])CC1 ZINC000808691406 1026350506 /nfs/dbraw/zinc/35/05/06/1026350506.db2.gz MACMFWJMBIRTDP-CYBMUJFWSA-N 1 1 310.869 3.737 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ncnn2C(C)(C)C)c1O ZINC000808717729 1026365234 /nfs/dbraw/zinc/36/52/34/1026365234.db2.gz MCQNLSDQVQJFOX-NSHDSACASA-N 1 1 322.840 3.551 20 10 DHCDMO CCCC[N@@H+](Cc1cncc(OC)c1)Cc1ccccc1O ZINC000808757307 1026379486 /nfs/dbraw/zinc/37/94/86/1026379486.db2.gz JAXIEVYAARFSKQ-UHFFFAOYSA-N 1 1 300.402 3.598 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1COc2ccc(F)cc2C1)c1ccc(F)cc1O ZINC000808730060 1026381484 /nfs/dbraw/zinc/38/14/84/1026381484.db2.gz SAXDIRLDRKHYNO-GOEBONIOSA-N 1 1 319.351 3.715 20 10 DHCDMO C[N@H+](Cc1cscc1Br)Cc1ccccc1O ZINC000809548833 1026558227 /nfs/dbraw/zinc/55/82/27/1026558227.db2.gz KDVBETGWOUEZIC-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[N@@H+](Cc1cscc1Br)Cc1ccccc1O ZINC000809548833 1026558232 /nfs/dbraw/zinc/55/82/32/1026558232.db2.gz KDVBETGWOUEZIC-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC=C(c3ccco3)C2)c1O ZINC000809688567 1026593251 /nfs/dbraw/zinc/59/32/51/1026593251.db2.gz MGTWEOZSDVYLGJ-UHFFFAOYSA-N 1 1 319.788 3.937 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CCCC3)[C@H]2C)cc1 ZINC000809724585 1026604319 /nfs/dbraw/zinc/60/43/19/1026604319.db2.gz QJSQAQMGIPDYHX-YLJYHZDGSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](N3CCCC3)[C@H]2C)cc1 ZINC000809724585 1026604322 /nfs/dbraw/zinc/60/43/22/1026604322.db2.gz QJSQAQMGIPDYHX-YLJYHZDGSA-N 1 1 315.505 3.591 20 10 DHCDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809767535 1026606257 /nfs/dbraw/zinc/60/62/57/1026606257.db2.gz NLQVGMQQRKHZIK-IBGZPJMESA-N 1 1 313.441 3.898 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@@H+](C)[C@H](C)CO)cc1 ZINC000809746161 1026613157 /nfs/dbraw/zinc/61/31/57/1026613157.db2.gz RIRZHEJZSXSOTA-QGZVFWFLSA-N 1 1 312.457 3.526 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1cc(F)ccc1O ZINC000809755765 1026617671 /nfs/dbraw/zinc/61/76/71/1026617671.db2.gz BVZFXCURXCSMAP-MRXNPFEDSA-N 1 1 317.408 3.989 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1O ZINC000809758143 1026617897 /nfs/dbraw/zinc/61/78/97/1026617897.db2.gz DTTADWBHXQZOKO-LSDHHAIUSA-N 1 1 323.864 3.993 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000809758641 1026618260 /nfs/dbraw/zinc/61/82/60/1026618260.db2.gz SBVIQPCGXQSESQ-ZIAGYGMSSA-N 1 1 309.837 3.684 20 10 DHCDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cc(OC)ccc1O ZINC000809780525 1026622539 /nfs/dbraw/zinc/62/25/39/1026622539.db2.gz AQCPBSMXBVHJEU-QGZVFWFLSA-N 1 1 315.413 3.993 20 10 DHCDMO COc1cc(Cl)cc(C[NH2+]C2(C(F)F)CCCC2)c1O ZINC000809790036 1026627737 /nfs/dbraw/zinc/62/77/37/1026627737.db2.gz UJZZGQJXVGMOEX-UHFFFAOYSA-N 1 1 305.752 3.722 20 10 DHCDMO CCC[N@H+](CC)C[C@@H](C)N[C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810261836 1026720895 /nfs/dbraw/zinc/72/08/95/1026720895.db2.gz KSCKOWYKBGVYQH-GUTXKFCHSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000810261836 1026720907 /nfs/dbraw/zinc/72/09/07/1026720907.db2.gz KSCKOWYKBGVYQH-GUTXKFCHSA-N 1 1 308.441 3.790 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Br)ccc2O)CCC1(F)F ZINC000811512059 1027026761 /nfs/dbraw/zinc/02/67/61/1027026761.db2.gz DCWABOLGDCLZLF-SECBINFHSA-N 1 1 320.177 3.632 20 10 DHCDMO CCn1nc(C)c(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)c1C ZINC000156841320 1027175467 /nfs/dbraw/zinc/17/54/67/1027175467.db2.gz DPSFJALMDWJIOR-UHFFFAOYSA-N 1 1 314.477 3.608 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C(C)C)[C@@H]3CCOC3)c2c1 ZINC000812290676 1027236607 /nfs/dbraw/zinc/23/66/07/1027236607.db2.gz FOMVPJDSQOGDDF-OAHLLOKOSA-N 1 1 315.413 3.553 20 10 DHCDMO Cc1cc(C[N@H+](C(C)C)[C@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000812293760 1027248611 /nfs/dbraw/zinc/24/86/11/1027248611.db2.gz XSQHTBYJAHNGHR-INIZCTEOSA-N 1 1 305.462 3.997 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)C[C@@H](C)OC ZINC000812808495 1027430368 /nfs/dbraw/zinc/43/03/68/1027430368.db2.gz FSMOEIPSOWMNAO-GFCCVEGCSA-N 1 1 318.383 3.628 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCO[C@@H](C)C2)cc1 ZINC000778995560 1027734645 /nfs/dbraw/zinc/73/46/45/1027734645.db2.gz ZFVXCJANURKEJA-WMZOPIPTSA-N 1 1 304.478 3.780 20 10 DHCDMO CCC[N@@H+](Cc1cc(F)ccc1O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000779024930 1027906583 /nfs/dbraw/zinc/90/65/83/1027906583.db2.gz DZAPVPPETADSQZ-OIISXLGYSA-N 1 1 307.409 3.557 20 10 DHCDMO C[C@@H]([NH2+]CC12CC(C1)CO2)c1cc(Cl)c(Cl)cc1O ZINC000527983838 1028002305 /nfs/dbraw/zinc/00/23/05/1028002305.db2.gz VDIHAMHKKMZQQC-NQTXRORDSA-N 1 1 302.201 3.529 20 10 DHCDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000779055589 1028085401 /nfs/dbraw/zinc/08/54/01/1028085401.db2.gz LCKZWXOIWOMOCX-VIFPVBQESA-N 1 1 311.303 3.669 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321744 1028167571 /nfs/dbraw/zinc/16/75/71/1028167571.db2.gz JNNIEGKTFRGLQV-FUHWJXTLSA-N 1 1 302.462 3.794 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321744 1028167577 /nfs/dbraw/zinc/16/75/77/1028167577.db2.gz JNNIEGKTFRGLQV-FUHWJXTLSA-N 1 1 302.462 3.794 20 10 DHCDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000780793967 1028181953 /nfs/dbraw/zinc/18/19/53/1028181953.db2.gz ZWXZOGOGVQBXGR-OCCSQVGLSA-N 1 1 300.368 3.915 20 10 DHCDMO CC(C)[C@@]1(CO)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000367968434 1028264842 /nfs/dbraw/zinc/26/48/42/1028264842.db2.gz XNPFARSRZVBDCJ-FQEVSTJZSA-N 1 1 316.489 3.517 20 10 DHCDMO COC1(CC[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCC1 ZINC000815019922 1028327756 /nfs/dbraw/zinc/32/77/56/1028327756.db2.gz VLODKDUZDKMLSP-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc1N(C)C ZINC000815118969 1028365381 /nfs/dbraw/zinc/36/53/81/1028365381.db2.gz NWROIWXOJDAMLI-RBUKOAKNSA-N 1 1 314.473 3.595 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CC)[C@@H]2CCOC(C)(C)C2)cc1 ZINC000815119833 1028367684 /nfs/dbraw/zinc/36/76/84/1028367684.db2.gz HMDIJFQIBGXHPW-GOSISDBHSA-N 1 1 304.478 3.922 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cc1 ZINC000815108918 1028383327 /nfs/dbraw/zinc/38/33/27/1028383327.db2.gz QBFAKQPUXCEHGH-IUODEOHRSA-N 1 1 300.368 3.915 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(F)c2[O-])o1 ZINC000368658239 1028392151 /nfs/dbraw/zinc/39/21/51/1028392151.db2.gz HUAVQJQBNKXVMX-HNNXBMFYSA-N 1 1 305.349 3.608 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(F)c2O)o1 ZINC000368658239 1028392167 /nfs/dbraw/zinc/39/21/67/1028392167.db2.gz HUAVQJQBNKXVMX-HNNXBMFYSA-N 1 1 305.349 3.608 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(F)c2O)o1 ZINC000368658239 1028392179 /nfs/dbraw/zinc/39/21/79/1028392179.db2.gz HUAVQJQBNKXVMX-HNNXBMFYSA-N 1 1 305.349 3.608 20 10 DHCDMO CSCc1cnc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000815136205 1028395349 /nfs/dbraw/zinc/39/53/49/1028395349.db2.gz RCGCWGFMXIIDCN-LBPRGKRZSA-N 1 1 321.515 3.923 20 10 DHCDMO C[C@H](C[C@H]1CCOC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815588348 1028559180 /nfs/dbraw/zinc/55/91/80/1028559180.db2.gz LHPQLDADUMAQOS-GRYCIOLGSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815588351 1028559289 /nfs/dbraw/zinc/55/92/89/1028559289.db2.gz LHPQLDADUMAQOS-WOPDTQHZSA-N 1 1 317.351 3.877 20 10 DHCDMO CCN(CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000815573856 1028566850 /nfs/dbraw/zinc/56/68/50/1028566850.db2.gz WBENPSGVXWRJIH-NSHDSACASA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1cccc(C(F)(F)F)c1O ZINC000815618207 1028571865 /nfs/dbraw/zinc/57/18/65/1028571865.db2.gz GTKUOQDBGMDUAD-MNOVXSKESA-N 1 1 301.308 3.754 20 10 DHCDMO C[C@@H]([NH2+]CCOC(F)(F)F)c1cccc(C(F)(F)F)c1O ZINC000815619338 1028572079 /nfs/dbraw/zinc/57/20/79/1028572079.db2.gz KGWAKLFHCLBNEQ-SSDOTTSWSA-N 1 1 317.229 3.598 20 10 DHCDMO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625462 1028577941 /nfs/dbraw/zinc/57/79/41/1028577941.db2.gz FAVROVWPGPHSRD-AUTRQRHGSA-N 1 1 305.365 3.813 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000077282343 1028818808 /nfs/dbraw/zinc/81/88/08/1028818808.db2.gz VTVONFDDBSDUBW-UHFFFAOYSA-N 1 1 300.368 3.917 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@@H]1CCCc2cccnc21 ZINC000372765004 1028897038 /nfs/dbraw/zinc/89/70/38/1028897038.db2.gz MCJICYFYHAVRHB-QGZVFWFLSA-N 1 1 312.413 3.695 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2ccc3ccccc3c2O)s1 ZINC000816516723 1028919888 /nfs/dbraw/zinc/91/98/88/1028919888.db2.gz OIBNWSQUMQCABL-UHFFFAOYSA-N 1 1 312.438 3.985 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCOC1CCCCC1 ZINC000816542044 1028926263 /nfs/dbraw/zinc/92/62/63/1028926263.db2.gz AZMITLLIFWPOGB-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO CO[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816537727 1028927295 /nfs/dbraw/zinc/92/72/95/1028927295.db2.gz PSQOMGQJQMFNOA-MRXNPFEDSA-N 1 1 309.768 3.662 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)ccc2ccccc21 ZINC000816521708 1028931361 /nfs/dbraw/zinc/93/13/61/1028931361.db2.gz XBSYGDLHACIQTL-WMZOPIPTSA-N 1 1 311.425 3.794 20 10 DHCDMO COc1cc(C)ccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816557588 1028942625 /nfs/dbraw/zinc/94/26/25/1028942625.db2.gz VXMYJEXQEZGOIZ-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO Cc1cccc(C[N@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1O ZINC000816643150 1028969154 /nfs/dbraw/zinc/96/91/54/1028969154.db2.gz WMROTGBFODFQJI-HNNXBMFYSA-N 1 1 317.351 3.632 20 10 DHCDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCCO1 ZINC000816675828 1028988759 /nfs/dbraw/zinc/98/87/59/1028988759.db2.gz MKIHBMAIRIOKHH-FQEVSTJZSA-N 1 1 316.489 3.924 20 10 DHCDMO Cc1cc(C)cc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938501 1029282547 /nfs/dbraw/zinc/28/25/47/1029282547.db2.gz LTSSXHXXEBSJJO-JXFKEZNVSA-N 1 1 311.473 3.720 20 10 DHCDMO Cc1cc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000817938118 1029284027 /nfs/dbraw/zinc/28/40/27/1029284027.db2.gz DUQYPXKLKKDKBE-SCLBCKFNSA-N 1 1 317.502 3.782 20 10 DHCDMO CC(C)[N@H+](C)CCN[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000155729985 1029287830 /nfs/dbraw/zinc/28/78/30/1029287830.db2.gz JPOFYBQAAAQVRW-KRWDZBQOSA-N 1 1 303.494 3.668 20 10 DHCDMO CC(C)[N@@H+](C)CCN[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000155729985 1029287846 /nfs/dbraw/zinc/28/78/46/1029287846.db2.gz JPOFYBQAAAQVRW-KRWDZBQOSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969046 1029310124 /nfs/dbraw/zinc/31/01/24/1029310124.db2.gz QHXUZPXVTLJCTR-NVXWUHKLSA-N 1 1 319.468 3.609 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000290443918 1030052366 /nfs/dbraw/zinc/05/23/66/1030052366.db2.gz LYVXWKXFTZNEQW-QGZVFWFLSA-N 1 1 316.424 3.569 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CCc3cccs3)CC2)cc1 ZINC000120960053 1030156038 /nfs/dbraw/zinc/15/60/38/1030156038.db2.gz VTVUPVPNUGFFKH-UHFFFAOYSA-N 1 1 316.470 3.512 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cn(C(C)C)nn2)cc1 ZINC000924710317 1030168785 /nfs/dbraw/zinc/16/87/85/1030168785.db2.gz JHTSAUWDLZNQCV-OAHLLOKOSA-N 1 1 315.465 3.556 20 10 DHCDMO C[C@H]1C[N@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCO1 ZINC000823394861 1030279480 /nfs/dbraw/zinc/27/94/80/1030279480.db2.gz DADDPXRYJBUQQS-HNNXBMFYSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCO1 ZINC000823394861 1030279491 /nfs/dbraw/zinc/27/94/91/1030279491.db2.gz DADDPXRYJBUQQS-HNNXBMFYSA-N 1 1 316.470 3.605 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@@H+](C)CC(C)(C)O)cc1 ZINC000823453351 1030292487 /nfs/dbraw/zinc/29/24/87/1030292487.db2.gz MMEUKJXQMJTXDM-UHFFFAOYSA-N 1 1 318.486 3.587 20 10 DHCDMO CC[N@@H+](CCCO)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823464634 1030294163 /nfs/dbraw/zinc/29/41/63/1030294163.db2.gz IOQIUGZOIVXGLG-UHFFFAOYSA-N 1 1 318.486 3.589 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nn(C)cc2C(F)F)cc1 ZINC000866567558 1030377499 /nfs/dbraw/zinc/37/74/99/1030377499.db2.gz QPBISGCMYAWOJH-LBPRGKRZSA-N 1 1 322.403 3.665 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1C ZINC000824695935 1030613791 /nfs/dbraw/zinc/61/37/91/1030613791.db2.gz DXJZDXYLDFRYAP-KURKYZTESA-N 1 1 303.446 3.525 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)cc1 ZINC000824691127 1030614936 /nfs/dbraw/zinc/61/49/36/1030614936.db2.gz UJYHJNPSSLXWBZ-SFHVURJKSA-N 1 1 318.848 3.571 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)CC2(O)CCCCCC2)c(Cl)c1 ZINC001308706943 1030630133 /nfs/dbraw/zinc/63/01/33/1030630133.db2.gz YWVNUWDNDKIVDO-UHFFFAOYSA-N 1 1 311.853 3.871 20 10 DHCDMO C[C@]1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1(Cl)Cl ZINC000824780338 1030636197 /nfs/dbraw/zinc/63/61/97/1030636197.db2.gz KWCLMNVKYUTRDU-LLVKDONJSA-N 1 1 312.599 3.858 20 10 DHCDMO CC(C)[C@H]1C[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000824800526 1030641332 /nfs/dbraw/zinc/64/13/32/1030641332.db2.gz YZBVMRMGFFNDPO-IAQYHMDHSA-N 1 1 315.816 3.726 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926915211 1030986966 /nfs/dbraw/zinc/98/69/66/1030986966.db2.gz KGWYDGSZBDONMW-NURSFMCSSA-N 1 1 321.314 3.682 20 10 DHCDMO CC[N@H+](Cc1ccccc1O)Cc1c(F)ccc(OC)c1F ZINC001143980088 1031145549 /nfs/dbraw/zinc/14/55/49/1031145549.db2.gz BKHIDJPPHXSYME-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(F)ccc(OC)c1F ZINC001143980088 1031145555 /nfs/dbraw/zinc/14/55/55/1031145555.db2.gz BKHIDJPPHXSYME-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c(O)c1 ZINC000292742517 1031153979 /nfs/dbraw/zinc/15/39/79/1031153979.db2.gz HOFDIAJNFVPZSL-JKSUJKDBSA-N 1 1 311.372 3.658 20 10 DHCDMO CCOc1c(F)cc(C[N@@H+](C)Cc2ccccc2O)cc1F ZINC001144033590 1031198501 /nfs/dbraw/zinc/19/85/01/1031198501.db2.gz XMSLTZORBNNNAQ-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000844919026 1031402140 /nfs/dbraw/zinc/40/21/40/1031402140.db2.gz BHFRUELFAISKKJ-CYBMUJFWSA-N 1 1 316.367 3.581 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc(O)ccc1F ZINC000872028560 1031411331 /nfs/dbraw/zinc/41/13/31/1031411331.db2.gz KMWRSPRXZHDSHW-LLVKDONJSA-N 1 1 306.356 3.587 20 10 DHCDMO CC1(C)CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144298407 1031437796 /nfs/dbraw/zinc/43/77/96/1031437796.db2.gz CZEWDASYQFEISC-UHFFFAOYSA-N 1 1 302.187 3.668 20 10 DHCDMO CC1(C)CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144298407 1031437802 /nfs/dbraw/zinc/43/78/02/1031437802.db2.gz CZEWDASYQFEISC-UHFFFAOYSA-N 1 1 302.187 3.668 20 10 DHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144298334 1031437751 /nfs/dbraw/zinc/43/77/51/1031437751.db2.gz BTLBNOKPRQOAKH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298334 1031437758 /nfs/dbraw/zinc/43/77/58/1031437758.db2.gz BTLBNOKPRQOAKH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@H]1CCCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298334 1031437764 /nfs/dbraw/zinc/43/77/64/1031437764.db2.gz BTLBNOKPRQOAKH-JTQLQIEISA-N 1 1 316.214 3.916 20 10 DHCDMO CC1(C)CCC[N@H+]1Cc1cc(Br)c(F)cc1[O-] ZINC001144298407 1031437790 /nfs/dbraw/zinc/43/77/90/1031437790.db2.gz CZEWDASYQFEISC-UHFFFAOYSA-N 1 1 302.187 3.668 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-])c1nccs1 ZINC000293622834 1031542990 /nfs/dbraw/zinc/54/29/90/1031542990.db2.gz MPQMWZPIGHIAAA-VIFPVBQESA-N 1 1 314.813 3.877 20 10 DHCDMO C[C@@H](C[N@H+](C)Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293622834 1031542999 /nfs/dbraw/zinc/54/29/99/1031542999.db2.gz MPQMWZPIGHIAAA-VIFPVBQESA-N 1 1 314.813 3.877 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293622834 1031543008 /nfs/dbraw/zinc/54/30/08/1031543008.db2.gz MPQMWZPIGHIAAA-VIFPVBQESA-N 1 1 314.813 3.877 20 10 DHCDMO Cc1nnsc1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000293751303 1031602066 /nfs/dbraw/zinc/60/20/66/1031602066.db2.gz RLDDVNIVHPEOCG-LURJTMIESA-N 1 1 318.229 3.710 20 10 DHCDMO COCC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccco1 ZINC000293753085 1031604374 /nfs/dbraw/zinc/60/43/74/1031604374.db2.gz YGXLDCYMEOORRM-CYBMUJFWSA-N 1 1 313.756 3.645 20 10 DHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc(C)c(C)cc3O)C2)n1 ZINC000872807327 1031664207 /nfs/dbraw/zinc/66/42/07/1031664207.db2.gz NKOOWWIOSAWQFV-AWEZNQCLSA-N 1 1 302.443 3.763 20 10 DHCDMO C[N@@H+](Cc1ccc2ccccc2c1)Cc1c(O)cc(O)cc1O ZINC001144515156 1031674476 /nfs/dbraw/zinc/67/44/76/1031674476.db2.gz FXRLABLVWSLNQG-UHFFFAOYSA-N 1 1 309.365 3.589 20 10 DHCDMO CC(C)c1nccn1C[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC000361065972 1031707010 /nfs/dbraw/zinc/70/70/10/1031707010.db2.gz IXVUMNPZGJVZTG-INIZCTEOSA-N 1 1 317.408 3.516 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2(C)CC(F)(F)C2)c1 ZINC000873197953 1031754296 /nfs/dbraw/zinc/75/42/96/1031754296.db2.gz WUDKVSLJBGPFTJ-UHFFFAOYSA-N 1 1 320.177 3.741 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1 ZINC000846105387 1031881047 /nfs/dbraw/zinc/88/10/47/1031881047.db2.gz TVHIVPBSWWRJFR-NJELEJDNSA-N 1 1 306.400 3.887 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(F)c(F)cc2[O-])Cc2ccccc21 ZINC001142527056 1031906954 /nfs/dbraw/zinc/90/69/54/1031906954.db2.gz ISCCKWNQCDMIQP-UHFFFAOYSA-N 1 1 303.352 3.964 20 10 DHCDMO CC1(C)C[N@H+](Cc2cc(F)c(F)cc2O)Cc2ccccc21 ZINC001142527056 1031906963 /nfs/dbraw/zinc/90/69/63/1031906963.db2.gz ISCCKWNQCDMIQP-UHFFFAOYSA-N 1 1 303.352 3.964 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1ccccc1F)[C@H](C)O)c1ccc(F)cc1O ZINC000846181885 1031912720 /nfs/dbraw/zinc/91/27/20/1031912720.db2.gz FOVZEUCZNWCNEG-PBQZTSCYSA-N 1 1 321.367 3.833 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071982 1031943947 /nfs/dbraw/zinc/94/39/47/1031943947.db2.gz WTNJIRJSFYVZMS-LLVKDONJSA-N 1 1 308.834 3.567 20 10 DHCDMO COc1cc(C[N@@H+](Cc2ccc(C)cc2O)C2CC2)ccc1O ZINC000877424218 1033296225 /nfs/dbraw/zinc/29/62/25/1033296225.db2.gz UABOZBRTCNYZNP-UHFFFAOYSA-N 1 1 313.397 3.579 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)CC1CCC1 ZINC000877479400 1033316636 /nfs/dbraw/zinc/31/66/36/1033316636.db2.gz CSKSFHKSZIJFEW-UHFFFAOYSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(O)c1 ZINC000877519669 1033334760 /nfs/dbraw/zinc/33/47/60/1033334760.db2.gz ZEHHAKMEENOLML-AQNXPRMDSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1ccc(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)c(O)c1 ZINC000877563843 1033359045 /nfs/dbraw/zinc/35/90/45/1033359045.db2.gz SNCYXWWULCBZCS-MRXNPFEDSA-N 1 1 305.805 3.519 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](O)C[C@H]1c1ccccc1 ZINC000877672367 1033404349 /nfs/dbraw/zinc/40/43/49/1033404349.db2.gz CPRHVIVTDVQTRU-IRXDYDNUSA-N 1 1 317.816 3.744 20 10 DHCDMO COCc1ccccc1/C=C(\C)C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703284 1033417773 /nfs/dbraw/zinc/41/77/73/1033417773.db2.gz ZYWBPMGEVAPFLK-XNTDXEJSSA-N 1 1 309.409 3.958 20 10 DHCDMO Cc1nn(-c2ccccc2)c(C)c1C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703362 1033418392 /nfs/dbraw/zinc/41/83/92/1033418392.db2.gz DWFBNQUCDGSWIQ-UHFFFAOYSA-N 1 1 319.408 3.711 20 10 DHCDMO CO[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001172939430 1033478267 /nfs/dbraw/zinc/47/82/67/1033478267.db2.gz POBZUQGDHVIDAI-MOPGFXCFSA-N 1 1 302.462 3.676 20 10 DHCDMO C[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000927065248 1033482543 /nfs/dbraw/zinc/48/25/43/1033482543.db2.gz GCSOEXULYYXETL-PLQHRBFRSA-N 1 1 309.837 3.901 20 10 DHCDMO CCC[N@@H+](Cc1nc2c(o1)CCCC2)Cc1ccccc1O ZINC000878151454 1033598212 /nfs/dbraw/zinc/59/82/12/1033598212.db2.gz QURQAYIDGOCGMO-UHFFFAOYSA-N 1 1 300.402 3.671 20 10 DHCDMO CCSC[C@@H](C)[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001173304805 1033659448 /nfs/dbraw/zinc/65/94/48/1033659448.db2.gz KDSWTHGDMNAIRB-CYBMUJFWSA-N 1 1 318.486 3.687 20 10 DHCDMO CCCC[N@H+](Cc1nc(CC2CC2)no1)Cc1ccccc1O ZINC000878564941 1033754388 /nfs/dbraw/zinc/75/43/88/1033754388.db2.gz GNJGCJSOVCBGGR-UHFFFAOYSA-N 1 1 315.417 3.530 20 10 DHCDMO CCCC[N@@H+](Cc1nc(CC2CC2)no1)Cc1ccccc1O ZINC000878564941 1033754405 /nfs/dbraw/zinc/75/44/05/1033754405.db2.gz GNJGCJSOVCBGGR-UHFFFAOYSA-N 1 1 315.417 3.530 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1 ZINC000862476390 1033864101 /nfs/dbraw/zinc/86/41/01/1033864101.db2.gz SAVUNZGRDGMCNC-LPHOPBHVSA-N 1 1 316.489 3.833 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1O ZINC000862485206 1033867567 /nfs/dbraw/zinc/86/75/67/1033867567.db2.gz JUKQXAILHZGHDD-ZBFHGGJFSA-N 1 1 319.445 3.500 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000862528641 1033872993 /nfs/dbraw/zinc/87/29/93/1033872993.db2.gz FEQUHRNJMGMZOM-YESZJQIVSA-N 1 1 309.409 3.636 20 10 DHCDMO COc1cccc2c1C[N@H+](C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000862530201 1033875820 /nfs/dbraw/zinc/87/58/20/1033875820.db2.gz WSMADMOGBZOCBB-AATRIKPKSA-N 1 1 308.425 3.790 20 10 DHCDMO COc1cccc2c1C[N@@H+](C/C=C/c1ccc(N(C)C)cc1)C2 ZINC000862530201 1033875841 /nfs/dbraw/zinc/87/58/41/1033875841.db2.gz WSMADMOGBZOCBB-AATRIKPKSA-N 1 1 308.425 3.790 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1F ZINC000862540977 1033883617 /nfs/dbraw/zinc/88/36/17/1033883617.db2.gz MUFSCNQQNDYFGT-MRXNPFEDSA-N 1 1 314.404 3.587 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](COC)c2ccco2)cc1F ZINC000177573952 1034169028 /nfs/dbraw/zinc/16/90/28/1034169028.db2.gz YSMDNILTLXEOHI-INIZCTEOSA-N 1 1 320.408 3.742 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3cccn3C)c2c1 ZINC000128356145 1034295877 /nfs/dbraw/zinc/29/58/77/1034295877.db2.gz QJXZIRLEOOQMKQ-UHFFFAOYSA-N 1 1 310.397 3.525 20 10 DHCDMO Cc1cccc2c(C[N@H+](C)Cc3ccc(N(C)C)cc3)[nH]nc21 ZINC001137150751 1034298271 /nfs/dbraw/zinc/29/82/71/1034298271.db2.gz VDQLVKLIODPDQP-UHFFFAOYSA-N 1 1 308.429 3.569 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)cc1OC ZINC000179630815 1034320375 /nfs/dbraw/zinc/32/03/75/1034320375.db2.gz HZIZEGKTNGDJSU-GFCCVEGCSA-N 1 1 319.376 3.742 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccccc2F)cc1OC ZINC000179677367 1034324016 /nfs/dbraw/zinc/32/40/16/1034324016.db2.gz RJWPLUZCUAELLJ-GFCCVEGCSA-N 1 1 319.376 3.742 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@H]2c2ccncc2)c1 ZINC000183447327 1034388193 /nfs/dbraw/zinc/38/81/93/1034388193.db2.gz SGDNAUNMUDAWKP-SFHVURJKSA-N 1 1 312.413 3.913 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)[C@@H](C)c2ccncc2)c(O)c1 ZINC000183715071 1034413753 /nfs/dbraw/zinc/41/37/53/1034413753.db2.gz GCFRPEUEGKQYDK-AWEZNQCLSA-N 1 1 300.402 3.769 20 10 DHCDMO CC[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccc(C)cc1O ZINC000794814823 1034521917 /nfs/dbraw/zinc/52/19/17/1034521917.db2.gz UCPPCTXSXYIRAP-MRXNPFEDSA-N 1 1 322.412 3.727 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(F)cc1O ZINC000185532229 1034554659 /nfs/dbraw/zinc/55/46/59/1034554659.db2.gz RHQYLOFGXFBOPO-CXAGYDPISA-N 1 1 303.377 3.696 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(F)cc2O)o1 ZINC000185548037 1034556511 /nfs/dbraw/zinc/55/65/11/1034556511.db2.gz LUROQLKHYMCTGT-XHDPSFHLSA-N 1 1 307.365 3.725 20 10 DHCDMO Cc1ccc(O)c([C@H](C)[NH2+]C2CCN(C3CCCC3)CC2)c1 ZINC000185648908 1034562610 /nfs/dbraw/zinc/56/26/10/1034562610.db2.gz LKULHSMGRKBENO-HNNXBMFYSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@@H](O)C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185737682 1034569689 /nfs/dbraw/zinc/56/96/89/1034569689.db2.gz RETCEYUXWAIXCX-IJEWVQPXSA-N 1 1 317.404 3.737 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccc(F)cc1O ZINC000186159409 1034604889 /nfs/dbraw/zinc/60/48/89/1034604889.db2.gz WDEDUJARXHCCPT-ACJLOTCBSA-N 1 1 315.388 3.696 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccc(F)cc1O ZINC000186620939 1034649287 /nfs/dbraw/zinc/64/92/87/1034649287.db2.gz QPJPTJVDRSFCNU-LBPRGKRZSA-N 1 1 303.377 3.610 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(F)cc1O ZINC000191856243 1034767249 /nfs/dbraw/zinc/76/72/49/1034767249.db2.gz QTKKRSYVMZSIPV-RFUYNDQBSA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccccn1)c1cc(Cl)c(Cl)cc1O ZINC000192592167 1034810524 /nfs/dbraw/zinc/81/05/24/1034810524.db2.gz WXVIOEWGBKAOMU-SNVBAGLBSA-N 1 1 311.212 3.987 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000195134689 1035415067 /nfs/dbraw/zinc/41/50/67/1035415067.db2.gz XPGHJKOOTMZXDK-SJLPKXTDSA-N 1 1 310.441 3.565 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000773732502 1035417674 /nfs/dbraw/zinc/41/76/74/1035417674.db2.gz CGGLRIJTKBYDIZ-UHFFFAOYSA-N 1 1 313.401 3.683 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C[C@@H](C)O)C2CCCCC2)cc1 ZINC000773756434 1035436352 /nfs/dbraw/zinc/43/63/52/1035436352.db2.gz ILRRJHXZWXUTOW-MRXNPFEDSA-N 1 1 304.478 3.658 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](CCO)c2ccccc2)cc1 ZINC000773750890 1035436364 /nfs/dbraw/zinc/43/63/64/1035436364.db2.gz FNQBCRFSNAQOEW-HXUWFJFHSA-N 1 1 312.457 3.698 20 10 DHCDMO Cc1cccc2c1OC[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC001178852756 1035451561 /nfs/dbraw/zinc/45/15/61/1035451561.db2.gz XXTXWLNYOGDBPD-GFCCVEGCSA-N 1 1 321.779 3.586 20 10 DHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC001180017608 1035569677 /nfs/dbraw/zinc/56/96/77/1035569677.db2.gz HXVUIBJRIVQYLE-LLVKDONJSA-N 1 1 302.434 3.604 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc(Cl)cc2O)C1 ZINC001180042987 1035573226 /nfs/dbraw/zinc/57/32/26/1035573226.db2.gz NQJIOXOWLZKFFU-JKIFEVAISA-N 1 1 322.880 3.883 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(N(C)CC)cc2)o1 ZINC000773838932 1035595628 /nfs/dbraw/zinc/59/56/28/1035595628.db2.gz ODAHYCBWQMKASH-SFHVURJKSA-N 1 1 316.445 3.775 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2C)CCO1 ZINC001180120244 1035605195 /nfs/dbraw/zinc/60/51/95/1035605195.db2.gz GJCDRICTQRVITL-OAQYLSRUSA-N 1 1 324.468 3.943 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](CCO)Cc1cc(Cl)c(F)cc1O ZINC001180188254 1035608462 /nfs/dbraw/zinc/60/84/62/1035608462.db2.gz DDXHREVQXIHBOF-GFCCVEGCSA-N 1 1 323.795 3.740 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1cc(Cl)c(F)cc1O ZINC001180188254 1035608468 /nfs/dbraw/zinc/60/84/68/1035608468.db2.gz DDXHREVQXIHBOF-GFCCVEGCSA-N 1 1 323.795 3.740 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CCN(C)c3ccccc3C2)cc1 ZINC001180213040 1035624233 /nfs/dbraw/zinc/62/42/33/1035624233.db2.gz NNHFNDNBHSZOHV-VOTSOKGWSA-N 1 1 321.468 3.718 20 10 DHCDMO CC[C@H]1CO[C@@](C)(CCC(C)C)[N@@H+]1Cc1ccc(O)cc1O ZINC001204281099 1035769023 /nfs/dbraw/zinc/76/90/23/1035769023.db2.gz QMQGYMPZTVXJJK-YJBOKZPZSA-N 1 1 307.434 3.861 20 10 DHCDMO CC[C@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1ccc(O)cc1O ZINC001204281099 1035769039 /nfs/dbraw/zinc/76/90/39/1035769039.db2.gz QMQGYMPZTVXJJK-YJBOKZPZSA-N 1 1 307.434 3.861 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCOc3cc(O)ccc3C2)c1 ZINC001181688292 1035954674 /nfs/dbraw/zinc/95/46/74/1035954674.db2.gz RRCXLXYRKABXCD-UHFFFAOYSA-N 1 1 313.397 3.616 20 10 DHCDMO CC(C)[C@@H](CO)[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)C(C)C ZINC001181891534 1036035150 /nfs/dbraw/zinc/03/51/50/1036035150.db2.gz BJPSTHZRNNUFKS-MLGOLLRUSA-N 1 1 317.832 3.563 20 10 DHCDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cc(F)cc(C(C)=O)c1O ZINC000773963132 1036075936 /nfs/dbraw/zinc/07/59/36/1036075936.db2.gz JJYFYHJRFLTNNL-SFHVURJKSA-N 1 1 323.408 3.515 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2ccccc2N(C)C)ccc1N(C)C ZINC001194890418 1036082225 /nfs/dbraw/zinc/08/22/25/1036082225.db2.gz HMTPICVJKCXWKO-UHFFFAOYSA-N 1 1 311.473 3.759 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774131713 1036188888 /nfs/dbraw/zinc/18/88/88/1036188888.db2.gz RJCSWJQZIOOOFI-XPTSAGLGSA-N 1 1 317.260 3.690 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)[nH]n1 ZINC000774202244 1036222647 /nfs/dbraw/zinc/22/26/47/1036222647.db2.gz QHTRRIXABIHCPJ-QMMMGPOBSA-N 1 1 300.189 3.581 20 10 DHCDMO CC(C)[C@@H](CCO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774210900 1036229248 /nfs/dbraw/zinc/22/92/48/1036229248.db2.gz HRZSLRCFDBPGRF-TVQRCGJNSA-N 1 1 306.233 3.757 20 10 DHCDMO CC[C@H](O)CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774252239 1036256683 /nfs/dbraw/zinc/25/66/83/1036256683.db2.gz KIECACFFUXDIBV-ZJUUUORDSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@H](CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[S@](C)=O ZINC000774259045 1036263479 /nfs/dbraw/zinc/26/34/79/1036263479.db2.gz WGPDWBMSDVBHTI-MGOSUKFUSA-N 1 1 324.273 3.507 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1cn[nH]c1 ZINC000774266929 1036267355 /nfs/dbraw/zinc/26/73/55/1036267355.db2.gz SKJDMZFGFXVMSL-SFYZADRCSA-N 1 1 300.189 3.834 20 10 DHCDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2cccc(C)c2O)c1 ZINC000775659995 1036269861 /nfs/dbraw/zinc/26/98/61/1036269861.db2.gz QVTJYLQOKGWCEQ-SFHVURJKSA-N 1 1 311.425 3.916 20 10 DHCDMO C[C@H]([NH2+]CC1(CCO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774372186 1036304253 /nfs/dbraw/zinc/30/42/53/1036304253.db2.gz WEEPKJZDTXBJIZ-VIFPVBQESA-N 1 1 304.217 3.512 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@H]2CCCN(c3ccccc3)C2)c1O ZINC000775709136 1036507269 /nfs/dbraw/zinc/50/72/69/1036507269.db2.gz QTEBYNDNNXCUPR-IBGZPJMESA-N 1 1 310.441 3.801 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@@H]2C)c1 ZINC000775724573 1036566088 /nfs/dbraw/zinc/56/60/88/1036566088.db2.gz MBWNZPSZVFSXEB-RDJZCZTQSA-N 1 1 311.425 3.854 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1O ZINC000775726668 1036574859 /nfs/dbraw/zinc/57/48/59/1036574859.db2.gz WBGVHWHMTCOMSQ-AWEZNQCLSA-N 1 1 309.837 3.603 20 10 DHCDMO CCc1cc(C[N@H+]2CCOCC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000774660853 1036648495 /nfs/dbraw/zinc/64/84/95/1036648495.db2.gz ROTREPRQZRHRFC-AWEZNQCLSA-N 1 1 305.462 3.863 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc2c(c1)CCO2 ZINC001184035540 1036733848 /nfs/dbraw/zinc/73/38/48/1036733848.db2.gz PKKYBIANDKGCIZ-SNVBAGLBSA-N 1 1 321.779 3.970 20 10 DHCDMO Cc1nccn1CCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000762916554 1037065806 /nfs/dbraw/zinc/06/58/06/1037065806.db2.gz HRKBWMMYRKYAIY-UHFFFAOYSA-N 1 1 314.477 3.558 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)CC2)cc1 ZINC001198706109 1037114449 /nfs/dbraw/zinc/11/44/49/1037114449.db2.gz NXJSMZZEAYNMFX-HXUWFJFHSA-N 1 1 310.441 3.716 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@H]2CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774863514 1037131058 /nfs/dbraw/zinc/13/10/58/1037131058.db2.gz OEYKXMZNVWQFHC-ZDUSSCGKSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@H]2CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774863514 1037131064 /nfs/dbraw/zinc/13/10/64/1037131064.db2.gz OEYKXMZNVWQFHC-ZDUSSCGKSA-N 1 1 322.405 3.710 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H](C(C)C)N2CCCC2)c(Cl)c1 ZINC001199161217 1037210627 /nfs/dbraw/zinc/21/06/27/1037210627.db2.gz IMGHFDHRGGAUHW-INIZCTEOSA-N 1 1 310.869 3.564 20 10 DHCDMO COc1c(O)c(C[NH2+]CCCC2CCCCC2)ccc1[N+](=O)[O-] ZINC000774964471 1037295198 /nfs/dbraw/zinc/29/51/98/1037295198.db2.gz VTAZVXOYSKHELA-UHFFFAOYSA-N 1 1 322.405 3.759 20 10 DHCDMO Cc1ccc(NCc2cc(Br)cc(C)c2O)[nH+]c1 ZINC000776031734 1037361307 /nfs/dbraw/zinc/36/13/07/1037361307.db2.gz OHUIBMSZBQVKLJ-UHFFFAOYSA-N 1 1 307.191 3.779 20 10 DHCDMO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775005240 1037366330 /nfs/dbraw/zinc/36/63/30/1037366330.db2.gz QKPMPIIEXPHMMF-OCCSQVGLSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCC[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775014919 1037397462 /nfs/dbraw/zinc/39/74/62/1037397462.db2.gz XHWUCAFRTNLEMN-GXTWGEPZSA-N 1 1 322.405 3.613 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)cc1 ZINC000105498746 1037414032 /nfs/dbraw/zinc/41/40/32/1037414032.db2.gz MCWAOISVOXFTDC-UHFFFAOYSA-N 1 1 303.475 3.796 20 10 DHCDMO COc1c(O)c(C[NH2+]CC[C@@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775020565 1037425468 /nfs/dbraw/zinc/42/54/68/1037425468.db2.gz JSCHTLOTQWEVCP-STQMWFEESA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775025127 1037427963 /nfs/dbraw/zinc/42/79/63/1037427963.db2.gz BZOSKJMTLPBWSV-UONOGXRCSA-N 1 1 322.405 3.613 20 10 DHCDMO CO[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@H]1C ZINC000784668953 1037461779 /nfs/dbraw/zinc/46/17/79/1037461779.db2.gz WXZRFDARWQCJJI-VQIMIIECSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1c2ccccc2oc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC001202066392 1038005135 /nfs/dbraw/zinc/00/51/35/1038005135.db2.gz WTEMPDHJAHKLDA-UHFFFAOYSA-N 1 1 319.307 3.715 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@H](C(=O)OC)c1ccccc1 ZINC000157058886 1038492658 /nfs/dbraw/zinc/49/26/58/1038492658.db2.gz UWDQZHPQRPNXMG-SFHVURJKSA-N 1 1 313.397 3.519 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C(=O)OC)c1ccccc1 ZINC000157058886 1038492660 /nfs/dbraw/zinc/49/26/60/1038492660.db2.gz UWDQZHPQRPNXMG-SFHVURJKSA-N 1 1 313.397 3.519 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCCN(c3ccccc3)C2)cc1 ZINC001191415988 1038500739 /nfs/dbraw/zinc/50/07/39/1038500739.db2.gz DIHAZYBSLHSWDB-NRFANRHFSA-N 1 1 323.484 3.853 20 10 DHCDMO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000170789453 1038965458 /nfs/dbraw/zinc/96/54/58/1038965458.db2.gz LMKJLRWJZBWQHU-OLZOCXBDSA-N 1 1 303.377 3.909 20 10 DHCDMO CCC[N@H+](C)C[C@@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450053 1040292034 /nfs/dbraw/zinc/29/20/34/1040292034.db2.gz VAZNHQWUSJSBSD-KRWDZBQOSA-N 1 1 318.505 3.988 20 10 DHCDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450053 1040292054 /nfs/dbraw/zinc/29/20/54/1040292054.db2.gz VAZNHQWUSJSBSD-KRWDZBQOSA-N 1 1 318.505 3.988 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCc3cc(F)ccc3C2)c1O ZINC000761215563 1040673540 /nfs/dbraw/zinc/67/35/40/1040673540.db2.gz RNNSBDAPWRTWER-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3cc(F)ccc3C2)c1O ZINC000761215563 1040673545 /nfs/dbraw/zinc/67/35/45/1040673545.db2.gz RNNSBDAPWRTWER-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO C[C@@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@@H+]1C ZINC000093644405 193280519 /nfs/dbraw/zinc/28/05/19/193280519.db2.gz VIZPDUHPMOWJOV-ZWNOBZJWSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@H+]1C ZINC000093644405 193280521 /nfs/dbraw/zinc/28/05/21/193280521.db2.gz VIZPDUHPMOWJOV-ZWNOBZJWSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644405 193280523 /nfs/dbraw/zinc/28/05/23/193280523.db2.gz VIZPDUHPMOWJOV-ZWNOBZJWSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644405 193280524 /nfs/dbraw/zinc/28/05/24/193280524.db2.gz VIZPDUHPMOWJOV-ZWNOBZJWSA-N 1 1 317.260 3.614 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000272249177 130011917 /nfs/dbraw/zinc/01/19/17/130011917.db2.gz IAPYLSSUJWOVJH-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1O ZINC000273723058 130159012 /nfs/dbraw/zinc/15/90/12/130159012.db2.gz ITCNHYNUPADBFP-AWEZNQCLSA-N 1 1 306.793 3.719 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000278367473 130686522 /nfs/dbraw/zinc/68/65/22/130686522.db2.gz BXDLISQLTRXBSK-OPRDCNLKSA-N 1 1 304.217 3.917 20 10 DHCDMO Cc1noc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000284206518 131059030 /nfs/dbraw/zinc/05/90/30/131059030.db2.gz ZEUMIARHSKGSGP-UHFFFAOYSA-N 1 1 323.396 3.776 20 10 DHCDMO CCc1noc(CC)c1C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000285520218 131176718 /nfs/dbraw/zinc/17/67/18/131176718.db2.gz BBZYYJMTRFQWLB-AWEZNQCLSA-N 1 1 306.381 3.885 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(N(C)C)cc1 ZINC000285747628 131198607 /nfs/dbraw/zinc/19/86/07/131198607.db2.gz RSROIYQGANZOCZ-RYUDHWBXSA-N 1 1 305.372 3.838 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)cc1OC)c1ccc(F)cc1O ZINC000285906146 131209187 /nfs/dbraw/zinc/20/91/87/131209187.db2.gz CXRINKZJEZRKNM-MRXNPFEDSA-N 1 1 319.376 3.789 20 10 DHCDMO CCc1nc(N2CC=C(c3c[nH]c4ncccc34)CC2)cc(C)[nH+]1 ZINC000286036482 131217348 /nfs/dbraw/zinc/21/73/48/131217348.db2.gz GVWHERBRQCCGEC-UHFFFAOYSA-N 1 1 319.412 3.517 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(F)cc1O ZINC000286225534 131225681 /nfs/dbraw/zinc/22/56/81/131225681.db2.gz SNGZBXSYSFNNKD-INIZCTEOSA-N 1 1 302.393 3.838 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1ccc(F)cc1O ZINC000286232809 131225760 /nfs/dbraw/zinc/22/57/60/131225760.db2.gz SXORGHOSISTGFK-MRXNPFEDSA-N 1 1 313.376 3.728 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000287035337 131260487 /nfs/dbraw/zinc/26/04/87/131260487.db2.gz MBIHSRRBJXKUTF-BDJLRTHQSA-N 1 1 323.795 3.959 20 10 DHCDMO CCCC[N@@H+](Cc1cnc([C@H](C)O)s1)Cc1ccccc1O ZINC000289546010 131394800 /nfs/dbraw/zinc/39/48/00/131394800.db2.gz FWYSHFDSEMPOKV-ZDUSSCGKSA-N 1 1 320.458 3.704 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(N(C)C)cc1 ZINC000297151452 132002478 /nfs/dbraw/zinc/00/24/78/132002478.db2.gz CJDPDURQTBRUFR-LLVKDONJSA-N 1 1 307.800 3.791 20 10 DHCDMO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)oc1C ZINC000299327691 132099232 /nfs/dbraw/zinc/09/92/32/132099232.db2.gz QGDCZMRYYAATRF-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)oc1C ZINC000299327691 132099233 /nfs/dbraw/zinc/09/92/33/132099233.db2.gz QGDCZMRYYAATRF-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO C[C@H]([NH2+]Cc1ccccc1-n1cccn1)c1ccc(F)cc1O ZINC000170789656 332636625 /nfs/dbraw/zinc/63/66/25/332636625.db2.gz BOQCXJDTXGBMNO-ZDUSSCGKSA-N 1 1 311.360 3.568 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccccc1-n1cccn1)c1ccc(F)cc1O ZINC000170789658 332636656 /nfs/dbraw/zinc/63/66/56/332636656.db2.gz BOQCXJDTXGBMNO-CYBMUJFWSA-N 1 1 311.360 3.568 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1O ZINC000294986482 335129582 /nfs/dbraw/zinc/12/95/82/335129582.db2.gz KFFGXSSTJZIFCK-YPMHNXCESA-N 1 1 317.351 3.954 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000271362380 334021405 /nfs/dbraw/zinc/02/14/05/334021405.db2.gz NPNMQTASPHGNMK-GDBMZVCRSA-N 1 1 303.427 3.542 20 10 DHCDMO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cs1 ZINC000273460896 334047221 /nfs/dbraw/zinc/04/72/21/334047221.db2.gz CQDIWLMCQHGBMN-UWVGGRQHSA-N 1 1 310.394 3.546 20 10 DHCDMO Clc1c[nH+]ccc1NCc1ccc(N2CCSCC2)cc1 ZINC000301601982 336317736 /nfs/dbraw/zinc/31/77/36/336317736.db2.gz VXGPYTLPXNTUMI-UHFFFAOYSA-N 1 1 319.861 3.900 20 10 DHCDMO CC[C@H]([NH2+][C@H]1COc2cccc(F)c21)c1ccc(F)cc1O ZINC000367620528 336826786 /nfs/dbraw/zinc/82/67/86/336826786.db2.gz YFCUKPDANWSEQX-KBPBESRZSA-N 1 1 305.324 3.845 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000375256590 337006594 /nfs/dbraw/zinc/00/65/94/337006594.db2.gz SUJQRTGGXMKBLT-ICSRJNTNSA-N 1 1 309.409 3.975 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000375255465 337006700 /nfs/dbraw/zinc/00/67/00/337006700.db2.gz GNAJJCICETUFCD-DOTOQJQBSA-N 1 1 313.445 3.532 20 10 DHCDMO Cc1cccc(-c2nnc([C@@H](C)[N@H+](C)Cc3ccccc3O)o2)c1 ZINC000377600656 337055871 /nfs/dbraw/zinc/05/58/71/337055871.db2.gz KEVQJPFSKIBUTG-CQSZACIVSA-N 1 1 323.396 3.944 20 10 DHCDMO Cc1cccc(-c2nnc([C@@H](C)[N@@H+](C)Cc3ccccc3O)o2)c1 ZINC000377600656 337055872 /nfs/dbraw/zinc/05/58/72/337055872.db2.gz KEVQJPFSKIBUTG-CQSZACIVSA-N 1 1 323.396 3.944 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000377615650 337056308 /nfs/dbraw/zinc/05/63/08/337056308.db2.gz MZDWLXVAXLBXMD-GJZGRUSLSA-N 1 1 301.390 3.762 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000377615650 337056309 /nfs/dbraw/zinc/05/63/09/337056309.db2.gz MZDWLXVAXLBXMD-GJZGRUSLSA-N 1 1 301.390 3.762 20 10 DHCDMO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+](C)Cc1ccccc1O ZINC000109773454 337388544 /nfs/dbraw/zinc/38/85/44/337388544.db2.gz FBXVZQQVHBWLFD-ZDUSSCGKSA-N 1 1 309.369 3.635 20 10 DHCDMO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)Cc1ccccc1O ZINC000109773454 337388545 /nfs/dbraw/zinc/38/85/45/337388545.db2.gz FBXVZQQVHBWLFD-ZDUSSCGKSA-N 1 1 309.369 3.635 20 10 DHCDMO COc1cccc([C@H](C[NH2+][C@H](C)c2ccc(F)cc2O)OC)c1 ZINC000527929618 337776373 /nfs/dbraw/zinc/77/63/73/337776373.db2.gz STLLUMPTRKSIEF-XIKOKIGWSA-N 1 1 319.376 3.578 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](c3nccs3)C2)cc1C ZINC000156543237 525315662 /nfs/dbraw/zinc/31/56/62/525315662.db2.gz QSBJNYJWPVMFPM-CQSZACIVSA-N 1 1 302.443 3.845 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000180285520 525340054 /nfs/dbraw/zinc/34/00/54/525340054.db2.gz FHPWJQBIYNZLLY-PEBXRYMYSA-N 1 1 317.454 3.631 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCCO2 ZINC000170789220 525531318 /nfs/dbraw/zinc/53/13/18/525531318.db2.gz RNPVKFWRNYJRAZ-RYUDHWBXSA-N 1 1 317.360 3.714 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccc(NC(C)=O)c1)c1ccc(F)cc1O ZINC000285765045 535919640 /nfs/dbraw/zinc/91/96/40/535919640.db2.gz SMFUWEDFNQSXTL-KRWDZBQOSA-N 1 1 316.376 3.731 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](C)[C@@H](F)C3)c2c1 ZINC000777965691 1032060240 /nfs/dbraw/zinc/06/02/40/1032060240.db2.gz FGCASYDLSNBMMI-PXAZEXFGSA-N 1 1 303.377 3.734 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H]2CC(C)(C)CO2)C2CC2)cc1 ZINC001167107661 1013149087 /nfs/dbraw/zinc/14/90/87/1013149087.db2.gz FVCQIRQSULOTMZ-SFHVURJKSA-N 1 1 302.462 3.532 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(F)cc1O ZINC000796833313 1015036564 /nfs/dbraw/zinc/03/65/64/1015036564.db2.gz ITBKDEYRVWDYPT-MRXNPFEDSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[C@H]([NH2+]CCOc1ncccc1Cl)c1ccc(F)cc1O ZINC000796834890 1015105055 /nfs/dbraw/zinc/10/50/55/1015105055.db2.gz NUQMVJVEJOVECB-AWEZNQCLSA-N 1 1 324.783 3.699 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2Cl)c(O)c1OC ZINC000891477356 1015311760 /nfs/dbraw/zinc/31/17/60/1015311760.db2.gz JGSVDWNAQSSAFE-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(C[N@H+]2CCc3sccc3[C@@H]2C)c(O)c1OC ZINC000891525546 1015353276 /nfs/dbraw/zinc/35/32/76/1015353276.db2.gz WDEXSDPCDSZIPC-NSHDSACASA-N 1 1 319.426 3.590 20 10 DHCDMO COc1ccc2c(c1)C[N@H+](Cc1ccc(Cl)cc1O)CC2 ZINC001140461852 1015440424 /nfs/dbraw/zinc/44/04/24/1015440424.db2.gz VUFXNVOVWGBMPN-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CC[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccc(F)cc1O ZINC000796677772 1015458626 /nfs/dbraw/zinc/45/86/26/1015458626.db2.gz WRPBRLOCFAQXEC-OAHLLOKOSA-N 1 1 317.360 3.543 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2cc(F)ncc2F)cc1F ZINC000294689686 1032116569 /nfs/dbraw/zinc/11/65/69/1032116569.db2.gz AFRQUJHIPPSLOB-UHFFFAOYSA-N 1 1 323.362 3.635 20 10 DHCDMO COc1ccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c(O)c1OC ZINC000891802113 1015636685 /nfs/dbraw/zinc/63/66/85/1015636685.db2.gz NXOFKYLCHZSPIB-GFCCVEGCSA-N 1 1 317.385 3.728 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1 ZINC000896640052 1015694115 /nfs/dbraw/zinc/69/41/15/1015694115.db2.gz FYWLMQZQOAQLBO-HUUCEWRRSA-N 1 1 307.409 3.606 20 10 DHCDMO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000281169516 1015842406 /nfs/dbraw/zinc/84/24/06/1015842406.db2.gz QPEHLDGAEAOKGR-GOSISDBHSA-N 1 1 312.461 3.696 20 10 DHCDMO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000281169516 1015842410 /nfs/dbraw/zinc/84/24/10/1015842410.db2.gz QPEHLDGAEAOKGR-GOSISDBHSA-N 1 1 312.461 3.696 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)OC(C)(C)C3)c2c1 ZINC000065224450 1016010740 /nfs/dbraw/zinc/01/07/40/1016010740.db2.gz DPVINGJEUSCXTH-CYBMUJFWSA-N 1 1 315.413 3.553 20 10 DHCDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000135460194 1016105379 /nfs/dbraw/zinc/10/53/79/1016105379.db2.gz AFMYCJASUNZTIT-CYBMUJFWSA-N 1 1 313.850 3.576 20 10 DHCDMO CCC[N@@H+](CCC(C)(C)CC(=O)OCC)Cc1ccccc1O ZINC001167522197 1016295081 /nfs/dbraw/zinc/29/50/81/1016295081.db2.gz UTAWMMFYMVAIDD-UHFFFAOYSA-N 1 1 321.461 3.974 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000294792426 1032155524 /nfs/dbraw/zinc/15/55/24/1032155524.db2.gz VHPXJGVZPMFYEE-HNNXBMFYSA-N 1 1 313.800 3.624 20 10 DHCDMO Cc1ccnc([C@H]2CC[N@H+](Cc3ccc(N(C)C)c(C)c3)C2)c1 ZINC000846975943 1032175344 /nfs/dbraw/zinc/17/53/44/1032175344.db2.gz SJIYDBQHKVAGJW-SFHVURJKSA-N 1 1 309.457 3.754 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](C3CCCC3)C2)c1O ZINC001171330429 1032391226 /nfs/dbraw/zinc/39/12/26/1032391226.db2.gz BZPVPQGPRJCLSE-AWEZNQCLSA-N 1 1 305.393 3.746 20 10 DHCDMO C[C@H](c1ncccn1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929183837 1032434430 /nfs/dbraw/zinc/43/44/30/1032434430.db2.gz FTZOVKKZYPVXEL-MRXNPFEDSA-N 1 1 310.445 3.660 20 10 DHCDMO C[C@H](c1ncccn1)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929183837 1032434434 /nfs/dbraw/zinc/43/44/34/1032434434.db2.gz FTZOVKKZYPVXEL-MRXNPFEDSA-N 1 1 310.445 3.660 20 10 DHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000773254720 1032661124 /nfs/dbraw/zinc/66/11/24/1032661124.db2.gz GCROJQKRTDQHCO-AWEZNQCLSA-N 1 1 311.491 3.969 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+]Cc1c(F)cc(F)cc1F ZINC000840948620 1017534488 /nfs/dbraw/zinc/53/44/88/1017534488.db2.gz HAJMNSUZRWNENO-UHFFFAOYSA-N 1 1 308.347 3.768 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2cccc(OC)c2O)C2CC2)cc1 ZINC000120728085 1017788411 /nfs/dbraw/zinc/78/84/11/1017788411.db2.gz WCHDKQCJRICROG-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cccc(OC)c2O)cc1 ZINC000125823780 1032723611 /nfs/dbraw/zinc/72/36/11/1032723611.db2.gz HRUIILKILSZLMM-CYBMUJFWSA-N 1 1 301.386 3.602 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(Cl)ncc1F ZINC001140611482 1017937434 /nfs/dbraw/zinc/93/74/34/1017937434.db2.gz HVTIXFKQVDJQFV-UHFFFAOYSA-N 1 1 321.827 3.962 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(Cl)ncc1F ZINC001140611482 1017937438 /nfs/dbraw/zinc/93/74/38/1017937438.db2.gz HVTIXFKQVDJQFV-UHFFFAOYSA-N 1 1 321.827 3.962 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858010824 1032740279 /nfs/dbraw/zinc/74/02/79/1032740279.db2.gz NFHWCLDIXPOUPV-GOSISDBHSA-N 1 1 324.424 3.708 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H](O)c2ccccc2)cc1 ZINC000764821618 1018391269 /nfs/dbraw/zinc/39/12/69/1018391269.db2.gz BAXZBFVKEUCPHV-FQEVSTJZSA-N 1 1 312.457 3.698 20 10 DHCDMO CC[C@@H](CN[C@@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868807 1018409510 /nfs/dbraw/zinc/40/95/10/1018409510.db2.gz JBQKSOCVNMNEBZ-WMZOPIPTSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@@H+]1CCCC[C@@H]1C ZINC000764930452 1018431915 /nfs/dbraw/zinc/43/19/15/1018431915.db2.gz SQTOMHQVLNFZIZ-BBWFWOEESA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)[N@H+]1CCCC[C@@H]1C ZINC000764930452 1018431921 /nfs/dbraw/zinc/43/19/21/1018431921.db2.gz SQTOMHQVLNFZIZ-BBWFWOEESA-N 1 1 303.494 3.666 20 10 DHCDMO COC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC000858135664 1032776134 /nfs/dbraw/zinc/77/61/34/1032776134.db2.gz BQRFBBZEUHENGX-KRWDZBQOSA-N 1 1 320.383 3.508 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccoc1)c1ccc(N2CCOCC2)cc1Cl ZINC000765279103 1018743328 /nfs/dbraw/zinc/74/33/28/1018743328.db2.gz FNAITEVLFZIUIH-CYBMUJFWSA-N 1 1 320.820 3.620 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(Cl)c2)c1 ZINC000756342516 1018863207 /nfs/dbraw/zinc/86/32/07/1018863207.db2.gz SCDSVFMSIVMIQD-LLVKDONJSA-N 1 1 319.788 3.683 20 10 DHCDMO Cc1cnc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC000921823157 1018913654 /nfs/dbraw/zinc/91/36/54/1018913654.db2.gz RJIHGRQIZFXDGS-UHFFFAOYSA-N 1 1 302.443 3.801 20 10 DHCDMO CC[C@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc(F)cc1O ZINC000842923591 1018921096 /nfs/dbraw/zinc/92/10/96/1018921096.db2.gz INRLHUZJAQRBJA-DLBZAZTESA-N 1 1 321.367 3.835 20 10 DHCDMO Cn1nc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1C1CC1 ZINC000922955006 1018938924 /nfs/dbraw/zinc/93/89/24/1018938924.db2.gz NXNDBWMOQGZDOX-UHFFFAOYSA-N 1 1 324.472 3.578 20 10 DHCDMO Cc1nc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)nc2ccccc12 ZINC000765636485 1019023401 /nfs/dbraw/zinc/02/34/01/1019023401.db2.gz XEPVUNTYUPBUFN-AWEZNQCLSA-N 1 1 320.440 3.855 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@]1(C)O ZINC001143103339 1019359476 /nfs/dbraw/zinc/35/94/76/1019359476.db2.gz AMGNUBVMWZKRNJ-KUHUBIRLSA-N 1 1 305.462 3.673 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000186188931 1019651279 /nfs/dbraw/zinc/65/12/79/1019651279.db2.gz HUEBPPZCPOLNQR-SOVGHPHASA-N 1 1 314.404 3.627 20 10 DHCDMO C[N@@H+](Cc1ccc(F)c(Br)c1)Cc1ccccc1O ZINC000731843703 1020156668 /nfs/dbraw/zinc/15/66/68/1020156668.db2.gz RZFGFFVXDGRHIZ-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](CCn1cccn1)Cc1cc2oc3ccccc3c2cc1O ZINC000732186689 1020209314 /nfs/dbraw/zinc/20/93/14/1020209314.db2.gz VSULFQGQZIUHLW-UHFFFAOYSA-N 1 1 321.380 3.620 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000091958288 1020328149 /nfs/dbraw/zinc/32/81/49/1020328149.db2.gz VTOHHIYIOVPTIC-GOEBONIOSA-N 1 1 321.804 3.727 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000733324762 1020371990 /nfs/dbraw/zinc/37/19/90/1020371990.db2.gz BANLDJLDXDWDOY-SNVBAGLBSA-N 1 1 323.742 3.589 20 10 DHCDMO CCCC[N@@H+]1CCCC[C@H]1CNCc1c(O)cccc1Cl ZINC000733327929 1020374390 /nfs/dbraw/zinc/37/43/90/1020374390.db2.gz HGSDGFZPZSVCLH-AWEZNQCLSA-N 1 1 310.869 3.790 20 10 DHCDMO CCCC[N@H+]1CCCC[C@H]1CNCc1c(O)cccc1Cl ZINC000733327929 1020374395 /nfs/dbraw/zinc/37/43/95/1020374395.db2.gz HGSDGFZPZSVCLH-AWEZNQCLSA-N 1 1 310.869 3.790 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(CC)no1 ZINC000282574184 1020464582 /nfs/dbraw/zinc/46/45/82/1020464582.db2.gz ZXOPNIUSIJJGTM-ZDUSSCGKSA-N 1 1 303.406 3.701 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](C)C(=O)OC(C)(C)C ZINC001171921368 1032919130 /nfs/dbraw/zinc/91/91/30/1032919130.db2.gz UOWIAHKXNDZWNL-OAHLLOKOSA-N 1 1 320.477 3.613 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](C)C(=O)OC(C)(C)C ZINC001171921368 1032919137 /nfs/dbraw/zinc/91/91/37/1032919137.db2.gz UOWIAHKXNDZWNL-OAHLLOKOSA-N 1 1 320.477 3.613 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCS[C@@H](C)[C@H]3C)c2c1 ZINC000735666155 1020760763 /nfs/dbraw/zinc/76/07/63/1020760763.db2.gz CKTTUUVPZARGPG-OLZOCXBDSA-N 1 1 317.454 3.880 20 10 DHCDMO CCc1cc(C[N@@H+]2CCC[C@@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738146130 1020862088 /nfs/dbraw/zinc/86/20/88/1020862088.db2.gz XQAOPIMKIQKTPM-QGZVFWFLSA-N 1 1 318.505 3.778 20 10 DHCDMO CCc1cc(C[N@H+]2CCC[C@@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738146130 1020862095 /nfs/dbraw/zinc/86/20/95/1020862095.db2.gz XQAOPIMKIQKTPM-QGZVFWFLSA-N 1 1 318.505 3.778 20 10 DHCDMO Cc1cc([C@H](C)[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)nn1C ZINC000858543722 1032941344 /nfs/dbraw/zinc/94/13/44/1032941344.db2.gz VVQXPOSLOYHRRV-INIZCTEOSA-N 1 1 322.456 3.987 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2c(O)ccc3ccncc32)C1(C)C ZINC000740861865 1020957155 /nfs/dbraw/zinc/95/71/55/1020957155.db2.gz SCXPEBSMSXWPHS-QZTJIDSGSA-N 1 1 314.429 3.576 20 10 DHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1(C)C ZINC000740863621 1020957455 /nfs/dbraw/zinc/95/74/55/1020957455.db2.gz VMNBLDQLJOGMBZ-MSOLQXFVSA-N 1 1 303.446 3.516 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1C ZINC000742166489 1021094451 /nfs/dbraw/zinc/09/44/51/1021094451.db2.gz OISDSDYGBYYOKL-SFHVURJKSA-N 1 1 303.446 3.933 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1)CCC2 ZINC000742165940 1021094467 /nfs/dbraw/zinc/09/44/67/1021094467.db2.gz LWIMMTORZBOZNU-IBGZPJMESA-N 1 1 315.457 3.805 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)sc1C ZINC000756033468 1021189204 /nfs/dbraw/zinc/18/92/04/1021189204.db2.gz JXVXBKLOLQSEIF-UHFFFAOYSA-N 1 1 315.486 3.991 20 10 DHCDMO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)sc1C ZINC000756033468 1021189209 /nfs/dbraw/zinc/18/92/09/1021189209.db2.gz JXVXBKLOLQSEIF-UHFFFAOYSA-N 1 1 315.486 3.991 20 10 DHCDMO CC1CCC([N@@H+](Cc2cc3c(cc2O)OCO3)C2CC2)CC1 ZINC000917438561 1021259894 /nfs/dbraw/zinc/25/98/94/1021259894.db2.gz RGAMCTGRGVNJCP-UHFFFAOYSA-N 1 1 303.402 3.664 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@@H](c2ccccc2)CO1 ZINC000743409059 1021290141 /nfs/dbraw/zinc/29/01/41/1021290141.db2.gz QYTFQLHUZICXEW-FOIQADDNSA-N 1 1 323.436 3.843 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000107671056 1021339293 /nfs/dbraw/zinc/33/92/93/1021339293.db2.gz LEJADCUUQAJQST-OAHLLOKOSA-N 1 1 305.462 3.857 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001140924047 1021501618 /nfs/dbraw/zinc/50/16/18/1021501618.db2.gz BRTKMDSQRXKMRX-LLVKDONJSA-N 1 1 306.759 3.790 20 10 DHCDMO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)CC2 ZINC000850386990 1021503293 /nfs/dbraw/zinc/50/32/93/1021503293.db2.gz OCOLIHZUXKESOD-AWEZNQCLSA-N 1 1 307.752 3.667 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)c(F)cc1O ZINC000850510700 1021568369 /nfs/dbraw/zinc/56/83/69/1021568369.db2.gz WPAVVXGFFSRSIF-DTWKUNHWSA-N 1 1 300.171 3.663 20 10 DHCDMO COC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc(OC)c1 ZINC000850513077 1021568947 /nfs/dbraw/zinc/56/89/47/1021568947.db2.gz DKHUVXIOBSPNDJ-SJCJKPOMSA-N 1 1 319.376 3.578 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nccc(OC)c2F)cc1 ZINC000850536973 1021593798 /nfs/dbraw/zinc/59/37/98/1021593798.db2.gz LKALFVQIJXJCCI-ZDUSSCGKSA-N 1 1 317.408 3.536 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@@H](O)C12CCC2)c1cc(Cl)c(Cl)cc1O ZINC000850548142 1021597764 /nfs/dbraw/zinc/59/77/64/1021597764.db2.gz ZEWGTIBVUZVZSG-ULCPSODYSA-N 1 1 316.228 3.653 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850554083 1021600490 /nfs/dbraw/zinc/60/04/90/1021600490.db2.gz HWTJHIRUUMMKNQ-SIUPQYRZSA-N 1 1 323.408 3.746 20 10 DHCDMO Cc1nc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cs1 ZINC000040443843 1021739595 /nfs/dbraw/zinc/73/95/95/1021739595.db2.gz RURMBUIDKNSOMA-UHFFFAOYSA-N 1 1 301.459 3.732 20 10 DHCDMO C[C@H](c1ccccc1)[N@H+](Cc1cn(C)cn1)Cc1ccccc1O ZINC000851878771 1022027468 /nfs/dbraw/zinc/02/74/68/1022027468.db2.gz CPYHARCSIMYUBS-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@H](c1ccccc1)[N@@H+](Cc1cn(C)cn1)Cc1ccccc1O ZINC000851878771 1022027485 /nfs/dbraw/zinc/02/74/85/1022027485.db2.gz CPYHARCSIMYUBS-MRXNPFEDSA-N 1 1 321.424 3.889 20 10 DHCDMO COc1cc(O)c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)cc1OC ZINC000180234845 1022120283 /nfs/dbraw/zinc/12/02/83/1022120283.db2.gz NKECJRYOZVQJFS-IPYPFGDCSA-N 1 1 305.418 3.562 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c1 ZINC000183376539 1022123558 /nfs/dbraw/zinc/12/35/58/1022123558.db2.gz CBFGTDAJOURJMG-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092693 1022217992 /nfs/dbraw/zinc/21/79/92/1022217992.db2.gz IXBBBJSOTVFYOT-OAHLLOKOSA-N 1 1 322.880 3.566 20 10 DHCDMO Cc1cc(O)c(CNC[C@H]2CCC[N@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092693 1022218001 /nfs/dbraw/zinc/21/80/01/1022218001.db2.gz IXBBBJSOTVFYOT-OAHLLOKOSA-N 1 1 322.880 3.566 20 10 DHCDMO Cc1cc(O)c(CNC[C@H]2CCC[N@@H+](CC3CC3)C2)c(Cl)c1 ZINC000853092693 1022218010 /nfs/dbraw/zinc/21/80/10/1022218010.db2.gz IXBBBJSOTVFYOT-OAHLLOKOSA-N 1 1 322.880 3.566 20 10 DHCDMO CCn1nccc1C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000853239146 1022239250 /nfs/dbraw/zinc/23/92/50/1022239250.db2.gz BFTJBDSCCUIVDK-SECBINFHSA-N 1 1 314.216 3.766 20 10 DHCDMO C[N@H+](Cc1csc(-c2ccccn2)n1)Cc1ccccc1O ZINC000111235898 1022252923 /nfs/dbraw/zinc/25/29/23/1022252923.db2.gz YZCWLBWYTGDEAW-UHFFFAOYSA-N 1 1 311.410 3.543 20 10 DHCDMO C[N@@H+](Cc1csc(-c2ccccn2)n1)Cc1ccccc1O ZINC000111235898 1022252931 /nfs/dbraw/zinc/25/29/31/1022252931.db2.gz YZCWLBWYTGDEAW-UHFFFAOYSA-N 1 1 311.410 3.543 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@H]3COC[C@@H]3C1)oc1ccccc12 ZINC000853586616 1022295931 /nfs/dbraw/zinc/29/59/31/1022295931.db2.gz VCNLZHICIVBWCP-HIFRSBDPSA-N 1 1 323.392 3.760 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)cc1C ZINC000853613707 1022299110 /nfs/dbraw/zinc/29/91/10/1022299110.db2.gz IHPIARZMMJXRRM-JSGCOSHPSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)cc1C ZINC000853613707 1022299105 /nfs/dbraw/zinc/29/91/05/1022299105.db2.gz IHPIARZMMJXRRM-JSGCOSHPSA-N 1 1 317.351 3.551 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000854225729 1022436110 /nfs/dbraw/zinc/43/61/10/1022436110.db2.gz GCOCCWAAYUCARQ-DLBZAZTESA-N 1 1 300.377 3.842 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000179688740 1022509267 /nfs/dbraw/zinc/50/92/67/1022509267.db2.gz DTECSZZQQFKMME-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc3oc4ccccc4c3cc2O)C[C@H](C)O1 ZINC000776763859 1022541367 /nfs/dbraw/zinc/54/13/67/1022541367.db2.gz QUSNYRYEMQHLQE-BETUJISGSA-N 1 1 311.381 3.901 20 10 DHCDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1O)c1ccccc1 ZINC000180201191 1022661824 /nfs/dbraw/zinc/66/18/24/1022661824.db2.gz KKKJOLLKUUDUIX-KRWDZBQOSA-N 1 1 313.372 3.769 20 10 DHCDMO CC[N@@H+](Cc1cnc2ccc(C)cn12)Cc1ccc(N(C)C)cc1 ZINC000768131869 1022897773 /nfs/dbraw/zinc/89/77/73/1022897773.db2.gz AOUCLOPTOQFLDQ-UHFFFAOYSA-N 1 1 322.456 3.731 20 10 DHCDMO CCc1ncc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)s1 ZINC000768134883 1022900828 /nfs/dbraw/zinc/90/08/28/1022900828.db2.gz WWGXEXVEZWRGFL-UHFFFAOYSA-N 1 1 303.475 3.794 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2cccn2C)cc1F ZINC000768199807 1022912940 /nfs/dbraw/zinc/91/29/40/1022912940.db2.gz ZCBFXOVNROBOAP-GOSISDBHSA-N 1 1 301.409 3.567 20 10 DHCDMO COc1cccc(O)c1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000768204194 1022915693 /nfs/dbraw/zinc/91/56/93/1022915693.db2.gz RCWIQUNGKPBJLA-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000768204194 1022915704 /nfs/dbraw/zinc/91/57/04/1022915704.db2.gz RCWIQUNGKPBJLA-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C)[C@@H](C)C(C)C)c1O ZINC000768268332 1022936674 /nfs/dbraw/zinc/93/66/74/1022936674.db2.gz HWVNUAINNAIOCB-JTQLQIEISA-N 1 1 316.239 3.640 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)CCOc2ccc(C)cc2)c1O ZINC000768214080 1022927947 /nfs/dbraw/zinc/92/79/47/1022927947.db2.gz YLJGFFJDHRMJSC-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC[N@@H+](CCc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000768335367 1022948402 /nfs/dbraw/zinc/94/84/02/1022948402.db2.gz MSKRZVABSWNPCU-UHFFFAOYSA-N 1 1 324.468 3.588 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000768364888 1022953013 /nfs/dbraw/zinc/95/30/13/1022953013.db2.gz PNNDZGPKVJKOSS-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO CCCC[N@@H+](Cc1cc2c(cc1O)OC[C@@H]2O)C1CCCCC1 ZINC000768440280 1022967198 /nfs/dbraw/zinc/96/71/98/1022967198.db2.gz PZQWELGFMASQCB-SFHVURJKSA-N 1 1 319.445 3.753 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC[C@H](C)[C@@H]3CCCC[C@@H]32)cc1OC ZINC000768439437 1022968385 /nfs/dbraw/zinc/96/83/85/1022968385.db2.gz LZPULRBAHVYRPB-BPUTZDHNSA-N 1 1 319.445 3.810 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](C3CCOCC3)C1)CCCC2 ZINC000768465451 1022972818 /nfs/dbraw/zinc/97/28/18/1022972818.db2.gz NANYXFLDCRVINW-SFHVURJKSA-N 1 1 315.457 3.520 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@H]3CCOC3)C1)CCCC2 ZINC000768463845 1022973702 /nfs/dbraw/zinc/97/37/02/1022973702.db2.gz YAGVMQIJKRSVQL-MSOLQXFVSA-N 1 1 315.457 3.520 20 10 DHCDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768462955 1022974180 /nfs/dbraw/zinc/97/41/80/1022974180.db2.gz PGKWZPVSURMDFA-HIFRSBDPSA-N 1 1 307.434 3.810 20 10 DHCDMO CCC[N@H+](Cc1cc(F)c(Cl)cc1O)C1CCOCC1 ZINC001237941601 1023006826 /nfs/dbraw/zinc/00/68/26/1023006826.db2.gz ZBHUJPHVLWBSPO-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO CCC[N@@H+](Cc1cc(F)c(Cl)cc1O)C1CCOCC1 ZINC001237941601 1023006840 /nfs/dbraw/zinc/00/68/40/1023006840.db2.gz ZBHUJPHVLWBSPO-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO CC(C)C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C(C)C ZINC000768780050 1023026175 /nfs/dbraw/zinc/02/61/75/1023026175.db2.gz KCAKXQWWPPQLDZ-UHFFFAOYSA-N 1 1 308.441 3.529 20 10 DHCDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876572473 1033095859 /nfs/dbraw/zinc/09/58/59/1033095859.db2.gz DUIKUAITTULBCV-VQIMIIECSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000025478891 1023050638 /nfs/dbraw/zinc/05/06/38/1023050638.db2.gz DMMBXCWVSDSIOQ-UHFFFAOYSA-N 1 1 300.358 3.549 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c(O)c1 ZINC000769035388 1023073306 /nfs/dbraw/zinc/07/33/06/1023073306.db2.gz HJLBXYWGJODZDH-KWOWKCNFSA-N 1 1 301.430 3.801 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1F ZINC000769106728 1023084192 /nfs/dbraw/zinc/08/41/92/1023084192.db2.gz WOTQPJILHBKRTH-SFHVURJKSA-N 1 1 314.404 3.934 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C)O1 ZINC000769103834 1023091325 /nfs/dbraw/zinc/09/13/25/1023091325.db2.gz CNOCGQKZJUFWPL-QFBILLFUSA-N 1 1 302.462 3.676 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1 ZINC000769244338 1023107735 /nfs/dbraw/zinc/10/77/35/1023107735.db2.gz NGGOEGFIXZGBKN-SFTDATJTSA-N 1 1 324.468 3.841 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(Cc3ccccc3)CC[C@H]2C)c1 ZINC000769307292 1023117568 /nfs/dbraw/zinc/11/75/68/1023117568.db2.gz GMOYJPIVBIXFCN-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1nc2sccn2c1C[N@H+](C)Cc1cc(Cl)ccc1O ZINC000769306676 1023117736 /nfs/dbraw/zinc/11/77/36/1023117736.db2.gz BPMBHACOBZAZSD-UHFFFAOYSA-N 1 1 321.833 3.695 20 10 DHCDMO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769311208 1023119691 /nfs/dbraw/zinc/11/96/91/1023119691.db2.gz ZQJZTBKKOYPINN-UZLBHIALSA-N 1 1 310.441 3.715 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000769337500 1023128797 /nfs/dbraw/zinc/12/87/97/1023128797.db2.gz JNRVWWZMBAUOEI-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c(O)c1 ZINC000769383793 1023138305 /nfs/dbraw/zinc/13/83/05/1023138305.db2.gz JQBYNNSWCMMARI-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cnn(CC)c2)cc1F ZINC000769427844 1023146443 /nfs/dbraw/zinc/14/64/43/1023146443.db2.gz PRIXXIHYNZICMY-UHFFFAOYSA-N 1 1 318.440 3.520 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cnn(CC)c2)cc1F ZINC000769427844 1023146444 /nfs/dbraw/zinc/14/64/44/1023146444.db2.gz PRIXXIHYNZICMY-UHFFFAOYSA-N 1 1 318.440 3.520 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769446718 1023156151 /nfs/dbraw/zinc/15/61/51/1023156151.db2.gz SGLGHFQVKWKELC-SFHVURJKSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000769446718 1023156155 /nfs/dbraw/zinc/15/61/55/1023156155.db2.gz SGLGHFQVKWKELC-SFHVURJKSA-N 1 1 317.816 3.928 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccn2C)cc1F ZINC000769468827 1023161165 /nfs/dbraw/zinc/16/11/65/1023161165.db2.gz PWBFXCZHARIQNI-UHFFFAOYSA-N 1 1 303.425 3.642 20 10 DHCDMO CCC[N@@H+](Cc1cc(C)ccc1O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000769471638 1023163185 /nfs/dbraw/zinc/16/31/85/1023163185.db2.gz WXBWJRMFSIDTEK-CGTJXYLNSA-N 1 1 303.446 3.726 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@H](Cc3ccccc3)[C@@H]2C)c1O ZINC000769499332 1023166681 /nfs/dbraw/zinc/16/66/81/1023166681.db2.gz QLPUHQVUAUPYEY-DOTOQJQBSA-N 1 1 311.425 3.854 20 10 DHCDMO CCC[N@H+](C)C[C@H]1CCN(Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507872 1023170583 /nfs/dbraw/zinc/17/05/83/1023170583.db2.gz POEFTRWAYJNEHE-LJQANCHMSA-N 1 1 317.521 3.697 20 10 DHCDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507872 1023170590 /nfs/dbraw/zinc/17/05/90/1023170590.db2.gz POEFTRWAYJNEHE-LJQANCHMSA-N 1 1 317.521 3.697 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)cc1F ZINC000770287020 1023291525 /nfs/dbraw/zinc/29/15/25/1023291525.db2.gz UNFSLUYLDZQNQI-AEFFLSMTSA-N 1 1 320.452 3.673 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)cc1 ZINC000770293498 1023295475 /nfs/dbraw/zinc/29/54/75/1023295475.db2.gz PFFJIZAJANLCMR-MJGOQNOKSA-N 1 1 302.462 3.534 20 10 DHCDMO C[N@@H+](CCC1CC1)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000770376040 1023301254 /nfs/dbraw/zinc/30/12/54/1023301254.db2.gz ULIRIESUTVRHOH-UHFFFAOYSA-N 1 1 317.433 3.817 20 10 DHCDMO Cn1c(-c2ccccc2)cnc1SCC[C@@H]1CCC[N@H+]1C ZINC000770463380 1023314875 /nfs/dbraw/zinc/31/48/75/1023314875.db2.gz SEQRIZKHABZJJZ-HNNXBMFYSA-N 1 1 301.459 3.664 20 10 DHCDMO CC[C@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccc(F)cc1O ZINC000796667436 1023330640 /nfs/dbraw/zinc/33/06/40/1023330640.db2.gz VDISDLYQINXUOF-INIZCTEOSA-N 1 1 308.441 3.837 20 10 DHCDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000770748716 1023347153 /nfs/dbraw/zinc/34/71/53/1023347153.db2.gz UOWZZAUWNDSSQL-NSHDSACASA-N 1 1 321.218 3.709 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cnc3ccccn23)C2CC2)cc1 ZINC000771790593 1023469966 /nfs/dbraw/zinc/46/99/66/1023469966.db2.gz DSONWCJFKIDKEX-UHFFFAOYSA-N 1 1 320.440 3.565 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccnc3ccccc23)cc1 ZINC000771935175 1023489531 /nfs/dbraw/zinc/48/95/31/1023489531.db2.gz MRLLVZGAKJCRSS-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc3ccccc3c2)cc1 ZINC000771935374 1023489799 /nfs/dbraw/zinc/48/97/99/1023489799.db2.gz PYDFSNSNBBPYKH-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2N2CCCC2)cc1 ZINC000771935122 1023489987 /nfs/dbraw/zinc/48/99/87/1023489987.db2.gz IYCGHPQUDXWQCD-UHFFFAOYSA-N 1 1 323.484 3.985 20 10 DHCDMO COc1ccccc1/C=C/C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000771935174 1023490001 /nfs/dbraw/zinc/49/00/01/1023490001.db2.gz MPLQVOLXSQKYFP-VQHVLOKHSA-N 1 1 310.441 3.906 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000876778920 1033141935 /nfs/dbraw/zinc/14/19/35/1033141935.db2.gz RZBNAXDDRIIHML-SUMWQHHRSA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000876805390 1033147298 /nfs/dbraw/zinc/14/72/98/1033147298.db2.gz ZQPSIWDTOJEIQX-WMLDXEAASA-N 1 1 317.454 3.850 20 10 DHCDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccc1O ZINC000787405911 1023793339 /nfs/dbraw/zinc/79/33/39/1023793339.db2.gz HEMGXUYLZIPFBF-UVTDQMKNSA-N 1 1 312.369 3.836 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)c1ccc(F)cc1O ZINC000756780221 1023800012 /nfs/dbraw/zinc/80/00/12/1023800012.db2.gz XKKFWXDYMQSYPF-FFFUXKDYSA-N 1 1 313.463 3.562 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1ccc(F)cc1O ZINC000796703405 1023855349 /nfs/dbraw/zinc/85/53/49/1023855349.db2.gz UMAALJQJOMPTIG-AEFFLSMTSA-N 1 1 303.377 3.614 20 10 DHCDMO C[N@@H+](CCC[C@H]1CCOC1)Cc1ccc(N2CCCCC2)cc1 ZINC000788442315 1023893261 /nfs/dbraw/zinc/89/32/61/1023893261.db2.gz DJIYXMNGSFQZTD-IBGZPJMESA-N 1 1 316.489 3.925 20 10 DHCDMO CCCCN(C)CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788592237 1023910041 /nfs/dbraw/zinc/91/00/41/1023910041.db2.gz KWUYMPNRNMWLBR-LBPRGKRZSA-N 1 1 318.383 3.794 20 10 DHCDMO CCN(CC)C[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788587274 1023910384 /nfs/dbraw/zinc/91/03/84/1023910384.db2.gz HPJQLDRWCYEQIX-VXGBXAGGSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@H]([NH2+]CCCC(C)(C)CO)c1cccc(C(F)(F)F)c1O ZINC000788605272 1023913011 /nfs/dbraw/zinc/91/30/11/1023913011.db2.gz WMLBEWJIMKZWRA-NSHDSACASA-N 1 1 319.367 3.860 20 10 DHCDMO CCC[C@@H](CCO)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788615324 1023913563 /nfs/dbraw/zinc/91/35/63/1023913563.db2.gz ZHFDNVDNJYAHGI-NEPJUHHUSA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@@H]([NH2+]CC(C)(C)CCCO)c1cccc(C(F)(F)F)c1O ZINC000788652734 1023916813 /nfs/dbraw/zinc/91/68/13/1023916813.db2.gz UJHMPEZWFVWDSO-LLVKDONJSA-N 1 1 319.367 3.860 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1cccc(C(F)(F)F)c1O ZINC000788760499 1023930069 /nfs/dbraw/zinc/93/00/69/1023930069.db2.gz BDWNZSLLOIJUPA-WDMOLILDSA-N 1 1 317.351 3.613 20 10 DHCDMO Cc1ccc(CN[C@@H](C[NH+]2CCCC2)c2ccccc2)c(O)c1 ZINC000876880497 1033176462 /nfs/dbraw/zinc/17/64/62/1033176462.db2.gz JXOUMMDIILVVCO-IBGZPJMESA-N 1 1 310.441 3.627 20 10 DHCDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000789586344 1024119598 /nfs/dbraw/zinc/11/95/98/1024119598.db2.gz LQASWJYMSUOMMS-QGZVFWFLSA-N 1 1 319.832 3.735 20 10 DHCDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000789586096 1024119866 /nfs/dbraw/zinc/11/98/66/1024119866.db2.gz JZQMQCXJIQCQAF-BZUAXINKSA-N 1 1 320.452 3.529 20 10 DHCDMO CCOc1cccc([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882942216 1024179334 /nfs/dbraw/zinc/17/93/34/1024179334.db2.gz UESPFIMVHBADNG-NSHDSACASA-N 1 1 307.340 3.920 20 10 DHCDMO CC(C)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H](O)c1ccccc1 ZINC000883106560 1024243825 /nfs/dbraw/zinc/24/38/25/1024243825.db2.gz XFAQRFVEGAWSQV-AEFFLSMTSA-N 1 1 321.367 3.518 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000883198325 1024282546 /nfs/dbraw/zinc/28/25/46/1024282546.db2.gz GEVSPDNEYLZOEJ-JOYOIKCWSA-N 1 1 321.289 3.905 20 10 DHCDMO CC[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(N(C)C)cc1 ZINC000883312712 1024366265 /nfs/dbraw/zinc/36/62/65/1024366265.db2.gz LGCCOYRAJYYMIC-KRWDZBQOSA-N 1 1 310.445 3.663 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H]1CCOC1 ZINC000278898609 1024381726 /nfs/dbraw/zinc/38/17/26/1024381726.db2.gz ZDHGKKKDRTUQGM-KXUCPTDWSA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)Oc1ccccc1 ZINC000790965365 1024407363 /nfs/dbraw/zinc/40/73/63/1024407363.db2.gz IDAJSEDNSZZEBG-LLVKDONJSA-N 1 1 309.768 3.742 20 10 DHCDMO CC(C)C[C@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790991690 1024413674 /nfs/dbraw/zinc/41/36/74/1024413674.db2.gz ZJYQMAISASGPHK-NEPJUHHUSA-N 1 1 315.816 3.868 20 10 DHCDMO COC1(C[N@@H+](Cc2ccco2)Cc2ccccc2O)CCCC1 ZINC000792161803 1024639348 /nfs/dbraw/zinc/63/93/48/1024639348.db2.gz JJPGBNQDRHNAMK-UHFFFAOYSA-N 1 1 315.413 3.947 20 10 DHCDMO OCCC[N@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792167166 1024641124 /nfs/dbraw/zinc/64/11/24/1024641124.db2.gz CIWKDPQERXFYJZ-UHFFFAOYSA-N 1 1 323.795 3.569 20 10 DHCDMO OCCC[N@@H+](Cc1ccccc1)Cc1c(O)ccc(Cl)c1F ZINC000792167166 1024641128 /nfs/dbraw/zinc/64/11/28/1024641128.db2.gz CIWKDPQERXFYJZ-UHFFFAOYSA-N 1 1 323.795 3.569 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CCF)C2)c1O ZINC000689885873 1024698374 /nfs/dbraw/zinc/69/83/74/1024698374.db2.gz LHWGULRSGVPNGH-NSHDSACASA-N 1 1 301.789 3.626 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccnc1OC(C)C)c1ccc(F)cc1O ZINC000796696842 1024765864 /nfs/dbraw/zinc/76/58/64/1024765864.db2.gz UNTCLZWIWMXCKS-MRXNPFEDSA-N 1 1 318.392 3.954 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)CC1CCOCC1 ZINC000112731170 1024785395 /nfs/dbraw/zinc/78/53/95/1024785395.db2.gz DCAXQBINRKPAIU-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO c1csc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCCC2)n1 ZINC000116374124 1024859797 /nfs/dbraw/zinc/85/97/97/1024859797.db2.gz PSRWIHQSCYRXNY-UHFFFAOYSA-N 1 1 300.427 3.637 20 10 DHCDMO C[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccc(F)cc1O ZINC000321563796 1025006218 /nfs/dbraw/zinc/00/62/18/1025006218.db2.gz OGLDGFVGASINAQ-CYBMUJFWSA-N 1 1 310.372 3.973 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2O)CCC1(F)F ZINC000825944315 1033260996 /nfs/dbraw/zinc/26/09/96/1033260996.db2.gz SXZHRAZAAUGSBL-SECBINFHSA-N 1 1 320.177 3.632 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)cc1C(C)C ZINC000884483365 1025134669 /nfs/dbraw/zinc/13/46/69/1025134669.db2.gz RINXOFHVHNQEPZ-KXBFYZLASA-N 1 1 303.446 3.825 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769282 1025159169 /nfs/dbraw/zinc/15/91/69/1025159169.db2.gz UFWHHEPMJNXRJN-HXUWFJFHSA-N 1 1 316.489 3.526 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@]3(CCN(C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769282 1025159180 /nfs/dbraw/zinc/15/91/80/1025159180.db2.gz UFWHHEPMJNXRJN-HXUWFJFHSA-N 1 1 316.489 3.526 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1ccncc1OC)c1ccc(F)cc1O ZINC000796959432 1025236183 /nfs/dbraw/zinc/23/61/83/1025236183.db2.gz NXMDXIBRGQURSU-NHYWBVRUSA-N 1 1 304.365 3.737 20 10 DHCDMO CCN(C#N)CC[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC001168244626 1025381451 /nfs/dbraw/zinc/38/14/51/1025381451.db2.gz QXGPMFMFDKADSM-KRWDZBQOSA-N 1 1 323.440 3.758 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000925879740 1025423351 /nfs/dbraw/zinc/42/33/51/1025423351.db2.gz JNNFCXKUHKUSLW-SCDSUCTJSA-N 1 1 316.367 3.579 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1C[C@@]12CCOC2)C1CCCC1 ZINC000886008526 1025435934 /nfs/dbraw/zinc/43/59/34/1025435934.db2.gz OPNDKYWPYOMSHL-VQIMIIECSA-N 1 1 301.430 3.563 20 10 DHCDMO Cc1ccnc(N)c1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000893864687 1025578040 /nfs/dbraw/zinc/57/80/40/1025578040.db2.gz YUHDNIQWSUTFRO-UHFFFAOYSA-N 1 1 324.472 3.595 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886495211 1025652222 /nfs/dbraw/zinc/65/22/22/1025652222.db2.gz NIECRVKAHZXVFZ-BMIGLBTASA-N 1 1 309.768 3.569 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1c(O)cccc1F ZINC000886498654 1025654240 /nfs/dbraw/zinc/65/42/40/1025654240.db2.gz KOAKWWJLLWKFRG-WDEREUQCSA-N 1 1 303.333 3.672 20 10 DHCDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1c(O)cccc1F ZINC000886542895 1025690917 /nfs/dbraw/zinc/69/09/17/1025690917.db2.gz HLJMRDRTJOQSAG-ZUEVXXBESA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccccc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886542980 1025691469 /nfs/dbraw/zinc/69/14/69/1025691469.db2.gz ITMYBZHDPDREDI-PBFPGSCMSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1c(O)cccc1F ZINC000886547309 1025696626 /nfs/dbraw/zinc/69/66/26/1025696626.db2.gz IZXKZPNGMAHXOM-HZMBPMFUSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610905 1025735681 /nfs/dbraw/zinc/73/56/81/1025735681.db2.gz MXLKBJCPZGVJEJ-AAEUAGOBSA-N 1 1 323.795 3.611 20 10 DHCDMO COc1cccc([C@@H](C[NH2+][C@@H](C)c2c(O)cccc2F)OC)c1 ZINC000886641662 1025752251 /nfs/dbraw/zinc/75/22/51/1025752251.db2.gz OTTIDDYWEMAZHZ-YVEFUNNKSA-N 1 1 319.376 3.578 20 10 DHCDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(N)cc2)cc1)C(C)C ZINC000236995927 1026012968 /nfs/dbraw/zinc/01/29/68/1026012968.db2.gz HTBLOEDRNAUFMI-UHFFFAOYSA-N 1 1 311.429 3.751 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2c2nc(C)no2)cc1 ZINC000289830878 1026192824 /nfs/dbraw/zinc/19/28/24/1026192824.db2.gz OSBWUECUVSGJKA-KRWDZBQOSA-N 1 1 314.433 3.561 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2c2nc(C)no2)cc1 ZINC000289830878 1026192831 /nfs/dbraw/zinc/19/28/31/1026192831.db2.gz OSBWUECUVSGJKA-KRWDZBQOSA-N 1 1 314.433 3.561 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]C2CCN(CC3CC3)CC2)c1O ZINC000808677816 1026356038 /nfs/dbraw/zinc/35/60/38/1026356038.db2.gz DTYSMHYNJXZBPE-ZDUSSCGKSA-N 1 1 322.880 3.879 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c1[O-] ZINC000808713467 1026361787 /nfs/dbraw/zinc/36/17/87/1026361787.db2.gz NINFABWGTQUFQK-CYBMUJFWSA-N 1 1 310.869 3.737 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c1[O-] ZINC000808715473 1026362619 /nfs/dbraw/zinc/36/26/19/1026362619.db2.gz FWDVHOJDUHFAEJ-CYBMUJFWSA-N 1 1 322.880 3.879 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1ccc(F)cc1O ZINC000808722095 1026368366 /nfs/dbraw/zinc/36/83/66/1026368366.db2.gz YVYUTAWGRZSKFZ-IWEFOYFVSA-N 1 1 303.377 3.694 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)c1O ZINC000809701178 1026590189 /nfs/dbraw/zinc/59/01/89/1026590189.db2.gz VESDYJMAEZVSNW-CJNGLKHVSA-N 1 1 311.853 3.870 20 10 DHCDMO COC[C@@H](C)C[N@@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC000809731017 1026597951 /nfs/dbraw/zinc/59/79/51/1026597951.db2.gz AFUMDBWBMQCMDZ-INIZCTEOSA-N 1 1 316.445 3.630 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](N3CCCC3)C[C@H]2C)cc1 ZINC000809703300 1026598941 /nfs/dbraw/zinc/59/89/41/1026598941.db2.gz HSANNGNWJYMCIJ-XLIONFOSSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@@H](N3CCCC3)C[C@H]2C)cc1 ZINC000809703300 1026598946 /nfs/dbraw/zinc/59/89/46/1026598946.db2.gz HSANNGNWJYMCIJ-XLIONFOSSA-N 1 1 315.505 3.591 20 10 DHCDMO C[N@H+](CCN1CCCC1)Cc1cc(-c2ccccc2)ccc1O ZINC000809738266 1026611608 /nfs/dbraw/zinc/61/16/08/1026611608.db2.gz VNPCVZAPJJYCQM-UHFFFAOYSA-N 1 1 310.441 3.587 20 10 DHCDMO C[N@@H+](CCN1CCCC1)Cc1cc(-c2ccccc2)ccc1O ZINC000809738266 1026611612 /nfs/dbraw/zinc/61/16/12/1026611612.db2.gz VNPCVZAPJJYCQM-UHFFFAOYSA-N 1 1 310.441 3.587 20 10 DHCDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765522 1026621386 /nfs/dbraw/zinc/62/13/86/1026621386.db2.gz NSEGANLEUGTAJA-UZLBHIALSA-N 1 1 324.468 3.831 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1Cc2ccccc2OC(C)(C)C1 ZINC000809790121 1026628012 /nfs/dbraw/zinc/62/80/12/1026628012.db2.gz ZMUQIMKMBGLLMG-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO CCC[N@H+](CC)C[C@@H](C)N[C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810261839 1026720602 /nfs/dbraw/zinc/72/06/02/1026720602.db2.gz KSCKOWYKBGVYQH-UMVBOHGHSA-N 1 1 308.441 3.790 20 10 DHCDMO CCC[N@@H+](CC)C[C@@H](C)N[C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000810261839 1026720610 /nfs/dbraw/zinc/72/06/10/1026720610.db2.gz KSCKOWYKBGVYQH-UMVBOHGHSA-N 1 1 308.441 3.790 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cccc(Br)c2O)[C@@H]1C1CC1 ZINC000811513918 1027028234 /nfs/dbraw/zinc/02/82/34/1027028234.db2.gz VUOOTQRCEQENNE-CQSZACIVSA-N 1 1 310.235 3.775 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1O ZINC000811512162 1027026097 /nfs/dbraw/zinc/02/60/97/1027026097.db2.gz FLCRSSICOWUVBW-FQEVSTJZSA-N 1 1 309.409 3.670 20 10 DHCDMO CC1(C)C[N@H+](Cc2cccc(Br)c2O)[C@@H]1C1CC1 ZINC000811513918 1027028228 /nfs/dbraw/zinc/02/82/28/1027028228.db2.gz VUOOTQRCEQENNE-CQSZACIVSA-N 1 1 310.235 3.775 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC000811793248 1027092518 /nfs/dbraw/zinc/09/25/18/1027092518.db2.gz UVSDJPNQKIASQE-AEFFLSMTSA-N 1 1 301.430 3.543 20 10 DHCDMO Cc1c([C@H]2CCC[N@H+]2Cc2c(O)ccc3ccccc32)cnn1C ZINC000362431358 1027202285 /nfs/dbraw/zinc/20/22/85/1027202285.db2.gz HOVSDIUMVNGTIW-LJQANCHMSA-N 1 1 321.424 3.924 20 10 DHCDMO CC[N@@H+](Cc1cc2oc3ccccc3c2cc1O)[C@@H]1CCOC1 ZINC000812297305 1027248102 /nfs/dbraw/zinc/24/81/02/1027248102.db2.gz ZGPUECZIQHVBSX-CQSZACIVSA-N 1 1 311.381 3.902 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1Cc1cccc(F)c1O ZINC000809757812 1027435375 /nfs/dbraw/zinc/43/53/75/1027435375.db2.gz SUPSEIUQMQWDCP-INIZCTEOSA-N 1 1 317.408 3.989 20 10 DHCDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1cccc(F)c1O ZINC000809757812 1027435378 /nfs/dbraw/zinc/43/53/78/1027435378.db2.gz SUPSEIUQMQWDCP-INIZCTEOSA-N 1 1 317.408 3.989 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1 ZINC000812840007 1027438971 /nfs/dbraw/zinc/43/89/71/1027438971.db2.gz FHERIZOHDBNQJE-AQNXPRMDSA-N 1 1 316.489 3.658 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000778996026 1027747972 /nfs/dbraw/zinc/74/79/72/1027747972.db2.gz KJHGJQIDDVDBOE-INIZCTEOSA-N 1 1 303.402 3.821 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000814175357 1027909882 /nfs/dbraw/zinc/90/98/82/1027909882.db2.gz SYEKWIOQWBQFQH-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@@H]1c1ccncc1 ZINC000814227918 1027960612 /nfs/dbraw/zinc/96/06/12/1027960612.db2.gz PVLHDEFMXOASEA-LJQANCHMSA-N 1 1 308.425 3.859 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1[O-] ZINC000367491332 1028192398 /nfs/dbraw/zinc/19/23/98/1028192398.db2.gz SPUKUXVGBICYMC-WWGRRREGSA-N 1 1 308.853 3.713 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccc(F)c(F)c2)c(O)cc1C ZINC000159734573 1028196855 /nfs/dbraw/zinc/19/68/55/1028196855.db2.gz FAEOSICVNIYPGI-UHFFFAOYSA-N 1 1 307.340 3.619 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@@H]2c2cc(C)on2)c1 ZINC000368046116 1028288340 /nfs/dbraw/zinc/28/83/40/1028288340.db2.gz YOFHHVCOFXQUST-BLLLJJGKSA-N 1 1 302.374 3.595 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2nc3ccccc3n2C)ccc1N(C)C ZINC000815072818 1028349094 /nfs/dbraw/zinc/34/90/94/1028349094.db2.gz TWGHLFCSCZGMAI-UHFFFAOYSA-N 1 1 322.456 3.580 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2nc3ccccc3n2C)ccc1N(C)C ZINC000815072818 1028349111 /nfs/dbraw/zinc/34/91/11/1028349111.db2.gz TWGHLFCSCZGMAI-UHFFFAOYSA-N 1 1 322.456 3.580 20 10 DHCDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@H]1C)c1ccc(F)cc1O ZINC000368586508 1028381647 /nfs/dbraw/zinc/38/16/47/1028381647.db2.gz YUKTZULHPCMAJE-FJHFEUQMSA-N 1 1 305.324 3.843 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2c(F)cc(F)cc2F)cc1F ZINC000815152344 1028384850 /nfs/dbraw/zinc/38/48/50/1028384850.db2.gz MNIOLRCTHDPUHD-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO Cc1[nH+]c2ccc(Br)cn2c1Nc1ccc(N)cc1 ZINC001159372419 1028520124 /nfs/dbraw/zinc/52/01/24/1028520124.db2.gz XBWQHGLSTFDZFY-UHFFFAOYSA-N 1 1 317.190 3.731 20 10 DHCDMO COc1ccc(N2CCC([N@@H+](C)CCC(F)(F)F)CC2)cc1 ZINC000369817219 1028536590 /nfs/dbraw/zinc/53/65/90/1028536590.db2.gz YUILIDRLWBMOAN-UHFFFAOYSA-N 1 1 316.367 3.548 20 10 DHCDMO CN(C)CCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815553082 1028540664 /nfs/dbraw/zinc/54/06/64/1028540664.db2.gz RDGQYIAOUVBTLT-LJQANCHMSA-N 1 1 312.457 3.607 20 10 DHCDMO CC[C@@H](c1ccccc1O)N1CCC([N@@H+]2CCC[C@H]2C)CC1 ZINC000369888348 1028542879 /nfs/dbraw/zinc/54/28/79/1028542879.db2.gz NXKXAQXCVRQQPG-QAPCUYQASA-N 1 1 302.462 3.792 20 10 DHCDMO CC[C@@H](c1ccccc1O)N1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000369888348 1028542886 /nfs/dbraw/zinc/54/28/86/1028542886.db2.gz NXKXAQXCVRQQPG-QAPCUYQASA-N 1 1 302.462 3.792 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)cn1 ZINC000815560785 1028543598 /nfs/dbraw/zinc/54/35/98/1028543598.db2.gz QDCWGHUUXXMLGL-LLVKDONJSA-N 1 1 310.319 3.965 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1nc(C(C)C)no1 ZINC000076074400 1028555965 /nfs/dbraw/zinc/55/59/65/1028555965.db2.gz QRQGMXKIEBCQLT-ZDUSSCGKSA-N 1 1 303.406 3.872 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1nc(C(C)C)no1 ZINC000076074400 1028555976 /nfs/dbraw/zinc/55/59/76/1028555976.db2.gz QRQGMXKIEBCQLT-ZDUSSCGKSA-N 1 1 303.406 3.872 20 10 DHCDMO C[C@H]([NH2+]C1CCC(C)(O)CC1)c1cccc(C(F)(F)F)c1O ZINC000815586894 1028557156 /nfs/dbraw/zinc/55/71/56/1028557156.db2.gz UXUZHBPHSFWYMP-NLTNOIMHSA-N 1 1 317.351 3.755 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCOC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625620 1028577497 /nfs/dbraw/zinc/57/74/97/1028577497.db2.gz ICPFPSPSSQCKRT-WOPDTQHZSA-N 1 1 317.351 3.734 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625465 1028578351 /nfs/dbraw/zinc/57/83/51/1028578351.db2.gz FAVROVWPGPHSRD-VDDIYKPWSA-N 1 1 305.365 3.813 20 10 DHCDMO Cc1cc(Br)cc([C@H](C)[NH2+]CC(C)(F)F)c1O ZINC000815645048 1028590184 /nfs/dbraw/zinc/59/01/84/1028590184.db2.gz SXMLALOTFHTBRQ-QMMMGPOBSA-N 1 1 308.166 3.769 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C(C)(C)O ZINC000815652381 1028595346 /nfs/dbraw/zinc/59/53/46/1028595346.db2.gz ZXRQUSOYWYZUGH-OQPBUACISA-N 1 1 306.233 3.899 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000815651713 1028595741 /nfs/dbraw/zinc/59/57/41/1028595741.db2.gz BABLIEJTRCLZSZ-BXKDBHETSA-N 1 1 305.340 3.611 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1 ZINC000190138698 1028826456 /nfs/dbraw/zinc/82/64/56/1028826456.db2.gz JRVVPRRAJDMDJN-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1 ZINC000190138698 1028826475 /nfs/dbraw/zinc/82/64/75/1028826475.db2.gz JRVVPRRAJDMDJN-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO COc1ccc(F)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000816477722 1028886469 /nfs/dbraw/zinc/88/64/69/1028886469.db2.gz IBTQXMGIAKNWSB-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO COCC[N@H+](Cc1cc(Cl)c(F)cc1O)C1CCCC1 ZINC000816490623 1028900187 /nfs/dbraw/zinc/90/01/87/1028900187.db2.gz ZTALHEKIJOTVOK-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO COCC[N@@H+](Cc1cc(Cl)c(F)cc1O)C1CCCC1 ZINC000816490623 1028900201 /nfs/dbraw/zinc/90/02/01/1028900201.db2.gz ZTALHEKIJOTVOK-UHFFFAOYSA-N 1 1 301.789 3.576 20 10 DHCDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816492977 1028900317 /nfs/dbraw/zinc/90/03/17/1028900317.db2.gz KSVLLOAWWSAXSC-LBPRGKRZSA-N 1 1 323.795 3.568 20 10 DHCDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816492977 1028900332 /nfs/dbraw/zinc/90/03/32/1028900332.db2.gz KSVLLOAWWSAXSC-LBPRGKRZSA-N 1 1 323.795 3.568 20 10 DHCDMO Oc1c(C[N@H+]2CCCC[C@@H](N3CCCC3)C2)ccc2ccccc21 ZINC000816499526 1028908211 /nfs/dbraw/zinc/90/82/11/1028908211.db2.gz SYDOHALJHQYXAD-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO Oc1c(CN2CCCC[C@@H]([NH+]3CCCC3)C2)ccc2ccccc21 ZINC000816499526 1028908227 /nfs/dbraw/zinc/90/82/27/1028908227.db2.gz SYDOHALJHQYXAD-LJQANCHMSA-N 1 1 324.468 3.996 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816508310 1028912843 /nfs/dbraw/zinc/91/28/43/1028912843.db2.gz IRRBPKGPTOMBLH-LLVKDONJSA-N 1 1 323.795 3.953 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816508310 1028912858 /nfs/dbraw/zinc/91/28/58/1028912858.db2.gz IRRBPKGPTOMBLH-LLVKDONJSA-N 1 1 323.795 3.953 20 10 DHCDMO [O-]c1c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513842 1028913757 /nfs/dbraw/zinc/91/37/57/1028913757.db2.gz DMDOJEARIMZYRY-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO [O-]c1c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513842 1028913759 /nfs/dbraw/zinc/91/37/59/1028913759.db2.gz DMDOJEARIMZYRY-IBGZPJMESA-N 1 1 324.468 3.996 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)[C@@H](CCO)c1ccccc1 ZINC000816512832 1028914495 /nfs/dbraw/zinc/91/44/95/1028914495.db2.gz WLMXLAUWPBWKSN-INIZCTEOSA-N 1 1 323.795 3.740 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@@H](CCO)c1ccccc1 ZINC000816512832 1028914509 /nfs/dbraw/zinc/91/45/09/1028914509.db2.gz WLMXLAUWPBWKSN-INIZCTEOSA-N 1 1 323.795 3.740 20 10 DHCDMO COc1ccc(C2([NH2+]Cc3cc(Cl)c(F)cc3O)CC2)cc1 ZINC000816546409 1028928970 /nfs/dbraw/zinc/92/89/70/1028928970.db2.gz JGOPOBNGYHCYDI-UHFFFAOYSA-N 1 1 321.779 3.972 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)ccc2ccccc21 ZINC000816521706 1028932750 /nfs/dbraw/zinc/93/27/50/1028932750.db2.gz XBSYGDLHACIQTL-FUHWJXTLSA-N 1 1 311.425 3.794 20 10 DHCDMO C[C@@](CO)([NH2+]Cc1cc(Cl)c(F)cc1O)C1CCCCC1 ZINC000816552111 1028938513 /nfs/dbraw/zinc/93/85/13/1028938513.db2.gz BAOHUBAKMDKDDY-INIZCTEOSA-N 1 1 315.816 3.606 20 10 DHCDMO CCOCCC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCC1 ZINC000816558174 1028941591 /nfs/dbraw/zinc/94/15/91/1028941591.db2.gz PLQRBZLMJLWGEZ-UHFFFAOYSA-N 1 1 315.816 3.871 20 10 DHCDMO COc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c(C)c1 ZINC000816558216 1028942228 /nfs/dbraw/zinc/94/22/28/1028942228.db2.gz QXSBTEGZJWNYDW-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO CCO[C@@H](CC[NH2+]Cc1cc(Cl)c(F)cc1O)C(C)C ZINC000816555817 1028942576 /nfs/dbraw/zinc/94/25/76/1028942576.db2.gz QYWNJHFZNLFHKR-HNNXBMFYSA-N 1 1 303.805 3.726 20 10 DHCDMO OCC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)C1CCCCC1 ZINC000816559352 1028946272 /nfs/dbraw/zinc/94/62/72/1028946272.db2.gz GVVUREKZOHOBMN-OAHLLOKOSA-N 1 1 315.816 3.606 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc(Cl)cn1 ZINC000816560346 1028946547 /nfs/dbraw/zinc/94/65/47/1028946547.db2.gz LSNOIYUOTLSLHN-UHFFFAOYSA-N 1 1 301.148 3.523 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@@H](c3ccccn3)C2)ccc2ccccc21 ZINC000816599411 1028955612 /nfs/dbraw/zinc/95/56/12/1028955612.db2.gz LUZMWBZRPCFGJO-MRXNPFEDSA-N 1 1 304.393 3.930 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816617402 1028963872 /nfs/dbraw/zinc/96/38/72/1028963872.db2.gz XVSADEOOIJGALD-SNVBAGLBSA-N 1 1 303.830 3.760 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CC1(c2ccccn2)CCC1 ZINC000816609151 1028961128 /nfs/dbraw/zinc/96/11/28/1028961128.db2.gz TVQNSAFYLJJVMW-UHFFFAOYSA-N 1 1 320.795 3.791 20 10 DHCDMO Cc1ccc([C@H](O)[C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816608505 1028961150 /nfs/dbraw/zinc/96/11/50/1028961150.db2.gz BERJNVGVXXIQRX-APPDUMDISA-N 1 1 323.795 3.705 20 10 DHCDMO CSC[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816617402 1028963857 /nfs/dbraw/zinc/96/38/57/1028963857.db2.gz XVSADEOOIJGALD-SNVBAGLBSA-N 1 1 303.830 3.760 20 10 DHCDMO C[N@H+]1CCN(Cc2cc(Cl)c(F)cc2O)c2ccccc2C1 ZINC000816617836 1028964181 /nfs/dbraw/zinc/96/41/81/1028964181.db2.gz JTYCQFFIKQZVRF-UHFFFAOYSA-N 1 1 320.795 3.637 20 10 DHCDMO COc1cc2c(cc1Cl)C[N@H+](Cc1cc(F)ccc1O)CC2 ZINC000816664722 1028983460 /nfs/dbraw/zinc/98/34/60/1028983460.db2.gz CBOINDVTSCRDGG-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc2c(cc1Cl)C[N@@H+](Cc1cc(F)ccc1O)CC2 ZINC000816664722 1028983474 /nfs/dbraw/zinc/98/34/74/1028983474.db2.gz CBOINDVTSCRDGG-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1CC12CCSCC2 ZINC000817409684 1029149827 /nfs/dbraw/zinc/14/98/27/1029149827.db2.gz DSMZXIVIZPWSCT-JTQLQIEISA-N 1 1 315.841 3.808 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000817412196 1029152131 /nfs/dbraw/zinc/15/21/31/1029152131.db2.gz GFZFGCPLQNAVOM-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000817413287 1029153160 /nfs/dbraw/zinc/15/31/60/1029153160.db2.gz VQOZLQFXJBDRPB-GFCCVEGCSA-N 1 1 317.351 3.955 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000155255707 1029213711 /nfs/dbraw/zinc/21/37/11/1029213711.db2.gz IHPSAIBXMZANKN-GOSISDBHSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c(O)c(C(C)(C)C)c1 ZINC000155463237 1029235050 /nfs/dbraw/zinc/23/50/50/1029235050.db2.gz PAGKWVGBABHUJP-ZBFHGGJFSA-N 1 1 305.462 3.733 20 10 DHCDMO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCc1ccc(N2CCCC2)cc1 ZINC000817898134 1029270874 /nfs/dbraw/zinc/27/08/74/1029270874.db2.gz DKLMRHWCVUKGPJ-HKUYNNGSSA-N 1 1 315.505 3.687 20 10 DHCDMO Cc1ccc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)c1 ZINC000817938345 1029283061 /nfs/dbraw/zinc/28/30/61/1029283061.db2.gz JEENDUJWLWOCOT-JXFKEZNVSA-N 1 1 311.473 3.720 20 10 DHCDMO CC(C)[NH2+]CCCN[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817953347 1029295275 /nfs/dbraw/zinc/29/52/75/1029295275.db2.gz KZJAXXFZGKIYHN-QGZVFWFLSA-N 1 1 303.494 3.716 20 10 DHCDMO CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963932 1029299188 /nfs/dbraw/zinc/29/91/88/1029299188.db2.gz YRMBQDGTGRKKHN-UWVGGRQHSA-N 1 1 305.249 3.867 20 10 DHCDMO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969048 1029310562 /nfs/dbraw/zinc/31/05/62/1029310562.db2.gz QHXUZPXVTLJCTR-WBVHZDCISA-N 1 1 319.468 3.609 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817971568 1029311121 /nfs/dbraw/zinc/31/11/21/1029311121.db2.gz OHHYYTLNBYVAGP-JKOKRWQUSA-N 1 1 316.367 3.592 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969043 1029312189 /nfs/dbraw/zinc/31/21/89/1029312189.db2.gz QHHWXTFLGUGIIW-TVYUQYBPSA-N 1 1 317.260 3.738 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC000817985166 1029323617 /nfs/dbraw/zinc/32/36/17/1029323617.db2.gz BJYTZJALLSMJDD-RKTXRCNFSA-N 1 1 310.441 3.584 20 10 DHCDMO Cc1cnc([C@H]2CCC[N@H+](Cc3cccc(F)c3O)C2)s1 ZINC000374894055 1029489531 /nfs/dbraw/zinc/48/95/31/1029489531.db2.gz KCYCDQZYCBHUFW-ZDUSSCGKSA-N 1 1 306.406 3.676 20 10 DHCDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3cccc(F)c3O)C2)s1 ZINC000374894055 1029489537 /nfs/dbraw/zinc/48/95/37/1029489537.db2.gz KCYCDQZYCBHUFW-ZDUSSCGKSA-N 1 1 306.406 3.676 20 10 DHCDMO CO[C@](C)(C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000820851868 1029780203 /nfs/dbraw/zinc/78/02/03/1029780203.db2.gz UCYZINYSISBMPY-HXUWFJFHSA-N 1 1 316.489 3.924 20 10 DHCDMO CCOc1cccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000865822844 1030040677 /nfs/dbraw/zinc/04/06/77/1030040677.db2.gz PCQBVVLMRIPFPJ-HNNXBMFYSA-N 1 1 307.340 3.730 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)C[C@](C)(O)c1ccccc1 ZINC000822520514 1030042685 /nfs/dbraw/zinc/04/26/85/1030042685.db2.gz DYFZSCKJDWIOSR-KRWDZBQOSA-N 1 1 323.795 3.524 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C[C@](C)(O)c1ccccc1 ZINC000822520514 1030042700 /nfs/dbraw/zinc/04/27/00/1030042700.db2.gz DYFZSCKJDWIOSR-KRWDZBQOSA-N 1 1 323.795 3.524 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCO1 ZINC000823394862 1030278718 /nfs/dbraw/zinc/27/87/18/1030278718.db2.gz DADDPXRYJBUQQS-OAHLLOKOSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N(C)Cc3cccs3)cc2)CCO1 ZINC000823394862 1030278735 /nfs/dbraw/zinc/27/87/35/1030278735.db2.gz DADDPXRYJBUQQS-OAHLLOKOSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823459026 1030293536 /nfs/dbraw/zinc/29/35/36/1030293536.db2.gz MSVWCRFFHLUFHT-OAHLLOKOSA-N 1 1 318.486 3.587 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](OCC3CC3)C1)CCCC2 ZINC000777547533 1030296292 /nfs/dbraw/zinc/29/62/92/1030296292.db2.gz CLPMQWGOFSAIAF-LJQANCHMSA-N 1 1 315.457 3.662 20 10 DHCDMO C[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCOC1)c1ccc(Cl)cc1O ZINC000866511965 1030337546 /nfs/dbraw/zinc/33/75/46/1030337546.db2.gz GUFJYPJVTLEAAH-XTQGRXLLSA-N 1 1 309.837 3.901 20 10 DHCDMO COc1cccc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000866596127 1030390569 /nfs/dbraw/zinc/39/05/69/1030390569.db2.gz BFGSRMKDYKNFHZ-NHYWBVRUSA-N 1 1 307.340 3.901 20 10 DHCDMO C[C@@H](c1cc(Cl)ccc1O)[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925754192 1030483410 /nfs/dbraw/zinc/48/34/10/1030483410.db2.gz MEMYABUXKIHMCR-NSHDSACASA-N 1 1 318.804 3.583 20 10 DHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(Cl)c(C)cc2O)no1 ZINC000824575697 1030584974 /nfs/dbraw/zinc/58/49/74/1030584974.db2.gz NDQGDZPSHYIYKC-OAHLLOKOSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)c(C)cc2O)no1 ZINC000824575697 1030584980 /nfs/dbraw/zinc/58/49/80/1030584980.db2.gz NDQGDZPSHYIYKC-OAHLLOKOSA-N 1 1 306.793 3.988 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCO[C@@H](c3ccsc3)C1)CCC2 ZINC000122186552 1030590454 /nfs/dbraw/zinc/59/04/54/1030590454.db2.gz WFNKCVNMNULGGI-GOSISDBHSA-N 1 1 315.438 3.516 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824697026 1030601817 /nfs/dbraw/zinc/60/18/17/1030601817.db2.gz YANNKMKNHXJYID-BFYDXBDKSA-N 1 1 309.837 3.561 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c(O)c1 ZINC000824714266 1030619287 /nfs/dbraw/zinc/61/92/87/1030619287.db2.gz AVMXGGMDPNFONK-DGCLKSJQSA-N 1 1 317.351 3.954 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000824716404 1030619533 /nfs/dbraw/zinc/61/95/33/1030619533.db2.gz UFPNFZRJMSDCQK-WCQYABFASA-N 1 1 317.351 3.954 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccc(Cl)cn1 ZINC001136929504 1030621783 /nfs/dbraw/zinc/62/17/83/1030621783.db2.gz NNAVFJVLHQUGNM-UHFFFAOYSA-N 1 1 315.848 3.967 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1 ZINC000824893287 1030661182 /nfs/dbraw/zinc/66/11/82/1030661182.db2.gz OQFBKTLSTHOABD-MOPGFXCFSA-N 1 1 314.473 3.534 20 10 DHCDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000825005748 1030684605 /nfs/dbraw/zinc/68/46/05/1030684605.db2.gz REWBQIVNOMFUDE-MRXNPFEDSA-N 1 1 312.461 3.744 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)c2nccn21 ZINC000825017721 1030699963 /nfs/dbraw/zinc/69/99/63/1030699963.db2.gz YJBFXTIRNAQZIP-CRAIPNDOSA-N 1 1 310.445 3.669 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1OCCc2sccc21)c1ccc(F)cc1O ZINC000291935062 1030710341 /nfs/dbraw/zinc/71/03/41/1030710341.db2.gz PDGQAGYPYUOCBD-PSVSLLHZSA-N 1 1 321.417 3.946 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926904404 1030977795 /nfs/dbraw/zinc/97/77/95/1030977795.db2.gz HKGWJGNZXUIRRF-NURSFMCSSA-N 1 1 321.314 3.682 20 10 DHCDMO Cc1nc2c(cccc2CC[NH2+][C@@H](C)c2ccc(F)cc2O)o1 ZINC000926974458 1031022156 /nfs/dbraw/zinc/02/21/56/1031022156.db2.gz LKQFSPAUYKHYHL-NSHDSACASA-N 1 1 314.360 3.874 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1OCCc2ccccc21)c1c(O)cccc1F ZINC000927113509 1031098630 /nfs/dbraw/zinc/09/86/30/1031098630.db2.gz ZNTNSOCGJORDLM-FZKQIMNGSA-N 1 1 315.388 3.886 20 10 DHCDMO Cc1nc(CN(Cc2ccccc2O)[C@@H](C)c2ccccc2)n[nH]1 ZINC000292657539 1031117917 /nfs/dbraw/zinc/11/79/17/1031117917.db2.gz AWBRJPITHJPNJV-AWEZNQCLSA-N 1 1 322.412 3.582 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2c(O)ccc3ccncc32)C(C)C)cn1 ZINC000844740903 1031311406 /nfs/dbraw/zinc/31/14/06/1031311406.db2.gz ZSIHFEYDNMVKIO-UHFFFAOYSA-N 1 1 324.428 3.567 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000844761058 1031318362 /nfs/dbraw/zinc/31/83/62/1031318362.db2.gz VFRONRGSDLYNII-MRXNPFEDSA-N 1 1 311.372 3.626 20 10 DHCDMO CC1(C)CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144300011 1031440238 /nfs/dbraw/zinc/44/02/38/1031440238.db2.gz NYHCSYUZBGGASX-UHFFFAOYSA-N 1 1 316.214 3.916 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[NH+]1CCCCCC1 ZINC001144298792 1031436667 /nfs/dbraw/zinc/43/66/67/1031436667.db2.gz JHAJBGTYORJSLH-UHFFFAOYSA-N 1 1 302.187 3.670 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001144298571 1031437196 /nfs/dbraw/zinc/43/71/96/1031437196.db2.gz GVBOGILYMKCBSH-NXEZZACHSA-N 1 1 314.198 3.526 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CC2CCC1CC2 ZINC001144306642 1031455503 /nfs/dbraw/zinc/45/55/03/1031455503.db2.gz KNYJWLXMEZRPCE-UHFFFAOYSA-N 1 1 314.198 3.668 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CC2CCC1CC2 ZINC001144306642 1031455512 /nfs/dbraw/zinc/45/55/12/1031455512.db2.gz KNYJWLXMEZRPCE-UHFFFAOYSA-N 1 1 314.198 3.668 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)c(C)nn1 ZINC000929293928 1031486234 /nfs/dbraw/zinc/48/62/34/1031486234.db2.gz ABTOQATUFCZAII-UHFFFAOYSA-N 1 1 312.461 3.570 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ncc(Cl)s2)c2c1c(F)ccc2O ZINC000872114842 1031506198 /nfs/dbraw/zinc/50/61/98/1031506198.db2.gz COPGUYXVUVNQFA-VXNVDRBHSA-N 1 1 312.797 3.979 20 10 DHCDMO CN(C)c1ccccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293622863 1031544881 /nfs/dbraw/zinc/54/48/81/1031544881.db2.gz MPTUAVNRAFOLEC-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO COc1cc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccco2)cc1OC ZINC000872634351 1031636503 /nfs/dbraw/zinc/63/65/03/1031636503.db2.gz PLHUEZXNHGACGS-KRWDZBQOSA-N 1 1 317.385 3.586 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC(C)(C)[C@@H]2c2ccco2)cc1OC ZINC000872634351 1031636509 /nfs/dbraw/zinc/63/65/09/1031636509.db2.gz PLHUEZXNHGACGS-KRWDZBQOSA-N 1 1 317.385 3.586 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3cccc(O)c3C2)c1 ZINC001144489577 1031640670 /nfs/dbraw/zinc/64/06/70/1031640670.db2.gz JKDPQPBZARPNJN-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c1 ZINC000872721187 1031647391 /nfs/dbraw/zinc/64/73/91/1031647391.db2.gz CVVVSILHDMVGFE-OCCSQVGLSA-N 1 1 321.486 3.580 20 10 DHCDMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1c(O)cc(O)cc1O ZINC001144516430 1031674410 /nfs/dbraw/zinc/67/44/10/1031674410.db2.gz YERTWPOUQMYXCF-SNVBAGLBSA-N 1 1 307.777 3.650 20 10 DHCDMO CC(C)c1nccn1C[C@H]1CCC[N@H+]1Cc1cc(F)ccc1O ZINC000361065975 1031706636 /nfs/dbraw/zinc/70/66/36/1031706636.db2.gz IXVUMNPZGJVZTG-MRXNPFEDSA-N 1 1 317.408 3.516 20 10 DHCDMO CC[N@@H+](Cc1cc2cnccc2o1)Cc1ccc(N(C)C)cc1 ZINC000845903655 1031768379 /nfs/dbraw/zinc/76/83/79/1031768379.db2.gz RDWZGLXTUCUTEC-UHFFFAOYSA-N 1 1 309.413 3.916 20 10 DHCDMO COCCc1cc[nH+]c(N[C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000294088612 1031792785 /nfs/dbraw/zinc/79/27/85/1031792785.db2.gz IUICQYMGURDTNB-AWEZNQCLSA-N 1 1 300.402 3.766 20 10 DHCDMO C[C@]1(CC[NH2+]Cc2cc(Cl)c(F)cc2O)C[C@]1(F)Cl ZINC000846029274 1031819701 /nfs/dbraw/zinc/81/97/01/1031819701.db2.gz IJQODVQTIGZFTH-QWHCGFSZSA-N 1 1 310.171 3.979 20 10 DHCDMO C[N@H+](CC/C=C/c1cccnc1)Cc1cc(F)c(F)cc1O ZINC001142527370 1031910990 /nfs/dbraw/zinc/91/09/90/1031910990.db2.gz SMISFEFFCRDAOQ-GORDUTHDSA-N 1 1 304.340 3.601 20 10 DHCDMO C[N@@H+](CC/C=C/c1cccnc1)Cc1cc(F)c(F)cc1O ZINC001142527370 1031910998 /nfs/dbraw/zinc/91/09/98/1031910998.db2.gz SMISFEFFCRDAOQ-GORDUTHDSA-N 1 1 304.340 3.601 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1 ZINC000846179780 1031913694 /nfs/dbraw/zinc/91/36/94/1031913694.db2.gz MTUDCZUPBINPHX-DJSGYFEHSA-N 1 1 323.458 3.504 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071983 1031942965 /nfs/dbraw/zinc/94/29/65/1031942965.db2.gz WTNJIRJSFYVZMS-NSHDSACASA-N 1 1 308.834 3.567 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCC(C)(C)C1 ZINC000877492128 1033323231 /nfs/dbraw/zinc/32/32/31/1033323231.db2.gz SFYUHHKBFSDWJT-GOSISDBHSA-N 1 1 316.489 3.658 20 10 DHCDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c(O)c1 ZINC000877634462 1033391713 /nfs/dbraw/zinc/39/17/13/1033391713.db2.gz QAFHQMJOILXROK-GOSISDBHSA-N 1 1 313.397 3.647 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1C ZINC000877674940 1033407323 /nfs/dbraw/zinc/40/73/23/1033407323.db2.gz XMWIZLKMMSSYSE-RTBURBONSA-N 1 1 311.425 3.707 20 10 DHCDMO COCc1ccccc1/C=C(/C)C[N@H+]1Cc2cccc(O)c2C1 ZINC000877703283 1033417793 /nfs/dbraw/zinc/41/77/93/1033417793.db2.gz ZYWBPMGEVAPFLK-GDNBJRDFSA-N 1 1 309.409 3.958 20 10 DHCDMO CO[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001172939432 1033477110 /nfs/dbraw/zinc/47/71/10/1033477110.db2.gz POBZUQGDHVIDAI-RBUKOAKNSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(F)c1C ZINC000862211572 1033780348 /nfs/dbraw/zinc/78/03/48/1033780348.db2.gz KBTNXVQOAYCAJR-UHFFFAOYSA-N 1 1 301.409 3.617 20 10 DHCDMO C[C@@H](c1cccnc1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862322971 1033814879 /nfs/dbraw/zinc/81/48/79/1033814879.db2.gz QVLHTHJKGFPJNF-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862322971 1033814896 /nfs/dbraw/zinc/81/48/96/1033814896.db2.gz QVLHTHJKGFPJNF-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@H](c1cccnc1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862322969 1033816883 /nfs/dbraw/zinc/81/68/83/1033816883.db2.gz QVLHTHJKGFPJNF-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862322969 1033816889 /nfs/dbraw/zinc/81/68/89/1033816889.db2.gz QVLHTHJKGFPJNF-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC000862373993 1033833607 /nfs/dbraw/zinc/83/36/07/1033833607.db2.gz JMYSYBQHWYUFKE-GFCCVEGCSA-N 1 1 314.445 3.606 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862482676 1033865678 /nfs/dbraw/zinc/86/56/78/1033865678.db2.gz KWAAUSQVHMNSDN-GOSISDBHSA-N 1 1 317.816 3.529 20 10 DHCDMO CCC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1O ZINC000175284129 1033999333 /nfs/dbraw/zinc/99/93/33/1033999333.db2.gz VDKPKVAQGHETOT-ZDUSSCGKSA-N 1 1 320.458 3.968 20 10 DHCDMO CCC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1O ZINC000175284129 1033999340 /nfs/dbraw/zinc/99/93/40/1033999340.db2.gz VDKPKVAQGHETOT-ZDUSSCGKSA-N 1 1 320.458 3.968 20 10 DHCDMO Oc1cc(Br)ccc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000826113659 1034060457 /nfs/dbraw/zinc/06/04/57/1034060457.db2.gz OCVWKAGLRNKDAZ-UHFFFAOYSA-N 1 1 324.140 3.539 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1nc(-c2cccs2)no1 ZINC000879649112 1034069865 /nfs/dbraw/zinc/06/98/65/1034069865.db2.gz LYOOWTZRYHKEIC-GHMZBOCLSA-N 1 1 315.398 3.916 20 10 DHCDMO Oc1cc(Br)ccc1Nc1cc[nH+]c2ccccc12 ZINC001174039182 1034095349 /nfs/dbraw/zinc/09/53/49/1034095349.db2.gz YDLSYNLYGFWYDQ-UHFFFAOYSA-N 1 1 315.170 3.868 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1Cl ZINC000826142375 1034212959 /nfs/dbraw/zinc/21/29/59/1034212959.db2.gz ANQVFCYMLSQKMW-CQSZACIVSA-N 1 1 301.764 3.975 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000178254278 1034223299 /nfs/dbraw/zinc/22/32/99/1034223299.db2.gz XEZOPHMOBHFKKX-INIZCTEOSA-N 1 1 315.505 3.668 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NC2CC[NH+](CC3CC3)CC2)cc1 ZINC000178254278 1034223317 /nfs/dbraw/zinc/22/33/17/1034223317.db2.gz XEZOPHMOBHFKKX-INIZCTEOSA-N 1 1 315.505 3.668 20 10 DHCDMO Cc1ccc(NCc2ccc(F)c(F)c2O)c(C[NH+](C)C)c1 ZINC000864028658 1034264189 /nfs/dbraw/zinc/26/41/89/1034264189.db2.gz WSLUVCWDZWTKMJ-UHFFFAOYSA-N 1 1 306.356 3.653 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)c1 ZINC000179563520 1034315965 /nfs/dbraw/zinc/31/59/65/1034315965.db2.gz MZWMFTOTMNFLSK-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000794663713 1034321873 /nfs/dbraw/zinc/32/18/73/1034321873.db2.gz VDFDRAFSPCZBRD-QMTHXVAHSA-N 1 1 310.319 3.713 20 10 DHCDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000179664531 1034325534 /nfs/dbraw/zinc/32/55/34/1034325534.db2.gz PUWWYCZSRGCOEE-CYBMUJFWSA-N 1 1 301.386 3.602 20 10 DHCDMO Cc1ccsc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000179703686 1034328031 /nfs/dbraw/zinc/32/80/31/1034328031.db2.gz YETNPFBOCGEEFI-UHFFFAOYSA-N 1 1 316.470 3.525 20 10 DHCDMO CC(C)Oc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cn1 ZINC000185046087 1034525698 /nfs/dbraw/zinc/52/56/98/1034525698.db2.gz JKRASBGOBUINJG-GFCCVEGCSA-N 1 1 304.365 3.564 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1ccc(F)cc1O ZINC000185323161 1034540614 /nfs/dbraw/zinc/54/06/14/1034540614.db2.gz NUGCOSAKBRKYSB-GFCCVEGCSA-N 1 1 317.360 3.543 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)c(O)c1 ZINC000185459605 1034548667 /nfs/dbraw/zinc/54/86/67/1034548667.db2.gz IGXNOOOZEUMESQ-AWEZNQCLSA-N 1 1 316.420 3.752 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(F)cc2O)o1 ZINC000185548093 1034558134 /nfs/dbraw/zinc/55/81/34/1034558134.db2.gz LUROQLKHYMCTGT-ABAIWWIYSA-N 1 1 307.365 3.725 20 10 DHCDMO C[C@@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185839601 1034576227 /nfs/dbraw/zinc/57/62/27/1034576227.db2.gz NBLKURDFOWCZPG-ZIBATOQPSA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@H]([NH2+][C@H](CO)CC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000794836005 1034591267 /nfs/dbraw/zinc/59/12/67/1034591267.db2.gz RFSNDJUJOPHPEI-ONGXEEELSA-N 1 1 318.244 3.901 20 10 DHCDMO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccc(F)cc1O ZINC000186159394 1034604104 /nfs/dbraw/zinc/60/41/04/1034604104.db2.gz WDEDUJARXHCCPT-UGSOOPFHSA-N 1 1 315.388 3.696 20 10 DHCDMO C[C@@H]([NH2+]CCCn1ccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192591414 1034811461 /nfs/dbraw/zinc/81/14/61/1034811461.db2.gz OWBCPRPPCDEBQH-SNVBAGLBSA-N 1 1 314.216 3.636 20 10 DHCDMO Cc1c(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)cnn1C ZINC000193053198 1034829325 /nfs/dbraw/zinc/82/93/25/1034829325.db2.gz QLNGYGOWGXXIGE-QMMMGPOBSA-N 1 1 314.216 3.592 20 10 DHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000757995812 1035149845 /nfs/dbraw/zinc/14/98/45/1035149845.db2.gz OMSRLHIAYNBXKR-GOSISDBHSA-N 1 1 302.462 3.678 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000773766608 1035442877 /nfs/dbraw/zinc/44/28/77/1035442877.db2.gz UBIIFMBNWVQOPB-QGZVFWFLSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000773766608 1035442880 /nfs/dbraw/zinc/44/28/80/1035442880.db2.gz UBIIFMBNWVQOPB-QGZVFWFLSA-N 1 1 316.470 3.778 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+][C@@H]2C[C@H]2CC(C)C)c1 ZINC001178922288 1035455833 /nfs/dbraw/zinc/45/58/33/1035455833.db2.gz UGOKQCMHCKATIE-BXUZGUMPSA-N 1 1 312.251 3.987 20 10 DHCDMO Cc1cc(O)c(CN[C@H](C)C[NH+]2CCC(C)CC2)c(Cl)c1 ZINC001179148810 1035467431 /nfs/dbraw/zinc/46/74/31/1035467431.db2.gz WDIUPFMXJVJGDB-CQSZACIVSA-N 1 1 310.869 3.564 20 10 DHCDMO CCN(C)c1ccc(C[NH2+][C@@H](COC)c2ccc(C)o2)cc1 ZINC000773832697 1035509451 /nfs/dbraw/zinc/50/94/51/1035509451.db2.gz AOAAHKZYRBWROS-KRWDZBQOSA-N 1 1 302.418 3.521 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)cc1 ZINC000773832777 1035509819 /nfs/dbraw/zinc/50/98/19/1035509819.db2.gz PVJYFDJWNFHYLE-LJQANCHMSA-N 1 1 309.457 3.602 20 10 DHCDMO Cc1cc(N(C)C)ccc1CN1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC001179906719 1035545055 /nfs/dbraw/zinc/54/50/55/1035545055.db2.gz ZYIPAICQTQDKOU-QUCCMNQESA-N 1 1 315.505 3.508 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(O)c1 ZINC001179914023 1035546981 /nfs/dbraw/zinc/54/69/81/1035546981.db2.gz QLUPZKVFKIMCQT-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO CO[C@]1(C)C[C@@H]([N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)C1(C)C ZINC001179958188 1035557060 /nfs/dbraw/zinc/55/70/60/1035557060.db2.gz WRPUVZPIROPCEN-NREOILKTSA-N 1 1 316.489 3.901 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c(O)c1 ZINC001180052871 1035576173 /nfs/dbraw/zinc/57/61/73/1035576173.db2.gz WEIGVBXWAGLEDE-WBVHZDCISA-N 1 1 307.459 3.569 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001180219504 1035622136 /nfs/dbraw/zinc/62/21/36/1035622136.db2.gz NIXYMZQDXLWNCY-UHFFFAOYSA-N 1 1 316.395 3.898 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001180219504 1035622148 /nfs/dbraw/zinc/62/21/48/1035622148.db2.gz NIXYMZQDXLWNCY-UHFFFAOYSA-N 1 1 316.395 3.898 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@@H](C)c2nccs2)cc1 ZINC000773842117 1035624168 /nfs/dbraw/zinc/62/41/68/1035624168.db2.gz UWLUSEOLEKJJMS-CQSZACIVSA-N 1 1 303.475 3.835 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC001180430601 1035670594 /nfs/dbraw/zinc/67/05/94/1035670594.db2.gz OXGYBJXYIJKICO-WMZOPIPTSA-N 1 1 305.462 3.745 20 10 DHCDMO Oc1ccc(C[N@H+]2CC[C@H](Sc3ccc(F)cc3)C2)c(O)c1 ZINC001204278158 1035745329 /nfs/dbraw/zinc/74/53/29/1035745329.db2.gz VTXJIOQYCCZMOD-INIZCTEOSA-N 1 1 319.401 3.604 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1[O-] ZINC001180970704 1035798214 /nfs/dbraw/zinc/79/82/14/1035798214.db2.gz WBKRXVGVKNVVRO-LDYMZIIASA-N 1 1 309.278 3.833 20 10 DHCDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001180970704 1035798229 /nfs/dbraw/zinc/79/82/29/1035798229.db2.gz WBKRXVGVKNVVRO-LDYMZIIASA-N 1 1 309.278 3.833 20 10 DHCDMO Cc1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c(C)nn1 ZINC000929636436 1036160597 /nfs/dbraw/zinc/16/05/97/1036160597.db2.gz VYLMORWJEAIJPM-UHFFFAOYSA-N 1 1 311.429 3.744 20 10 DHCDMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC001195213806 1036183133 /nfs/dbraw/zinc/18/31/33/1036183133.db2.gz IWJZUFGCMHNSFW-GOSISDBHSA-N 1 1 316.489 3.781 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774160827 1036206409 /nfs/dbraw/zinc/20/64/09/1036206409.db2.gz BRPYQBRKCZQCPR-NXEZZACHSA-N 1 1 317.260 3.832 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](CCO)c2ccccc2)cc1Cl ZINC001204335061 1036218232 /nfs/dbraw/zinc/21/82/32/1036218232.db2.gz OLACSFNRJAWYOB-KRWDZBQOSA-N 1 1 319.832 3.910 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)c1cn[nH]c1 ZINC000774266919 1036265706 /nfs/dbraw/zinc/26/57/06/1036265706.db2.gz SKJDMZFGFXVMSL-HTQZYQBOSA-N 1 1 300.189 3.834 20 10 DHCDMO C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774274426 1036273629 /nfs/dbraw/zinc/27/36/29/1036273629.db2.gz SYOZPDXXKDFBNT-SNVBAGLBSA-N 1 1 315.244 3.612 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](Cc2ccccc2)C[C@@H](C)O)c1O ZINC000775659632 1036273779 /nfs/dbraw/zinc/27/37/79/1036273779.db2.gz ZRXGHSFQODKJAC-CQSZACIVSA-N 1 1 319.832 3.737 20 10 DHCDMO Cc1occc1C[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000775662094 1036281219 /nfs/dbraw/zinc/28/12/19/1036281219.db2.gz UFJOPQJRXFLZIL-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO C[C@@H]([NH2+]CC1(N(C)C)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774366192 1036299374 /nfs/dbraw/zinc/29/93/74/1036299374.db2.gz BVCFQIBRYISPIK-SNVBAGLBSA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@H]([NH2+]C1COC(C)(C)OC1)c1cc(Cl)c(Cl)cc1O ZINC000774349047 1036312366 /nfs/dbraw/zinc/31/23/66/1036312366.db2.gz SBBXWRPAKBZGRP-QMMMGPOBSA-N 1 1 320.216 3.501 20 10 DHCDMO COc1ccc(N(C)CC[N@H+](C)Cc2cc(F)ccc2F)cc1 ZINC001195791070 1036346591 /nfs/dbraw/zinc/34/65/91/1036346591.db2.gz WWHYSFMPTVTWJT-UHFFFAOYSA-N 1 1 320.383 3.542 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2cc(F)ccc2F)cc1 ZINC001195791070 1036346605 /nfs/dbraw/zinc/34/66/05/1036346605.db2.gz WWHYSFMPTVTWJT-UHFFFAOYSA-N 1 1 320.383 3.542 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@@H]2CCC[C@H](C)C2)cc1 ZINC001195790682 1036347477 /nfs/dbraw/zinc/34/74/77/1036347477.db2.gz VKIRIRFCRGYNHI-DLBZAZTESA-N 1 1 304.478 3.890 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000774497384 1036359729 /nfs/dbraw/zinc/35/97/29/1036359729.db2.gz OFTLJKNLRNCVMS-MLGOLLRUSA-N 1 1 318.436 3.544 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)C[C@H]2CCc3ccccc32)cc1 ZINC001182726715 1036438200 /nfs/dbraw/zinc/43/82/00/1036438200.db2.gz XVLBDMSQJMHVHX-GOSISDBHSA-N 1 1 324.468 3.793 20 10 DHCDMO C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC001206540474 1036440417 /nfs/dbraw/zinc/44/04/17/1036440417.db2.gz BSAOHSQYMJKPJX-OAHLLOKOSA-N 1 1 317.260 3.650 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775687564 1036454228 /nfs/dbraw/zinc/45/42/28/1036454228.db2.gz FIBWMNZCYBLDGZ-CQSZACIVSA-N 1 1 315.816 3.966 20 10 DHCDMO CC(C)CCO[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001183093870 1036520634 /nfs/dbraw/zinc/52/06/34/1036520634.db2.gz GLBJIIBSUDJEQV-GFCCVEGCSA-N 1 1 315.816 3.822 20 10 DHCDMO CC(C)CCO[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC001183093870 1036520642 /nfs/dbraw/zinc/52/06/42/1036520642.db2.gz GLBJIIBSUDJEQV-GFCCVEGCSA-N 1 1 315.816 3.822 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCCN(Cc3ccccc3)C[C@@H]2C)c1O ZINC000775716437 1036533390 /nfs/dbraw/zinc/53/33/90/1036533390.db2.gz XDVOETPKIBDVPE-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1O ZINC000775716437 1036533398 /nfs/dbraw/zinc/53/33/98/1036533398.db2.gz XDVOETPKIBDVPE-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)c1O ZINC000775716437 1036533412 /nfs/dbraw/zinc/53/34/12/1036533412.db2.gz XDVOETPKIBDVPE-SFHVURJKSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1C ZINC000029894394 1036553259 /nfs/dbraw/zinc/55/32/59/1036553259.db2.gz UBUVJKFYIVKBAX-IBGZPJMESA-N 1 1 315.388 3.722 20 10 DHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001183410936 1036582101 /nfs/dbraw/zinc/58/21/01/1036582101.db2.gz XSCVFCCKFDIWME-SFHVURJKSA-N 1 1 303.352 3.992 20 10 DHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001183410936 1036582107 /nfs/dbraw/zinc/58/21/07/1036582107.db2.gz XSCVFCCKFDIWME-SFHVURJKSA-N 1 1 303.352 3.992 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1F ZINC000102675123 1036627262 /nfs/dbraw/zinc/62/72/62/1036627262.db2.gz YHKDVTQFNPJIMD-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)cc1F ZINC001183673009 1036644898 /nfs/dbraw/zinc/64/48/98/1036644898.db2.gz ORDGYBFAXOOXPQ-AWEZNQCLSA-N 1 1 322.321 3.805 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)cc1F ZINC001183673009 1036644902 /nfs/dbraw/zinc/64/49/02/1036644902.db2.gz ORDGYBFAXOOXPQ-AWEZNQCLSA-N 1 1 322.321 3.805 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCOCC12CCCC2 ZINC001184364302 1036812213 /nfs/dbraw/zinc/81/22/13/1036812213.db2.gz RGLDPQROWZPGID-OAHLLOKOSA-N 1 1 313.800 3.624 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(F)c(F)cc1O)c1cc(F)ccc1N(C)C ZINC001184417339 1036843419 /nfs/dbraw/zinc/84/34/19/1036843419.db2.gz BFJITIZFWJOHTB-JTQLQIEISA-N 1 1 324.346 3.726 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCO2)ccc1N(C)C ZINC001198686055 1037108723 /nfs/dbraw/zinc/10/87/23/1037108723.db2.gz QNUZCXAAZNRGBR-RTBURBONSA-N 1 1 302.462 3.595 20 10 DHCDMO Cc1cc(C[N@H+]2CCCC[C@H]2[C@@H]2CCCO2)ccc1N(C)C ZINC001198686053 1037109411 /nfs/dbraw/zinc/10/94/11/1037109411.db2.gz QNUZCXAAZNRGBR-OALUTQOASA-N 1 1 302.462 3.595 20 10 DHCDMO Oc1cc2c(cc1O)C[N@H+](Cc1ccc(Cl)cc1)CCC2 ZINC001203921907 1037164638 /nfs/dbraw/zinc/16/46/38/1037164638.db2.gz GFXUCHSNESVEIG-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccc(Cl)cc1)CCC2 ZINC001203921907 1037164649 /nfs/dbraw/zinc/16/46/49/1037164649.db2.gz GFXUCHSNESVEIG-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCCC[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000774909521 1037202503 /nfs/dbraw/zinc/20/25/03/1037202503.db2.gz REXKHALQOKHCJD-CQSZACIVSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCCC[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000774909521 1037202523 /nfs/dbraw/zinc/20/25/23/1037202523.db2.gz REXKHALQOKHCJD-CQSZACIVSA-N 1 1 322.405 3.710 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776012125 1037305810 /nfs/dbraw/zinc/30/58/10/1037305810.db2.gz CZCFQLNVGUGONW-FZMZJTMJSA-N 1 1 317.351 3.954 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c(O)c1 ZINC000776011835 1037309467 /nfs/dbraw/zinc/30/94/67/1037309467.db2.gz BQKUTLYUACEXBR-BXUZGUMPSA-N 1 1 317.351 3.954 20 10 DHCDMO Cc1ccc[nH+]c1NCc1cc(Br)cc(C)c1O ZINC000776024678 1037343729 /nfs/dbraw/zinc/34/37/29/1037343729.db2.gz PYMDMJGQLJPZQM-UHFFFAOYSA-N 1 1 307.191 3.779 20 10 DHCDMO COc1c(O)c(C[NH2+]C(CC(C)C)CC(C)C)ccc1[N+](=O)[O-] ZINC000774997894 1037359587 /nfs/dbraw/zinc/35/95/87/1037359587.db2.gz MOHHZIJYGLBMMN-UHFFFAOYSA-N 1 1 324.421 3.859 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCC[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775014921 1037397312 /nfs/dbraw/zinc/39/73/12/1037397312.db2.gz XHWUCAFRTNLEMN-OCCSQVGLSA-N 1 1 322.405 3.613 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775025122 1037428408 /nfs/dbraw/zinc/42/84/08/1037428408.db2.gz BZOSKJMTLPBWSV-KBPBESRZSA-N 1 1 322.405 3.613 20 10 DHCDMO COc1c(O)c(C[NH2+]CC2(CC(C)C)CCC2)ccc1[N+](=O)[O-] ZINC000775034899 1037448867 /nfs/dbraw/zinc/44/88/67/1037448867.db2.gz UBFPAZZEECXRGR-UHFFFAOYSA-N 1 1 322.405 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+]CC2CCC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000775041796 1037466857 /nfs/dbraw/zinc/46/68/57/1037466857.db2.gz VFNDTVYTPBJVAR-UHFFFAOYSA-N 1 1 322.405 3.615 20 10 DHCDMO CN1CCCc2cc(NCc3cc(F)cc(F)c3[O-])ccc21 ZINC001201309075 1037602002 /nfs/dbraw/zinc/60/20/02/1037602002.db2.gz SIHJTNJHTNWYLJ-UHFFFAOYSA-N 1 1 304.340 3.665 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001203658390 1037617258 /nfs/dbraw/zinc/61/72/58/1037617258.db2.gz SYEOZRHGGVURBK-ZDUSSCGKSA-N 1 1 302.805 3.820 20 10 DHCDMO Cc1nnc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)s1 ZINC000780743020 1037800302 /nfs/dbraw/zinc/80/03/02/1037800302.db2.gz FCNFVOJDBULLHI-ZDUSSCGKSA-N 1 1 316.474 3.688 20 10 DHCDMO [O-]c1ccc(Cl)cc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000776230474 1037943695 /nfs/dbraw/zinc/94/36/95/1037943695.db2.gz JOYVTTSJSLFICM-UHFFFAOYSA-N 1 1 322.880 3.932 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)C2CCCCC2)cc1OC ZINC000775205296 1038002000 /nfs/dbraw/zinc/00/20/00/1038002000.db2.gz FXECZKCEFRXVQJ-ZDUSSCGKSA-N 1 1 307.434 3.810 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[C@H](C2CC2)O1 ZINC001190436880 1038315147 /nfs/dbraw/zinc/31/51/47/1038315147.db2.gz NEQHTNCQBCSMSK-WOJBJXKFSA-N 1 1 316.489 3.921 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2csc(N(C)C)n2)cc1 ZINC000157045850 1038489633 /nfs/dbraw/zinc/48/96/33/1038489633.db2.gz BQDGVSCSHJXZSM-CYBMUJFWSA-N 1 1 318.490 3.516 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Cl)ccc1[O-] ZINC000775512597 1038606067 /nfs/dbraw/zinc/60/60/67/1038606067.db2.gz RMTDIIMXIVZWAM-YCPHGPKFSA-N 1 1 310.869 3.959 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000760882439 1038960255 /nfs/dbraw/zinc/96/02/55/1038960255.db2.gz WUSIGGSHSDKSRL-LAEOZQHASA-N 1 1 307.394 3.590 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC[C@@](C)(F)C2)cc1Cl ZINC001232263783 1039009590 /nfs/dbraw/zinc/00/95/90/1039009590.db2.gz AAPONBZYLQKKOG-OAHLLOKOSA-N 1 1 301.789 3.768 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1[O-])C[NH+]1CCCC1 ZINC000171141655 1039285713 /nfs/dbraw/zinc/28/57/13/1039285713.db2.gz NJAFUWQPUFQRCP-CVEARBPZSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccccc1O)c1nc(C2CCCCC2)no1 ZINC000173867720 1040436142 /nfs/dbraw/zinc/43/61/42/1040436142.db2.gz YUXKCQSJZKTWIR-GFCCVEGCSA-N 1 1 301.390 3.674 20 10 DHCDMO CC[N@@H+](Cc1cccc(C)c1O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000761226916 1040820503 /nfs/dbraw/zinc/82/05/03/1040820503.db2.gz XCJITTXNZOBBTM-FQEVSTJZSA-N 1 1 324.468 3.797 20 10 DHCDMO CCCOc1ccc(C[N@@H+](C)Cc2ccccc2O)c(O)c1 ZINC000091974527 193134669 /nfs/dbraw/zinc/13/46/69/193134669.db2.gz ZYGDBYIPUKTIDI-UHFFFAOYSA-N 1 1 301.386 3.519 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(C)ccc1O)CCC2 ZINC000093365150 193239933 /nfs/dbraw/zinc/23/99/33/193239933.db2.gz HEVPZJLPMPYMNR-OAHLLOKOSA-N 1 1 302.443 3.975 20 10 DHCDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000272249178 130011736 /nfs/dbraw/zinc/01/17/36/130011736.db2.gz IAPYLSSUJWOVJH-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C2(c3ccccc3)CC2)c1 ZINC000273345713 130109656 /nfs/dbraw/zinc/10/96/56/130109656.db2.gz ANXXGCFMUXVWRB-CYBMUJFWSA-N 1 1 311.381 3.519 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)c(O)c1C ZINC000273394849 130115419 /nfs/dbraw/zinc/11/54/19/130115419.db2.gz LPKHTLRCARCQJI-OAHLLOKOSA-N 1 1 302.462 3.534 20 10 DHCDMO CC[C@@H]([NH2+]CCc1ccc(Cl)nc1)c1ccc(F)cc1O ZINC000286272750 131226987 /nfs/dbraw/zinc/22/69/87/131226987.db2.gz VKMSVWRSZFMQEU-CQSZACIVSA-N 1 1 308.784 3.863 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nccn1-c1ccccc1 ZINC000287210696 131269224 /nfs/dbraw/zinc/26/92/24/131269224.db2.gz MKCFYTVUGXWWBY-OAHLLOKOSA-N 1 1 319.408 3.658 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c2nccn21 ZINC000297908979 132040176 /nfs/dbraw/zinc/04/01/76/132040176.db2.gz WMPFUBOBCBXADM-QFBILLFUSA-N 1 1 324.472 3.915 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)c1 ZINC000295046582 335130205 /nfs/dbraw/zinc/13/02/05/335130205.db2.gz NCOBYPCJFKMHLQ-MRXNPFEDSA-N 1 1 305.805 3.519 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000184673379 333363837 /nfs/dbraw/zinc/36/38/37/333363837.db2.gz VZKFYUINZBYEBR-JTQLQIEISA-N 1 1 323.742 3.829 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000278402162 334095829 /nfs/dbraw/zinc/09/58/29/334095829.db2.gz OITFTJNGZFLTBG-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(F)cc1O ZINC000375242783 337006467 /nfs/dbraw/zinc/00/64/67/337006467.db2.gz QOIQESFTKJUYEH-OTYXRUKQSA-N 1 1 307.752 3.969 20 10 DHCDMO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)cc2)n1 ZINC000375354553 337009010 /nfs/dbraw/zinc/00/90/10/337009010.db2.gz SZMMDQBOKIHVNN-GOSISDBHSA-N 1 1 310.445 3.737 20 10 DHCDMO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2ccc(N3CCCCC3)cc2)n1 ZINC000375354553 337009011 /nfs/dbraw/zinc/00/90/11/337009011.db2.gz SZMMDQBOKIHVNN-GOSISDBHSA-N 1 1 310.445 3.737 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[C@H](CO)c2ccccc21)c1ccc(F)cc1O ZINC000375897964 337022622 /nfs/dbraw/zinc/02/26/22/337022622.db2.gz NAEXNXCYDWZKKW-OCBCSQNSSA-N 1 1 315.388 3.793 20 10 DHCDMO Oc1ccc(Cl)c(F)c1CN1CCC[C@@H]1c1nccs1 ZINC000377014678 337045379 /nfs/dbraw/zinc/04/53/79/337045379.db2.gz NUJSGWDIJPTZNR-LLVKDONJSA-N 1 1 312.797 3.978 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000377631060 337056792 /nfs/dbraw/zinc/05/67/92/337056792.db2.gz SLSNMOQQJSVHPC-DZGCQCFKSA-N 1 1 317.351 3.623 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@@H+](C)[C@@H]2CCCc3cccnc32)c1 ZINC000377690673 337058432 /nfs/dbraw/zinc/05/84/32/337058432.db2.gz DMOVQCHGKMYQQO-CXAGYDPISA-N 1 1 312.413 3.866 20 10 DHCDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c(OC)c1 ZINC000320573585 337598395 /nfs/dbraw/zinc/59/83/95/337598395.db2.gz QWWVTEJUKKQDBS-RYUDHWBXSA-N 1 1 319.376 3.960 20 10 DHCDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(OC)ccc2O)s1 ZINC000180406826 522229330 /nfs/dbraw/zinc/22/93/30/522229330.db2.gz RBNAJKAXNKSWFJ-LBPRGKRZSA-N 1 1 320.458 3.921 20 10 DHCDMO Cc1cccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1O ZINC000180545819 524410512 /nfs/dbraw/zinc/41/05/12/524410512.db2.gz XFHAZDSCKUFOEO-BBRMVZONSA-N 1 1 303.427 3.724 20 10 DHCDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)cc1O ZINC000368482635 525638132 /nfs/dbraw/zinc/63/81/32/525638132.db2.gz NVBWUJYGJREPPQ-XQJJYNOISA-N 1 1 305.324 3.843 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc(C)c1O)CCC2 ZINC000180231680 527106377 /nfs/dbraw/zinc/10/63/77/527106377.db2.gz VUBDZXVKPVYMHS-HNNXBMFYSA-N 1 1 302.443 3.975 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@H](C)[C@@H](F)C3)c2c1 ZINC000777965693 1032058650 /nfs/dbraw/zinc/05/86/50/1032058650.db2.gz FGCASYDLSNBMMI-SJCJKPOMSA-N 1 1 303.377 3.734 20 10 DHCDMO COc1ccc(CNc2ccc(C3CCC3)c[nH+]2)c(O)c1OC ZINC000894642902 1013440471 /nfs/dbraw/zinc/44/04/71/1013440471.db2.gz UCZCQADFNHSFPH-UHFFFAOYSA-N 1 1 314.385 3.684 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(-n3cccn3)cc2)cc1 ZINC000052661889 1014127495 /nfs/dbraw/zinc/12/74/95/1014127495.db2.gz ASDCYKLTYVWTPN-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO COc1ccc(N2CC[NH+](Cc3cc(C)c(C)o3)CC2)c(C)c1 ZINC001204539453 1014132933 /nfs/dbraw/zinc/13/29/33/1014132933.db2.gz PSTLSHZVOYIOHK-UHFFFAOYSA-N 1 1 314.429 3.536 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2ccccc2)C(C)C)c(O)c1OC ZINC000891393823 1014837732 /nfs/dbraw/zinc/83/77/32/1014837732.db2.gz RTQSBEFFBRBZEV-UHFFFAOYSA-N 1 1 315.413 3.820 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)nc1 ZINC000126961009 1014957327 /nfs/dbraw/zinc/95/73/27/1014957327.db2.gz ZCXVTPQSEXAAND-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC2(CCCC2)C1 ZINC000707129158 1015081960 /nfs/dbraw/zinc/08/19/60/1015081960.db2.gz DORJHBAOGPEWRG-UHFFFAOYSA-N 1 1 310.235 3.921 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CC[C@H](c3nccs3)C2)cc1 ZINC000895580516 1015216337 /nfs/dbraw/zinc/21/63/37/1015216337.db2.gz BLOKHZOLUPQEBV-CWDCEQMOSA-N 1 1 313.470 3.712 20 10 DHCDMO CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000040621775 1015331224 /nfs/dbraw/zinc/33/12/24/1015331224.db2.gz MHPKKMNJJDSAAH-LLVKDONJSA-N 1 1 317.260 3.519 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895846533 1015331827 /nfs/dbraw/zinc/33/18/27/1015331827.db2.gz PWGMHKZRQGFHDH-AZUAARDMSA-N 1 1 314.473 3.678 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c(O)c1OC ZINC000891504724 1015334080 /nfs/dbraw/zinc/33/40/80/1015334080.db2.gz YNJJKZKUFZTWJM-ZDUSSCGKSA-N 1 1 301.386 3.602 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c(O)c1OC ZINC000891536383 1015362393 /nfs/dbraw/zinc/36/23/93/1015362393.db2.gz IKYUYTLLLRWEBR-LBPRGKRZSA-N 1 1 319.376 3.742 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2cccs2)C(C)C)c(O)c1OC ZINC000891626904 1015464729 /nfs/dbraw/zinc/46/47/29/1015464729.db2.gz RQBPJSFBLVDQFI-UHFFFAOYSA-N 1 1 321.442 3.882 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC000896515609 1015616964 /nfs/dbraw/zinc/61/69/64/1015616964.db2.gz GXHNISFFKLYSAJ-AWEZNQCLSA-N 1 1 314.454 3.717 20 10 DHCDMO CCOc1cccc(C[N@H+](Cc2ccccn2)CC(C)C)c1O ZINC000896664036 1015701588 /nfs/dbraw/zinc/70/15/88/1015701588.db2.gz GPELWVXKRHLHHS-UHFFFAOYSA-N 1 1 314.429 3.844 20 10 DHCDMO COc1ccc(C[N@@H+](C)C[C@H](C)c2ccccc2)c(O)c1OC ZINC000891916752 1015755407 /nfs/dbraw/zinc/75/54/07/1015755407.db2.gz OLNMNULLHSUMME-AWEZNQCLSA-N 1 1 315.413 3.645 20 10 DHCDMO CCC[C@@H]1C[N@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CCO1 ZINC001204777633 1015760016 /nfs/dbraw/zinc/76/00/16/1015760016.db2.gz WUPVPKRZDPJINN-OAHLLOKOSA-N 1 1 321.461 3.699 20 10 DHCDMO CCC[C@@H]1C[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CCO1 ZINC001204777633 1015760020 /nfs/dbraw/zinc/76/00/20/1015760020.db2.gz WUPVPKRZDPJINN-OAHLLOKOSA-N 1 1 321.461 3.699 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC=C(c3ccccn3)C2)cc1 ZINC000846924401 1032139289 /nfs/dbraw/zinc/13/92/89/1032139289.db2.gz WTUGBZSIXMURSG-UHFFFAOYSA-N 1 1 307.441 3.827 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(N(C)C)c(C)c2)CCO1 ZINC001167549218 1016384640 /nfs/dbraw/zinc/38/46/40/1016384640.db2.gz LCDYCRQJODBMIB-NRFANRHFSA-N 1 1 324.468 3.943 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc(F)cc1O ZINC000185032522 1016503963 /nfs/dbraw/zinc/50/39/63/1016503963.db2.gz YBVSTSBMSFWDEX-CYBMUJFWSA-N 1 1 311.360 3.568 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(F)cc1O ZINC000185165287 1016690737 /nfs/dbraw/zinc/69/07/37/1016690737.db2.gz XTGSGFBREIRZRX-ZDUSSCGKSA-N 1 1 311.360 3.568 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccc(F)cc1O ZINC000185576200 1017019913 /nfs/dbraw/zinc/01/99/13/1017019913.db2.gz QYMMLBZGARQAMM-NWDGAFQWSA-N 1 1 307.340 3.789 20 10 DHCDMO Cc1ncc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)o1 ZINC000840794567 1017037855 /nfs/dbraw/zinc/03/78/55/1017037855.db2.gz LOCWFEDXVJMUOC-QMMMGPOBSA-N 1 1 300.280 3.558 20 10 DHCDMO CC1(C)C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCS1 ZINC001308957608 1032199820 /nfs/dbraw/zinc/19/98/20/1032199820.db2.gz VTWNFOGYPDIFHA-SNVBAGLBSA-N 1 1 303.830 3.949 20 10 DHCDMO C[C@H]([NH2+]CCOc1ccc(F)cc1F)c1ccc(F)cc1O ZINC000185646958 1017079677 /nfs/dbraw/zinc/07/96/77/1017079677.db2.gz ZZTXNVQEUCVISA-JTQLQIEISA-N 1 1 311.303 3.539 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccc(C)cc1O ZINC000295098208 1032275167 /nfs/dbraw/zinc/27/51/67/1032275167.db2.gz VQLWBOZTMKWHGK-QGZVFWFLSA-N 1 1 322.412 3.522 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1 ZINC000295119613 1032280899 /nfs/dbraw/zinc/28/08/99/1032280899.db2.gz XELXIXLXSWVJBM-ZYHUDNBSSA-N 1 1 303.324 3.564 20 10 DHCDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2O)c(-c2cnn(C)c2)c1 ZINC000282708759 1032458483 /nfs/dbraw/zinc/45/84/83/1032458483.db2.gz AWVPQGGZRMFWGL-UHFFFAOYSA-N 1 1 321.424 3.733 20 10 DHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000773254724 1032660098 /nfs/dbraw/zinc/66/00/98/1032660098.db2.gz GCROJQKRTDQHCO-CQSZACIVSA-N 1 1 311.491 3.969 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000773264111 1032663313 /nfs/dbraw/zinc/66/33/13/1032663313.db2.gz QPXKMCLAXPCERU-DLBZAZTESA-N 1 1 303.446 3.648 20 10 DHCDMO CCn1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000840836762 1017132049 /nfs/dbraw/zinc/13/20/49/1017132049.db2.gz FGWTVRTUNIYKIA-INIZCTEOSA-N 1 1 312.461 3.744 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CCOCC2(CC2)C1 ZINC000783599516 1017483973 /nfs/dbraw/zinc/48/39/73/1017483973.db2.gz QVHSTGQWBPHBTL-UHFFFAOYSA-N 1 1 309.409 3.672 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccc(F)cc1O ZINC000926918957 1032766727 /nfs/dbraw/zinc/76/67/27/1032766727.db2.gz KMVSBAZAVPBOJS-NWDGAFQWSA-N 1 1 301.361 3.706 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2F)cc1 ZINC001137837916 1018664615 /nfs/dbraw/zinc/66/46/15/1018664615.db2.gz YYIWONJYLWZTSJ-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(O)cccc2F)cc1 ZINC001137837916 1018664620 /nfs/dbraw/zinc/66/46/20/1018664620.db2.gz YYIWONJYLWZTSJ-KRWDZBQOSA-N 1 1 301.361 3.877 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1O ZINC000278453368 1018708606 /nfs/dbraw/zinc/70/86/06/1018708606.db2.gz YHCRREFBVUCXTG-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO Cc1csc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000921749957 1018753743 /nfs/dbraw/zinc/75/37/43/1018753743.db2.gz JCQMHFGBUGEQLK-UHFFFAOYSA-N 1 1 302.443 3.801 20 10 DHCDMO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451083 1018791228 /nfs/dbraw/zinc/79/12/28/1018791228.db2.gz SMRUGJXDKBDXGG-HOTGVXAUSA-N 1 1 321.484 3.807 20 10 DHCDMO C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451083 1018791238 /nfs/dbraw/zinc/79/12/38/1018791238.db2.gz SMRUGJXDKBDXGG-HOTGVXAUSA-N 1 1 321.484 3.807 20 10 DHCDMO C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451084 1018791684 /nfs/dbraw/zinc/79/16/84/1018791684.db2.gz SMRUGJXDKBDXGG-HZPDHXFCSA-N 1 1 321.484 3.807 20 10 DHCDMO C[C@H](CCN(C)C)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451084 1018791692 /nfs/dbraw/zinc/79/16/92/1018791692.db2.gz SMRUGJXDKBDXGG-HZPDHXFCSA-N 1 1 321.484 3.807 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](C)NC(=O)OC(C)(C)C ZINC000785457832 1018996343 /nfs/dbraw/zinc/99/63/43/1018996343.db2.gz IQFBPTZUBZKSMG-AWEZNQCLSA-N 1 1 322.449 3.517 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CC3(C[C@H]2C)CCOCC3)c1O ZINC000843431849 1019040147 /nfs/dbraw/zinc/04/01/47/1019040147.db2.gz KKRWMGZNHRBCRV-CYBMUJFWSA-N 1 1 309.837 3.745 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1CCO)c1cc(Cl)c(Cl)cc1O ZINC000278728120 1019099541 /nfs/dbraw/zinc/09/95/41/1019099541.db2.gz MMKCVQRVSCUGSF-PKFCDNJMSA-N 1 1 318.244 3.901 20 10 DHCDMO CC[C@@H]1CCCC[N@@H+]1CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765962607 1019194593 /nfs/dbraw/zinc/19/45/93/1019194593.db2.gz ULXFBRCWCUDSEG-FUHWJXTLSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765962607 1019194599 /nfs/dbraw/zinc/19/45/99/1019194599.db2.gz ULXFBRCWCUDSEG-FUHWJXTLSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H]1CCCN(c2ccc(C[NH2+]Cc3cc[nH]n3)cc2Cl)C1 ZINC000282165895 1019538618 /nfs/dbraw/zinc/53/86/18/1019538618.db2.gz YCTBLPYSJTUFQE-CYBMUJFWSA-N 1 1 318.852 3.589 20 10 DHCDMO CCCC[N@@H+](Cc1cn(C)nc1C(F)F)Cc1ccccc1O ZINC000282332627 1019566605 /nfs/dbraw/zinc/56/66/05/1019566605.db2.gz BEGQJTQMGRSUAH-UHFFFAOYSA-N 1 1 323.387 3.866 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)[C@@H]2C=CCCCCC2)cc1 ZINC001171730177 1032847948 /nfs/dbraw/zinc/84/79/48/1032847948.db2.gz RTEFKHQZHMZVBA-QGZVFWFLSA-N 1 1 302.462 3.952 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000922584357 1020139160 /nfs/dbraw/zinc/13/91/60/1020139160.db2.gz IQFMHNLJMQBASW-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO CC(C)c1ccccc1NC(=O)C[N@H+](C)Cc1ccccc1O ZINC000731843801 1020156508 /nfs/dbraw/zinc/15/65/08/1020156508.db2.gz WYQRGJZOWAXDDZ-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO CC(C)c1ccccc1NC(=O)C[N@@H+](C)Cc1ccccc1O ZINC000731843801 1020156515 /nfs/dbraw/zinc/15/65/15/1020156515.db2.gz WYQRGJZOWAXDDZ-UHFFFAOYSA-N 1 1 312.413 3.586 20 10 DHCDMO CC[N@H+](Cc1c(O)c(C(=O)OC)cc2ccccc21)CC1CC1 ZINC000732665590 1020267577 /nfs/dbraw/zinc/26/75/77/1020267577.db2.gz JWLFUAKYHONWQR-UHFFFAOYSA-N 1 1 313.397 3.564 20 10 DHCDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000732980284 1020308739 /nfs/dbraw/zinc/30/87/39/1020308739.db2.gz WPUUCEUXIGOKSS-IBGZPJMESA-N 1 1 313.397 3.950 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c1O ZINC000186863341 1020511488 /nfs/dbraw/zinc/51/14/88/1020511488.db2.gz GAZKCBJRRKZNSL-OAHLLOKOSA-N 1 1 318.442 3.811 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490604 1032917219 /nfs/dbraw/zinc/91/72/19/1032917219.db2.gz KKZOLLXJKGXPPS-HZPDHXFCSA-N 1 1 316.489 3.654 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490324 1032915790 /nfs/dbraw/zinc/91/57/90/1032915790.db2.gz GFWNYCYCWRQUJS-CVEARBPZSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1[O-] ZINC000858490324 1032915807 /nfs/dbraw/zinc/91/58/07/1032915807.db2.gz GFWNYCYCWRQUJS-CVEARBPZSA-N 1 1 312.457 3.928 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H](n3ccnc3)C2)cc1C(C)C ZINC000738159020 1020863103 /nfs/dbraw/zinc/86/31/03/1020863103.db2.gz QBZWNJGEANMGLY-QGZVFWFLSA-N 1 1 313.445 3.858 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc3oc4ccccc4c3cc2O)CCCO1 ZINC000738158574 1020863233 /nfs/dbraw/zinc/86/32/33/1020863233.db2.gz MPCZPLROZQCBKU-ZDUSSCGKSA-N 1 1 311.381 3.902 20 10 DHCDMO C[N@H+](Cc1ccon1)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000739878410 1020919164 /nfs/dbraw/zinc/91/91/64/1020919164.db2.gz DPIWGWOXDSKNGY-UHFFFAOYSA-N 1 1 312.369 3.637 20 10 DHCDMO C[N@@H+](Cc1ccon1)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000739878410 1020919167 /nfs/dbraw/zinc/91/91/67/1020919167.db2.gz DPIWGWOXDSKNGY-UHFFFAOYSA-N 1 1 312.369 3.637 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2nccn2C)c(C)n1-c1ccccc1 ZINC000858544020 1032941203 /nfs/dbraw/zinc/94/12/03/1032941203.db2.gz XTWXCUPACBJODB-OAHLLOKOSA-N 1 1 308.429 3.678 20 10 DHCDMO Cc1cccc(F)c1C[NH2+]Cc1cccc(Br)c1O ZINC000742380739 1021108318 /nfs/dbraw/zinc/10/83/18/1021108318.db2.gz RXQARUFKZKCYQO-UHFFFAOYSA-N 1 1 324.193 3.892 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@@]1(C)O ZINC001236793730 1021276740 /nfs/dbraw/zinc/27/67/40/1021276740.db2.gz OIMCQURBQYMEJZ-MEBBXXQBSA-N 1 1 318.244 3.682 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@@]1(C)O ZINC001236793730 1021276744 /nfs/dbraw/zinc/27/67/44/1021276744.db2.gz OIMCQURBQYMEJZ-MEBBXXQBSA-N 1 1 318.244 3.682 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@@]1(C)O ZINC001236793731 1021277862 /nfs/dbraw/zinc/27/78/62/1021277862.db2.gz OIMCQURBQYMEJZ-ZUZCIYMTSA-N 1 1 318.244 3.682 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC[C@@]1(C)O ZINC001236793731 1021277868 /nfs/dbraw/zinc/27/78/68/1021277868.db2.gz OIMCQURBQYMEJZ-ZUZCIYMTSA-N 1 1 318.244 3.682 20 10 DHCDMO CCCC[N@@H+](CC(=O)N(C(C)C)C(C)C)Cc1ccccc1O ZINC000801599653 1021286834 /nfs/dbraw/zinc/28/68/34/1021286834.db2.gz XTQZJKHVLJAVBH-UHFFFAOYSA-N 1 1 320.477 3.640 20 10 DHCDMO Cc1cc(C[N@@H+](C)C[C@@H]2CCCOC2)c(O)c(C(C)(C)C)c1 ZINC000107671052 1021338302 /nfs/dbraw/zinc/33/83/02/1021338302.db2.gz LEJADCUUQAJQST-HNNXBMFYSA-N 1 1 305.462 3.857 20 10 DHCDMO CCOc1cccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)c1O ZINC000069953128 1021442339 /nfs/dbraw/zinc/44/23/39/1021442339.db2.gz RVXDXDRLWUYABB-UHFFFAOYSA-N 1 1 320.477 3.535 20 10 DHCDMO CCOc1cccc(CNCCC[N@H+](C)C2CCCCC2)c1O ZINC000069953128 1021442349 /nfs/dbraw/zinc/44/23/49/1021442349.db2.gz RVXDXDRLWUYABB-UHFFFAOYSA-N 1 1 320.477 3.535 20 10 DHCDMO CCOc1cccc(CNCCC[N@@H+](C)C2CCCCC2)c1O ZINC000069953128 1021442357 /nfs/dbraw/zinc/44/23/57/1021442357.db2.gz RVXDXDRLWUYABB-UHFFFAOYSA-N 1 1 320.477 3.535 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCC(C)(C)F)c1 ZINC000850374844 1021496389 /nfs/dbraw/zinc/49/63/89/1021496389.db2.gz SJBJXJADEKODFE-UHFFFAOYSA-N 1 1 304.203 3.691 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@]2(C)CC2(F)F)c1 ZINC000850379713 1021499032 /nfs/dbraw/zinc/49/90/32/1021499032.db2.gz WDTBBCXJIGHQRM-LBPRGKRZSA-N 1 1 320.177 3.598 20 10 DHCDMO Cc1cc(O)c(CN[C@H]2CC[N@@H+](C3CCCCC3)C2)cc1C ZINC000850382037 1021501472 /nfs/dbraw/zinc/50/14/72/1021501472.db2.gz NGMNHUKZJIJPKF-KRWDZBQOSA-N 1 1 302.462 3.506 20 10 DHCDMO Cc1cc(O)c(CN[C@H]2CC[N@H+](C3CCCCC3)C2)cc1C ZINC000850382037 1021501479 /nfs/dbraw/zinc/50/14/79/1021501479.db2.gz NGMNHUKZJIJPKF-KRWDZBQOSA-N 1 1 302.462 3.506 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)nc1 ZINC000154722206 1021514961 /nfs/dbraw/zinc/51/49/61/1021514961.db2.gz GYPGDFVLBNWKBS-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)nc1 ZINC000154722206 1021514972 /nfs/dbraw/zinc/51/49/72/1021514972.db2.gz GYPGDFVLBNWKBS-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO COc1cccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)c1C ZINC000850416714 1021521747 /nfs/dbraw/zinc/52/17/47/1021521747.db2.gz PBFZYQJEGLYMPY-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)c(F)cc1O ZINC000850510702 1021569067 /nfs/dbraw/zinc/56/90/67/1021569067.db2.gz WPAVVXGFFSRSIF-RKDXNWHRSA-N 1 1 300.171 3.663 20 10 DHCDMO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850513369 1021571546 /nfs/dbraw/zinc/57/15/46/1021571546.db2.gz GVVQQUAUZRGYIN-DCAQKATOSA-N 1 1 303.324 3.629 20 10 DHCDMO CCCN1CC[C@H]([NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850557155 1021604203 /nfs/dbraw/zinc/60/42/03/1021604203.db2.gz UURPKTDMPDLDLL-NEPJUHHUSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cccc(C(F)(F)F)c1O ZINC000850571293 1021615105 /nfs/dbraw/zinc/61/51/05/1021615105.db2.gz PCQWQTZGVXQWSV-MNOVXSKESA-N 1 1 317.351 3.877 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H](C)O)c1ccc(F)cc1O ZINC000850583636 1021622792 /nfs/dbraw/zinc/62/27/92/1021622792.db2.gz MYJGPDFDHBFDNL-IWEFOYFVSA-N 1 1 303.377 3.694 20 10 DHCDMO C[N@@H+](Cc1ccc(CO)cc1)Cc1ccc(N2CCCCC2)cc1 ZINC000182617140 1021740659 /nfs/dbraw/zinc/74/06/59/1021740659.db2.gz LQGGEVADZODQER-UHFFFAOYSA-N 1 1 324.468 3.801 20 10 DHCDMO C[N@@H+](CCC(=O)Nc1cccc(Cl)c1)Cc1ccccc1O ZINC000109769272 1021748155 /nfs/dbraw/zinc/74/81/55/1021748155.db2.gz MCPPGUZQKFRIHX-UHFFFAOYSA-N 1 1 318.804 3.506 20 10 DHCDMO Cc1cc[nH+]c(N[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)c1 ZINC000182640633 1021756050 /nfs/dbraw/zinc/75/60/50/1021756050.db2.gz SXFFMHMTCDQYRX-AWEZNQCLSA-N 1 1 315.392 3.539 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc3cnccc32)cc1 ZINC000182919389 1021886559 /nfs/dbraw/zinc/88/65/59/1021886559.db2.gz ZEZSSEOZZYZWCG-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2cccs2)c1 ZINC000756378936 1022168469 /nfs/dbraw/zinc/16/84/69/1022168469.db2.gz KMVIHPGVXVIBFZ-RYUDHWBXSA-N 1 1 319.426 3.522 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H](C)N(C)Cc1ccccc1)c1ccccc1O ZINC000183541057 1022180891 /nfs/dbraw/zinc/18/08/91/1022180891.db2.gz QMDWPXZUOFGKRC-DLBZAZTESA-N 1 1 312.457 3.953 20 10 DHCDMO CC[C@@H]1C[C@@H](C[N@@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC000780754323 1022240258 /nfs/dbraw/zinc/24/02/58/1022240258.db2.gz MUCHSJNWVBJDKO-PKOBYXMFSA-N 1 1 304.478 3.780 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240649 1022241940 /nfs/dbraw/zinc/24/19/40/1022241940.db2.gz QDXZMNFFNPOUGO-UKRRQHHQSA-N 1 1 322.880 3.818 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000853240649 1022241952 /nfs/dbraw/zinc/24/19/52/1022241952.db2.gz QDXZMNFFNPOUGO-UKRRQHHQSA-N 1 1 322.880 3.818 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1cn2ccccc2n1)C1CCCC1 ZINC000111245068 1022262944 /nfs/dbraw/zinc/26/29/44/1022262944.db2.gz DUUVRRGNJPFCMN-UHFFFAOYSA-N 1 1 321.424 3.985 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCC3(CCOCC3)[C@H]2C)c(O)c1 ZINC000363866344 1022354782 /nfs/dbraw/zinc/35/47/82/1022354782.db2.gz IAAXTJWHRARZDF-OAHLLOKOSA-N 1 1 319.445 3.572 20 10 DHCDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185143602 1022462262 /nfs/dbraw/zinc/46/22/62/1022462262.db2.gz PBNWOWYBPFIIIK-ZDUSSCGKSA-N 1 1 318.392 3.956 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](CCn1cccn1)Cc1ccccc1O ZINC000179645082 1022495054 /nfs/dbraw/zinc/49/50/54/1022495054.db2.gz NRVTVKOAIDETPT-KRWDZBQOSA-N 1 1 321.424 3.852 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@@H](C)c1cccc(OC)c1 ZINC000179723298 1022519234 /nfs/dbraw/zinc/51/92/34/1022519234.db2.gz FJMWTSVILAHXJZ-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000179884748 1022572640 /nfs/dbraw/zinc/57/26/40/1022572640.db2.gz WNEFDOVKAXGTSA-ZWKOTPCHSA-N 1 1 316.489 3.787 20 10 DHCDMO Cc1cccc(CN2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884748 1022572644 /nfs/dbraw/zinc/57/26/44/1022572644.db2.gz WNEFDOVKAXGTSA-ZWKOTPCHSA-N 1 1 316.489 3.787 20 10 DHCDMO Cc1cccc(CN2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884748 1022572652 /nfs/dbraw/zinc/57/26/52/1022572652.db2.gz WNEFDOVKAXGTSA-ZWKOTPCHSA-N 1 1 316.489 3.787 20 10 DHCDMO Oc1cccc(C[N@H+](Cc2cc(F)ccc2O)CC2CC2)c1 ZINC000180013089 1022613989 /nfs/dbraw/zinc/61/39/89/1022613989.db2.gz VYDXBCSLPCXKOV-UHFFFAOYSA-N 1 1 301.361 3.649 20 10 DHCDMO Oc1ccc2c(c1)CC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C2 ZINC000767726415 1022789650 /nfs/dbraw/zinc/78/96/50/1022789650.db2.gz ATCPTGLJLQHTLT-GFCCVEGCSA-N 1 1 321.779 3.537 20 10 DHCDMO CC[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC000768131932 1022897861 /nfs/dbraw/zinc/89/78/61/1022897861.db2.gz BRKKOLHOZPXXOA-UHFFFAOYSA-N 1 1 314.477 3.795 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000768137079 1022905645 /nfs/dbraw/zinc/90/56/45/1022905645.db2.gz FZGNKIKGWKMAAL-KRWDZBQOSA-N 1 1 312.413 3.913 20 10 DHCDMO C[N@H+](Cc1cccs1)Cc1cccc(Br)c1O ZINC000768160757 1022906678 /nfs/dbraw/zinc/90/66/78/1022906678.db2.gz OIMDSMCGOKKWLN-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[N@@H+](Cc1cccs1)Cc1cccc(Br)c1O ZINC000768160757 1022906685 /nfs/dbraw/zinc/90/66/85/1022906685.db2.gz OIMDSMCGOKKWLN-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000768160449 1022907540 /nfs/dbraw/zinc/90/75/40/1022907540.db2.gz NXJZGXRTCXKETH-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1OC ZINC000768169165 1022909647 /nfs/dbraw/zinc/90/96/47/1022909647.db2.gz QMNWTOVTIOZCMP-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO Cn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c(Cl)n1 ZINC000857020563 1022922834 /nfs/dbraw/zinc/92/28/34/1022922834.db2.gz AOJWNTGLCPZGJA-UHFFFAOYSA-N 1 1 319.836 3.724 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)CCOc1cccc(Cl)c1 ZINC000768212599 1022924341 /nfs/dbraw/zinc/92/43/41/1022924341.db2.gz MNTZCFQPOGNUBW-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000768231216 1022930069 /nfs/dbraw/zinc/93/00/69/1022930069.db2.gz SHNSQRQCKSLTMF-UHFFFAOYSA-N 1 1 305.425 3.792 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000768231216 1022930079 /nfs/dbraw/zinc/93/00/79/1022930079.db2.gz SHNSQRQCKSLTMF-UHFFFAOYSA-N 1 1 305.425 3.792 20 10 DHCDMO CCCC[N@@H+](Cc1cn(C)nc1Cl)Cc1ccccc1O ZINC000857043939 1022930659 /nfs/dbraw/zinc/93/06/59/1022930659.db2.gz FDUFBEKQFHMALK-UHFFFAOYSA-N 1 1 307.825 3.581 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2OCC)c(O)c1 ZINC000768251986 1022933764 /nfs/dbraw/zinc/93/37/64/1022933764.db2.gz CSLOXPSNWALUQA-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000768261230 1022936216 /nfs/dbraw/zinc/93/62/16/1022936216.db2.gz AHTNLKADCVTLOK-NVXWUHKLSA-N 1 1 320.452 3.673 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000768245410 1022938671 /nfs/dbraw/zinc/93/86/71/1022938671.db2.gz RVCJYWNIKKOFRE-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC000768245410 1022938676 /nfs/dbraw/zinc/93/86/76/1022938676.db2.gz RVCJYWNIKKOFRE-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000768245410 1022938687 /nfs/dbraw/zinc/93/86/87/1022938687.db2.gz RVCJYWNIKKOFRE-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO CCC[N@H+](Cc1cc2c(cc1O)OC[C@@H]2O)CC1CCCCC1 ZINC000768442160 1022967159 /nfs/dbraw/zinc/96/71/59/1022967159.db2.gz JRYFEFUMWFKOJZ-SFHVURJKSA-N 1 1 319.445 3.610 20 10 DHCDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876580057 1033096767 /nfs/dbraw/zinc/09/67/67/1033096767.db2.gz QDKBIRLKBCGYJD-LJQANCHMSA-N 1 1 316.489 3.658 20 10 DHCDMO COc1cc(O)c(C[N@@H+]2CC=C(C(C)(C)C)CC2)cc1OC ZINC000768464609 1022972790 /nfs/dbraw/zinc/97/27/90/1022972790.db2.gz CZPSPKXQHHQULV-UHFFFAOYSA-N 1 1 305.418 3.588 20 10 DHCDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768462958 1022974394 /nfs/dbraw/zinc/97/43/94/1022974394.db2.gz PGKWZPVSURMDFA-ZFWWWQNUSA-N 1 1 307.434 3.810 20 10 DHCDMO CC[N@@H+](Cc1c(O)cccc1OC)[C@H](C)c1cccc(OC)c1 ZINC000768519816 1022979225 /nfs/dbraw/zinc/97/92/25/1022979225.db2.gz IGWRVEGQJDMXJX-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@H]([N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)C(C)(C)C ZINC000768541780 1022986684 /nfs/dbraw/zinc/98/66/84/1022986684.db2.gz AEPMPDDUZFYSMI-AWEZNQCLSA-N 1 1 308.441 3.529 20 10 DHCDMO OC1CCN(c2ccc(C[N@@H+](C3CC3)C3CCCC3)cc2)CC1 ZINC000876571327 1033096232 /nfs/dbraw/zinc/09/62/32/1033096232.db2.gz JDQAPYVBWHRSDW-UHFFFAOYSA-N 1 1 314.473 3.555 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 ZINC000768912646 1023055037 /nfs/dbraw/zinc/05/50/37/1023055037.db2.gz ATNOTDBFHWAYCJ-JKIFEVAISA-N 1 1 322.880 3.883 20 10 DHCDMO CC[N@@H+](Cc1cc2c(cc1O)OCO2)[C@@H](C)c1ccc(F)cc1 ZINC000768911387 1023056101 /nfs/dbraw/zinc/05/61/01/1023056101.db2.gz NJDRGOSAJPQDLS-LBPRGKRZSA-N 1 1 317.360 3.843 20 10 DHCDMO CCC[N@@H+](Cc1cnc2cccc(C)n12)Cc1ccccc1O ZINC000769201042 1023101122 /nfs/dbraw/zinc/10/11/22/1023101122.db2.gz OZEMDSNLIGNBEH-UHFFFAOYSA-N 1 1 309.413 3.761 20 10 DHCDMO CCC[N@@H+](Cc1cccc(-n2cccn2)c1)Cc1ccccc1O ZINC000769200604 1023101479 /nfs/dbraw/zinc/10/14/79/1023101479.db2.gz BWAGFGGVRAJGOZ-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)cc1 ZINC000769311586 1023118840 /nfs/dbraw/zinc/11/88/40/1023118840.db2.gz NDLBELOPYIFSHN-LJQANCHMSA-N 1 1 312.461 3.566 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000184811914 1023129520 /nfs/dbraw/zinc/12/95/20/1023129520.db2.gz ICWANQILHSGFNJ-FQEVSTJZSA-N 1 1 309.409 3.640 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@@]3(C1)OCc1ccccc13)CCC2 ZINC000184811762 1023129774 /nfs/dbraw/zinc/12/97/74/1023129774.db2.gz NPLKGSBMIXMIET-NRFANRHFSA-N 1 1 321.420 3.512 20 10 DHCDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C ZINC001172372717 1033107159 /nfs/dbraw/zinc/10/71/59/1033107159.db2.gz GTKIGNGSMKRMKK-UWVAXJGDSA-N 1 1 316.489 3.780 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC000769387587 1023138105 /nfs/dbraw/zinc/13/81/05/1023138105.db2.gz MLRHJOFAHSJERJ-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000769390589 1023139171 /nfs/dbraw/zinc/13/91/71/1023139171.db2.gz ZJMXCKNXDRHEHH-GFCCVEGCSA-N 1 1 305.805 3.814 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000769390350 1023139515 /nfs/dbraw/zinc/13/95/15/1023139515.db2.gz VJKVITPRKZHWIW-CQSZACIVSA-N 1 1 315.413 3.560 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCCC[C@@H](SCC)C2)c1O ZINC000769404082 1023140799 /nfs/dbraw/zinc/14/07/99/1023140799.db2.gz NGOYOJNWUNQSES-OAHLLOKOSA-N 1 1 309.475 3.899 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCCC[C@H](SCC)C2)c1O ZINC000769404078 1023140930 /nfs/dbraw/zinc/14/09/30/1023140930.db2.gz NGOYOJNWUNQSES-HNNXBMFYSA-N 1 1 309.475 3.899 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000769426999 1023147150 /nfs/dbraw/zinc/14/71/50/1023147150.db2.gz XJPSIVGZKQFYQO-HNNXBMFYSA-N 1 1 315.388 3.605 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(O)c1 ZINC000769396519 1023149747 /nfs/dbraw/zinc/14/97/47/1023149747.db2.gz LYAHWVOWJFLRKO-OAHLLOKOSA-N 1 1 315.388 3.920 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@]3(CCCOC3)C2)cc1 ZINC000769485212 1023151422 /nfs/dbraw/zinc/15/14/22/1023151422.db2.gz LVPPEHIMCUQWHN-FQEVSTJZSA-N 1 1 316.489 3.925 20 10 DHCDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769447375 1023156561 /nfs/dbraw/zinc/15/65/61/1023156561.db2.gz YROFLESGEPTGCY-LJQANCHMSA-N 1 1 302.462 3.535 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000769464786 1023159277 /nfs/dbraw/zinc/15/92/77/1023159277.db2.gz ANVMVIRFNUYCII-HIFRSBDPSA-N 1 1 315.388 3.918 20 10 DHCDMO CC(C)[N@@H+](CCO[C@H]1CCCCO1)Cc1ccc(N(C)C)cc1 ZINC000769712270 1023198438 /nfs/dbraw/zinc/19/84/38/1023198438.db2.gz ZNKJKFGMNMQVBN-IBGZPJMESA-N 1 1 320.477 3.506 20 10 DHCDMO CCC[N@@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccccc1O ZINC000876654814 1033114351 /nfs/dbraw/zinc/11/43/51/1033114351.db2.gz QAGCIMGTMPJTLP-UHFFFAOYSA-N 1 1 312.369 3.651 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(C)cc1O)CCC2 ZINC000876732532 1033127839 /nfs/dbraw/zinc/12/78/39/1033127839.db2.gz YGFFUSSSPVFHCS-OAHLLOKOSA-N 1 1 302.443 3.975 20 10 DHCDMO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000756707702 1023550785 /nfs/dbraw/zinc/55/07/85/1023550785.db2.gz NHDRRVXZYAKSTI-STQMWFEESA-N 1 1 303.377 3.822 20 10 DHCDMO Cc1nccn1CCC[N@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000746628550 1023753707 /nfs/dbraw/zinc/75/37/07/1023753707.db2.gz WWYGLXHBKKDOHF-UHFFFAOYSA-N 1 1 315.461 3.851 20 10 DHCDMO COC(C)(C)CC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000787152546 1023763555 /nfs/dbraw/zinc/76/35/55/1023763555.db2.gz WMPZNVYIGRUMDX-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H](C)CC2CCCCC2)ccc1[N+](=O)[O-] ZINC000787301161 1023786192 /nfs/dbraw/zinc/78/61/92/1023786192.db2.gz DNCGSBATZUXXOM-GFCCVEGCSA-N 1 1 322.405 3.758 20 10 DHCDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccc1O ZINC000787405910 1023793621 /nfs/dbraw/zinc/79/36/21/1023793621.db2.gz HEMGXUYLZIPFBF-GXDHUFHOSA-N 1 1 312.369 3.836 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]C2CCN(CC(C)C)CC2)c(O)c1 ZINC000788507514 1023897141 /nfs/dbraw/zinc/89/71/41/1023897141.db2.gz PIONIZSCNZBLOD-MRXNPFEDSA-N 1 1 304.478 3.780 20 10 DHCDMO Cc1cc(C)c([C@H](C)[NH2+]C2CCN(CC(C)C)CC2)c(O)c1 ZINC000788507458 1023897807 /nfs/dbraw/zinc/89/78/07/1023897807.db2.gz PIONIZSCNZBLOD-INIZCTEOSA-N 1 1 304.478 3.780 20 10 DHCDMO CCOCCCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788549258 1023904369 /nfs/dbraw/zinc/90/43/69/1023904369.db2.gz UZUBOZCGBLJJCM-LLVKDONJSA-N 1 1 305.340 3.878 20 10 DHCDMO CCCN(CC)CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788610587 1023908025 /nfs/dbraw/zinc/90/80/25/1023908025.db2.gz LFQYFCAVWHPJRT-GFCCVEGCSA-N 1 1 318.383 3.794 20 10 DHCDMO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788589858 1023909930 /nfs/dbraw/zinc/90/99/30/1023909930.db2.gz DFHSIDUTVSIUBB-ZIBATOQPSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@@H]([NH2+]CC1(N(C)C)CCC1)c1cccc(C(F)(F)F)c1O ZINC000788758991 1023930372 /nfs/dbraw/zinc/93/03/72/1023930372.db2.gz TULNWSTYNQQFER-LLVKDONJSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]CCCOC(F)F)c1cccc(C(F)(F)F)c1O ZINC000788819654 1023941332 /nfs/dbraw/zinc/94/13/32/1023941332.db2.gz UBACDYUVODBNIA-MRVPVSSYSA-N 1 1 313.266 3.691 20 10 DHCDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000789586292 1024119899 /nfs/dbraw/zinc/11/98/99/1024119899.db2.gz JZQMQCXJIQCQAF-PMPSAXMXSA-N 1 1 320.452 3.529 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CSCc2ccccc21 ZINC000882936399 1024176279 /nfs/dbraw/zinc/17/62/79/1024176279.db2.gz STQMXCNTRTVSKW-HNNXBMFYSA-N 1 1 307.365 3.748 20 10 DHCDMO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000882986208 1024194837 /nfs/dbraw/zinc/19/48/37/1024194837.db2.gz MGXRFBMYRLRXMU-INIZCTEOSA-N 1 1 319.351 3.846 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1 ZINC000268997155 1024216581 /nfs/dbraw/zinc/21/65/81/1024216581.db2.gz KUOFHIBZNNKBIP-MRXNPFEDSA-N 1 1 315.505 3.810 20 10 DHCDMO CC(C)[C@H](O)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1 ZINC000883180040 1024270019 /nfs/dbraw/zinc/27/00/19/1024270019.db2.gz QVZHZUVROAPACA-SJORKVTESA-N 1 1 321.367 3.518 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCc3cc(Cl)ccc3C2)c1O ZINC000790441023 1024306254 /nfs/dbraw/zinc/30/62/54/1024306254.db2.gz AERAEOGUHXWOOF-UHFFFAOYSA-N 1 1 317.816 3.921 20 10 DHCDMO Cc1cc([O-])c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927630 1033201124 /nfs/dbraw/zinc/20/11/24/1033201124.db2.gz GWPHRJMJQNYORG-HNNXBMFYSA-N 1 1 322.880 3.518 20 10 DHCDMO Cc1cc([O-])c(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927630 1033201133 /nfs/dbraw/zinc/20/11/33/1033201133.db2.gz GWPHRJMJQNYORG-HNNXBMFYSA-N 1 1 322.880 3.518 20 10 DHCDMO CC(C)(C)c1cnc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000790468881 1024314570 /nfs/dbraw/zinc/31/45/70/1024314570.db2.gz BNBLDAXQYWRFMT-UHFFFAOYSA-N 1 1 302.443 3.665 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC(C)(C)CC(F)F)c1 ZINC000883259529 1024331438 /nfs/dbraw/zinc/33/14/38/1024331438.db2.gz PQTSAVVMDIWFEB-JTQLQIEISA-N 1 1 315.360 3.511 20 10 DHCDMO CC[C@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Cl)ccc1O ZINC000883311447 1024362568 /nfs/dbraw/zinc/36/25/68/1024362568.db2.gz AFAGNDHYPGKMAO-AWEZNQCLSA-N 1 1 317.820 3.956 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278898610 1024381872 /nfs/dbraw/zinc/38/18/72/1024381872.db2.gz ZDHGKKKDRTUQGM-LPEHRKFASA-N 1 1 304.217 3.775 20 10 DHCDMO CC(C)OCC[C@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001172450290 1033207419 /nfs/dbraw/zinc/20/74/19/1033207419.db2.gz WPWPGQYFUNWAQO-LBPRGKRZSA-N 1 1 322.836 3.887 20 10 DHCDMO CS[C@H]1CCC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790966743 1024409968 /nfs/dbraw/zinc/40/99/68/1024409968.db2.gz VOLUBCKQOZGXLO-UWVGGRQHSA-N 1 1 303.830 3.949 20 10 DHCDMO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790989245 1024412137 /nfs/dbraw/zinc/41/21/37/1024412137.db2.gz AJUNFIXJMRVGNQ-HIFRSBDPSA-N 1 1 315.816 3.868 20 10 DHCDMO C[C@](O)(C[NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790996979 1024415985 /nfs/dbraw/zinc/41/59/85/1024415985.db2.gz JWQZVUFXWPTFIL-INIZCTEOSA-N 1 1 315.816 3.606 20 10 DHCDMO CC(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790972107 1024420041 /nfs/dbraw/zinc/42/00/41/1024420041.db2.gz DDHAYMRHJXEPNX-ZBEGNZNMSA-N 1 1 315.816 3.726 20 10 DHCDMO CCO[C@@H]1C[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C12CCC2 ZINC000790972046 1024420359 /nfs/dbraw/zinc/42/03/59/1024420359.db2.gz FCERATQPZHJNFP-UONOGXRCSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCC[C@@H]1CCCC[C@@H]1O ZINC000790976993 1024422184 /nfs/dbraw/zinc/42/21/84/1024422184.db2.gz DHYYVWNCFAQZKP-FZMZJTMJSA-N 1 1 315.816 3.606 20 10 DHCDMO OCC[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C1CCCCC1 ZINC000790980179 1024423872 /nfs/dbraw/zinc/42/38/72/1024423872.db2.gz JPCXIWBVFLFTGL-AWEZNQCLSA-N 1 1 315.816 3.606 20 10 DHCDMO COCC[N@@H+](Cc1cccc(OC)c1O)[C@@H](C)c1ccccc1 ZINC000271080754 1024454460 /nfs/dbraw/zinc/45/44/60/1024454460.db2.gz VRXIKBMTEZPZNM-HNNXBMFYSA-N 1 1 315.413 3.610 20 10 DHCDMO CC(C)COC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccco1 ZINC000101597043 1024516970 /nfs/dbraw/zinc/51/69/70/1024516970.db2.gz GXBNKMWQTOIFMX-SFHVURJKSA-N 1 1 316.445 3.849 20 10 DHCDMO COC1(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCCC1 ZINC000792162967 1024639452 /nfs/dbraw/zinc/63/94/52/1024639452.db2.gz SVJKCRAJDIFFDD-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)CC[C@@H]1C(F)(F)F ZINC000792190190 1024645104 /nfs/dbraw/zinc/64/51/04/1024645104.db2.gz QXGALOLFIVNXTO-ZDUSSCGKSA-N 1 1 305.315 3.942 20 10 DHCDMO Cc1ccccc1-n1nccc1C[N@H+](C)Cc1ccccc1O ZINC000792787390 1024791780 /nfs/dbraw/zinc/79/17/80/1024791780.db2.gz DQUXMGGMLABDHU-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO C[C@@H]1COCCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000772821548 1024792139 /nfs/dbraw/zinc/79/21/39/1024792139.db2.gz BAYIMJTYTUAIFI-CYBMUJFWSA-N 1 1 311.381 3.902 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H](C2CC2)O1 ZINC000793221212 1024936339 /nfs/dbraw/zinc/93/63/39/1024936339.db2.gz YAPNJOBTGWILSE-JXFKEZNVSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1cc(Br)cc(C[NH2+]C(C)(C)C(F)F)c1O ZINC000793255848 1024966671 /nfs/dbraw/zinc/96/66/71/1024966671.db2.gz SWIMCRVQALHOFL-UHFFFAOYSA-N 1 1 308.166 3.596 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@](C)(OC)CC2)cc1 ZINC000793342262 1024983901 /nfs/dbraw/zinc/98/39/01/1024983901.db2.gz WUAPOYDSAITTEP-IBGZPJMESA-N 1 1 304.478 3.924 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1ccc(N(C)C)cc1 ZINC000793566411 1025104392 /nfs/dbraw/zinc/10/43/92/1025104392.db2.gz FNJGRZAHPMDADP-CQSZACIVSA-N 1 1 308.429 3.522 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000793607550 1025125218 /nfs/dbraw/zinc/12/52/18/1025125218.db2.gz AMQVVONXLNLKAW-WOJBJXKFSA-N 1 1 314.473 3.820 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)cc1 ZINC000793610303 1025129883 /nfs/dbraw/zinc/12/98/83/1025129883.db2.gz STRFTKNFONXLLW-MOPGFXCFSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1C ZINC000793695032 1025152587 /nfs/dbraw/zinc/15/25/87/1025152587.db2.gz CYPCAZZFUHSPCW-CQSZACIVSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1C ZINC000793695032 1025152600 /nfs/dbraw/zinc/15/26/00/1025152600.db2.gz CYPCAZZFUHSPCW-CQSZACIVSA-N 1 1 317.351 3.551 20 10 DHCDMO C[C@@]1(O)CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000279692746 1025161099 /nfs/dbraw/zinc/16/10/99/1025161099.db2.gz QAPXGJXOBUFQPZ-HXUWFJFHSA-N 1 1 311.425 3.796 20 10 DHCDMO COc1cccc(C[N@@H+](C)Cc2ccccc2SC)c1O ZINC000279721342 1025180046 /nfs/dbraw/zinc/18/00/46/1025180046.db2.gz USHUASZVQFXCPE-UHFFFAOYSA-N 1 1 303.427 3.755 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC(C)(C)C1 ZINC000877306248 1033281033 /nfs/dbraw/zinc/28/10/33/1033281033.db2.gz KPVYUKADHBSTCD-INIZCTEOSA-N 1 1 316.489 3.516 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000925879739 1025424278 /nfs/dbraw/zinc/42/42/78/1025424278.db2.gz JNNFCXKUHKUSLW-OSMZGAPFSA-N 1 1 316.367 3.579 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3ccsc3C2)c1O ZINC000761202765 1025533067 /nfs/dbraw/zinc/53/30/67/1025533067.db2.gz LKYIXSLAEOOOLN-UHFFFAOYSA-N 1 1 309.818 3.674 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1c(O)cccc1F ZINC000886501794 1025657071 /nfs/dbraw/zinc/65/70/71/1025657071.db2.gz ZJFKQIAPKOMWOK-LSDHHAIUSA-N 1 1 314.404 3.708 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2O)n1 ZINC000894031130 1025657647 /nfs/dbraw/zinc/65/76/47/1025657647.db2.gz PHMMIVIOPZVCQA-MRXNPFEDSA-N 1 1 304.340 3.711 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2O)n1 ZINC000894031130 1025657656 /nfs/dbraw/zinc/65/76/56/1025657656.db2.gz PHMMIVIOPZVCQA-MRXNPFEDSA-N 1 1 304.340 3.711 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1c(O)cccc1F ZINC000886501791 1025659158 /nfs/dbraw/zinc/65/91/58/1025659158.db2.gz ZJFKQIAPKOMWOK-CABCVRRESA-N 1 1 314.404 3.708 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1c(O)cccc1F ZINC000886561876 1025708824 /nfs/dbraw/zinc/70/88/24/1025708824.db2.gz LPDUWBCMSJDSTI-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO Cc1c(C[NH2+][C@H](C)c2c(O)cccc2F)cccc1[N+](=O)[O-] ZINC000886598495 1025730353 /nfs/dbraw/zinc/73/03/53/1025730353.db2.gz BVCNYMGWGWQQSK-LLVKDONJSA-N 1 1 304.321 3.599 20 10 DHCDMO COC[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1cccc(OC)c1 ZINC000886636775 1025750053 /nfs/dbraw/zinc/75/00/53/1025750053.db2.gz UYPXBYJMKZEFFO-BLLLJJGKSA-N 1 1 319.376 3.578 20 10 DHCDMO CCc1cccc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1O ZINC000691527932 1025807280 /nfs/dbraw/zinc/80/72/80/1025807280.db2.gz VNYUFNPOMPMKNN-GOSISDBHSA-N 1 1 324.468 3.566 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000806180826 1025835421 /nfs/dbraw/zinc/83/54/21/1025835421.db2.gz SXWLVZYNWMQNBK-AAEUAGOBSA-N 1 1 323.795 3.611 20 10 DHCDMO CCC[N@@H+](Cc1cccc(NC(C)=O)c1)Cc1ccccc1O ZINC000075829105 1025851130 /nfs/dbraw/zinc/85/11/30/1025851130.db2.gz JLFSEPJEMYTYOE-UHFFFAOYSA-N 1 1 312.413 3.763 20 10 DHCDMO C[C@H]1[C@@H](N2CCCC2)CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000808190859 1026222076 /nfs/dbraw/zinc/22/20/76/1026222076.db2.gz KHRUJEJBKZXHMG-KXBFYZLASA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1c(O)ccc2ccccc21 ZINC000808190859 1026222090 /nfs/dbraw/zinc/22/20/90/1026222090.db2.gz KHRUJEJBKZXHMG-KXBFYZLASA-N 1 1 310.441 3.604 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)OCO3)[C@@H]1c1cccs1 ZINC000808221352 1026229005 /nfs/dbraw/zinc/22/90/05/1026229005.db2.gz FPUUIMGNSAXNAJ-MRXNPFEDSA-N 1 1 317.410 3.766 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCN2CCCCC2)c1O ZINC000808673830 1026354743 /nfs/dbraw/zinc/35/47/43/1026354743.db2.gz VHJODXLXLGFRTE-CQSZACIVSA-N 1 1 310.869 3.881 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1O ZINC000808677014 1026355021 /nfs/dbraw/zinc/35/50/21/1026355021.db2.gz OJTQJXRNPUXSGM-MAZHCROVSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1O ZINC000808677014 1026355031 /nfs/dbraw/zinc/35/50/31/1026355031.db2.gz OJTQJXRNPUXSGM-MAZHCROVSA-N 1 1 308.853 3.631 20 10 DHCDMO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808712734 1026362827 /nfs/dbraw/zinc/36/28/27/1026362827.db2.gz AYVQHWJGHVKSOK-DTWKUNHWSA-N 1 1 311.838 3.926 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC000809728698 1026595794 /nfs/dbraw/zinc/59/57/94/1026595794.db2.gz FSHGDEAMAVRVGU-OAHLLOKOSA-N 1 1 318.804 3.786 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2N(C)C)cc1F ZINC000809788324 1026628003 /nfs/dbraw/zinc/62/80/03/1026628003.db2.gz QOQGAIWEUCXKSM-UHFFFAOYSA-N 1 1 315.436 3.590 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCCc3occc3C2)c1O ZINC000809792216 1026629792 /nfs/dbraw/zinc/62/97/92/1026629792.db2.gz MNCVTYLCXYYKKT-UHFFFAOYSA-N 1 1 307.777 3.596 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1O ZINC000811513522 1027028810 /nfs/dbraw/zinc/02/88/10/1027028810.db2.gz JVEGUEIANKNWOH-INIZCTEOSA-N 1 1 307.821 3.819 20 10 DHCDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000295195790 1027140466 /nfs/dbraw/zinc/14/04/66/1027140466.db2.gz XXRQWDQBKCXVNU-LJQANCHMSA-N 1 1 302.462 3.535 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCCC12CCOCC2 ZINC000362335518 1027153726 /nfs/dbraw/zinc/15/37/26/1027153726.db2.gz LQFJTKYCPVUPQB-UHFFFAOYSA-N 1 1 314.473 3.822 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C(C)C)[C@H]3CCOC3)c2c1 ZINC000812290675 1027235642 /nfs/dbraw/zinc/23/56/42/1027235642.db2.gz FOMVPJDSQOGDDF-HNNXBMFYSA-N 1 1 315.413 3.553 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccc(F)cc1O ZINC000812734320 1027379357 /nfs/dbraw/zinc/37/93/57/1027379357.db2.gz GZNSRSZLBVLHCA-MRXNPFEDSA-N 1 1 313.376 3.659 20 10 DHCDMO CN(C)c1ccc(C[NH+]2CC(c3ccccc3F)C2)cc1F ZINC000812791641 1027407853 /nfs/dbraw/zinc/40/78/53/1027407853.db2.gz YQKOZTBIPRIFME-UHFFFAOYSA-N 1 1 302.368 3.630 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC3(CCC3)C2)c(OC)c1 ZINC001138389670 1027478852 /nfs/dbraw/zinc/47/88/52/1027478852.db2.gz JYHJSTSTVNYXDW-UHFFFAOYSA-N 1 1 302.462 3.917 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)Cc3ccccc3)cc2)CC1 ZINC000296256950 1027588890 /nfs/dbraw/zinc/58/88/90/1027588890.db2.gz GBFMUTGUNLBYFS-UHFFFAOYSA-N 1 1 324.468 3.934 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706699 1027642941 /nfs/dbraw/zinc/64/29/41/1027642941.db2.gz KOOXSSGCSYORCT-HNNXBMFYSA-N 1 1 303.352 3.660 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cc(F)ccc2O)C2CC2)cc1 ZINC000778995791 1027733202 /nfs/dbraw/zinc/73/32/02/1027733202.db2.gz IXDAXUNEDUKIJE-UHFFFAOYSA-N 1 1 314.404 3.762 20 10 DHCDMO CC[N@@H+](Cc1cc(F)ccc1O)Cc1ccc(OC)cc1OC ZINC000778996233 1027746242 /nfs/dbraw/zinc/74/62/42/1027746242.db2.gz KFIJHOOVENUHJW-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000779020634 1027854313 /nfs/dbraw/zinc/85/43/13/1027854313.db2.gz NSKLWRNNSLNVSV-CQSZACIVSA-N 1 1 303.352 3.735 20 10 DHCDMO CC[N@@H+](Cc1cc(F)ccc1O)[C@@H]1CCCc2cccnc21 ZINC000365001410 1027897073 /nfs/dbraw/zinc/89/70/73/1027897073.db2.gz MZFVLFULSBVBON-MRXNPFEDSA-N 1 1 300.377 3.826 20 10 DHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC12CCC2 ZINC000814171302 1027906064 /nfs/dbraw/zinc/90/60/64/1027906064.db2.gz NYUHJEVGHXHIOB-LJQANCHMSA-N 1 1 314.473 3.534 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc(F)cc1O ZINC000528000666 1028024718 /nfs/dbraw/zinc/02/47/18/1028024718.db2.gz KLGUUWDOGLADAT-NVXWUHKLSA-N 1 1 306.425 3.589 20 10 DHCDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000779055588 1028086553 /nfs/dbraw/zinc/08/65/53/1028086553.db2.gz LCKZWXOIWOMOCX-SECBINFHSA-N 1 1 311.303 3.669 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCC2CCOCC2)C2CC2)cc1 ZINC000814618863 1028125848 /nfs/dbraw/zinc/12/58/48/1028125848.db2.gz ISQGGWKOXBUZIZ-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@@H+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)C1 ZINC001170759262 1028160649 /nfs/dbraw/zinc/16/06/49/1028160649.db2.gz BDPCSQBZRKOOIU-WVJCCSTMSA-N 1 1 324.468 3.980 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(N2CCCCC2)cc1 ZINC000368001186 1028271911 /nfs/dbraw/zinc/27/19/11/1028271911.db2.gz XGHOLQJLLIIMRL-NVXWUHKLSA-N 1 1 324.472 3.608 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000368024355 1028279050 /nfs/dbraw/zinc/27/90/50/1028279050.db2.gz TXJLJWKTFNXVMA-HOTGVXAUSA-N 1 1 301.386 3.818 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000368024355 1028279068 /nfs/dbraw/zinc/27/90/68/1028279068.db2.gz TXJLJWKTFNXVMA-HOTGVXAUSA-N 1 1 301.386 3.818 20 10 DHCDMO Cc1cc(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)ccc1N(C)C ZINC000815055883 1028334794 /nfs/dbraw/zinc/33/47/94/1028334794.db2.gz RIILGWNOTBWJNZ-MOPGFXCFSA-N 1 1 315.505 3.508 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2cc(Cl)cn2C)ccc1N(C)C ZINC000815061377 1028347470 /nfs/dbraw/zinc/34/74/70/1028347470.db2.gz SHYYUVUFOVXEIE-UHFFFAOYSA-N 1 1 305.853 3.685 20 10 DHCDMO Cc1cc(C[N@H+](CCc2nccs2)C(C)C)ccc1N(C)C ZINC000815076244 1028352498 /nfs/dbraw/zinc/35/24/98/1028352498.db2.gz NUQJPPUSQNLYFX-UHFFFAOYSA-N 1 1 317.502 3.971 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)ccc1N(C)C ZINC000815089583 1028359222 /nfs/dbraw/zinc/35/92/22/1028359222.db2.gz DSGUMLZSHLLYOE-LJQANCHMSA-N 1 1 309.457 3.521 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)ccc1N(C)C ZINC000815102773 1028379260 /nfs/dbraw/zinc/37/92/60/1028379260.db2.gz LDTMEGJJCABHKE-CQSZACIVSA-N 1 1 300.368 3.835 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)ccc1N(C)C ZINC000815108800 1028381571 /nfs/dbraw/zinc/38/15/71/1028381571.db2.gz ODSZWXMTTRXXQS-GXTWGEPZSA-N 1 1 300.368 3.834 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000368815696 1028411324 /nfs/dbraw/zinc/41/13/24/1028411324.db2.gz GEDJBJRUEKEWKL-OAQYLSRUSA-N 1 1 319.404 3.985 20 10 DHCDMO Cc1ccn(C2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)n1 ZINC000369291704 1028467353 /nfs/dbraw/zinc/46/73/53/1028467353.db2.gz AOWIWYFZYPXALV-UHFFFAOYSA-N 1 1 323.799 3.527 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000369878253 1028541682 /nfs/dbraw/zinc/54/16/82/1028541682.db2.gz OWVHLWKADCBOTI-IEBWSBKVSA-N 1 1 315.388 3.576 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000369928993 1028547423 /nfs/dbraw/zinc/54/74/23/1028547423.db2.gz GFCAPGQSFIOAQB-NVXWUHKLSA-N 1 1 303.427 3.978 20 10 DHCDMO CC(C)N(C)C[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628195 1028577587 /nfs/dbraw/zinc/57/75/87/1028577587.db2.gz UEFAFOXAWBTVCG-NWDGAFQWSA-N 1 1 318.383 3.790 20 10 DHCDMO CO[C@H](C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1CC1 ZINC000815651202 1028596135 /nfs/dbraw/zinc/59/61/35/1028596135.db2.gz NGTULINVHISLIO-RMLUDKJBSA-N 1 1 304.217 3.775 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000815651714 1028596207 /nfs/dbraw/zinc/59/62/07/1028596207.db2.gz BABLIEJTRCLZSZ-CABZTGNLSA-N 1 1 305.340 3.611 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H](c3ccsc3)C[C@H]2C)c1O ZINC000372405580 1028851148 /nfs/dbraw/zinc/85/11/48/1028851148.db2.gz WMYDBIAFEUPKJA-DOMZBBRYSA-N 1 1 303.427 3.840 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000372595210 1028872614 /nfs/dbraw/zinc/87/26/14/1028872614.db2.gz OVLKJTMUCCPYMP-PKOBYXMFSA-N 1 1 313.397 3.622 20 10 DHCDMO C[N@H+](CCC(F)(F)F)Cc1c(O)cccc1Br ZINC000707165784 1028888483 /nfs/dbraw/zinc/88/84/83/1028888483.db2.gz KQDHHQLQERYQNP-UHFFFAOYSA-N 1 1 312.129 3.539 20 10 DHCDMO C[N@@H+](CCC(F)(F)F)Cc1c(O)cccc1Br ZINC000707165784 1028888496 /nfs/dbraw/zinc/88/84/96/1028888496.db2.gz KQDHHQLQERYQNP-UHFFFAOYSA-N 1 1 312.129 3.539 20 10 DHCDMO [O-]c1c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816486094 1028891539 /nfs/dbraw/zinc/89/15/39/1028891539.db2.gz NYJLXBGTHPERKK-UHFFFAOYSA-N 1 1 324.468 3.853 20 10 DHCDMO CCc1nocc1C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000816508659 1028911549 /nfs/dbraw/zinc/91/15/49/1028911549.db2.gz RAGHKQGWNDYRTA-UHFFFAOYSA-N 1 1 300.402 3.887 20 10 DHCDMO CS[C@@H]1CCCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521709 1028933479 /nfs/dbraw/zinc/93/34/79/1028933479.db2.gz XCSQTNXSSJTYRD-LLVKDONJSA-N 1 1 303.830 3.902 20 10 DHCDMO CS[C@@H]1CCCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816521709 1028933492 /nfs/dbraw/zinc/93/34/92/1028933492.db2.gz XCSQTNXSSJTYRD-LLVKDONJSA-N 1 1 303.830 3.902 20 10 DHCDMO C[C@H](CC[NH2+]Cc1ccc2ccccc2c1[O-])[NH+]1CCCCC1 ZINC000816567917 1028948419 /nfs/dbraw/zinc/94/84/19/1028948419.db2.gz PEYWXFNJOSDJOO-MRXNPFEDSA-N 1 1 312.457 3.900 20 10 DHCDMO CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc2ccccc2c1[O-] ZINC000816610990 1028958668 /nfs/dbraw/zinc/95/86/68/1028958668.db2.gz FCOMUJADPNITRM-UHFFFAOYSA-N 1 1 312.457 3.853 20 10 DHCDMO CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccc2ccccc2c1[O-] ZINC000816610990 1028958677 /nfs/dbraw/zinc/95/86/77/1028958677.db2.gz FCOMUJADPNITRM-UHFFFAOYSA-N 1 1 312.457 3.853 20 10 DHCDMO CCC[N@H+](CC)C[C@@H](C)NCc1ccc2ccccc2c1O ZINC000816616335 1028963218 /nfs/dbraw/zinc/96/32/18/1028963218.db2.gz ULZPJTCXZVGWOZ-OAHLLOKOSA-N 1 1 300.446 3.755 20 10 DHCDMO CCC[N@@H+](CC)C[C@@H](C)NCc1ccc2ccccc2c1O ZINC000816616335 1028963230 /nfs/dbraw/zinc/96/32/30/1028963230.db2.gz ULZPJTCXZVGWOZ-OAHLLOKOSA-N 1 1 300.446 3.755 20 10 DHCDMO Oc1c(C[N@H+]2CCOC[C@@H](C3CCC3)C2)ccc2ccccc21 ZINC000816617100 1028964696 /nfs/dbraw/zinc/96/46/96/1028964696.db2.gz OYDIBAGKLHTCCZ-SFHVURJKSA-N 1 1 311.425 3.794 20 10 DHCDMO CCC[N@H+](CC)C[C@H](C)NCc1ccc2ccccc2c1O ZINC000816616334 1028965215 /nfs/dbraw/zinc/96/52/15/1028965215.db2.gz ULZPJTCXZVGWOZ-HNNXBMFYSA-N 1 1 300.446 3.755 20 10 DHCDMO CCC[N@@H+](CC)C[C@H](C)NCc1ccc2ccccc2c1O ZINC000816616334 1028965222 /nfs/dbraw/zinc/96/52/22/1028965222.db2.gz ULZPJTCXZVGWOZ-HNNXBMFYSA-N 1 1 300.446 3.755 20 10 DHCDMO CN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1F ZINC000816621696 1028967507 /nfs/dbraw/zinc/96/75/07/1028967507.db2.gz NLNOWLODELYIHP-SFHVURJKSA-N 1 1 313.420 3.870 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1F ZINC000816621696 1028967522 /nfs/dbraw/zinc/96/75/22/1028967522.db2.gz NLNOWLODELYIHP-SFHVURJKSA-N 1 1 313.420 3.870 20 10 DHCDMO [O-]c1c(C[NH2+]CCCCC[NH+]2CCCC2)ccc2ccccc21 ZINC000816644457 1028973374 /nfs/dbraw/zinc/97/33/74/1028973374.db2.gz NGRKUWRQDDGQGO-UHFFFAOYSA-N 1 1 312.457 3.901 20 10 DHCDMO COc1cc2c(cc1Cl)C[N@@H+](Cc1ccccc1O)CC2 ZINC000816665084 1028985239 /nfs/dbraw/zinc/98/52/39/1028985239.db2.gz RPUYSNBNEPAEAR-UHFFFAOYSA-N 1 1 303.789 3.613 20 10 DHCDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(F)cc1O ZINC000373254634 1028988693 /nfs/dbraw/zinc/98/86/93/1028988693.db2.gz FVNDDAKOILGUJS-ZUEVXXBESA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000817413275 1029152857 /nfs/dbraw/zinc/15/28/57/1029152857.db2.gz VNFLLCQQTPOTMC-HOTGVXAUSA-N 1 1 311.425 3.510 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2c1c(F)ccc2[O-] ZINC000817585551 1029212171 /nfs/dbraw/zinc/21/21/71/1029212171.db2.gz GOLUKRXWOSTPBU-LFUGVXIPSA-N 1 1 306.425 3.542 20 10 DHCDMO C[C@@H](C[C@H]1CCCCC[NH2+]1)NCc1ccc(N2CCCC2)cc1 ZINC000817898137 1029270284 /nfs/dbraw/zinc/27/02/84/1029270284.db2.gz DKLMRHWCVUKGPJ-PKOBYXMFSA-N 1 1 315.505 3.687 20 10 DHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccs1 ZINC000817938660 1029278491 /nfs/dbraw/zinc/27/84/91/1029278491.db2.gz OZANTYHTHNMIBC-HOTGVXAUSA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(Cl)c1 ZINC000817939104 1029282804 /nfs/dbraw/zinc/28/28/04/1029282804.db2.gz ZAVYWEXIJCDQDU-ACJLOTCBSA-N 1 1 317.864 3.757 20 10 DHCDMO CCC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccsc1 ZINC000817941170 1029284721 /nfs/dbraw/zinc/28/47/21/1029284721.db2.gz JGUMAPNTGRGUMD-ROUUACIJSA-N 1 1 317.502 3.945 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970183 1029311380 /nfs/dbraw/zinc/31/13/80/1029311380.db2.gz NNUYGKQKUGTAFG-BZPMIXESSA-N 1 1 316.367 3.722 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1[O-] ZINC000817984996 1029324331 /nfs/dbraw/zinc/32/43/31/1029324331.db2.gz DXHOFTYDCUEUEA-HIFRSBDPSA-N 1 1 308.853 3.761 20 10 DHCDMO Cc1cc(C[NH2+]Cc2ncnn2C(C)C)c(C)n1-c1ccccc1 ZINC000865642174 1029957134 /nfs/dbraw/zinc/95/71/34/1029957134.db2.gz CSLPPCLQUQDHQG-UHFFFAOYSA-N 1 1 323.444 3.556 20 10 DHCDMO COc1cc(O)c(CNc2cccc3cc[nH+]cc32)cc1OC ZINC000777500566 1030056301 /nfs/dbraw/zinc/05/63/01/1030056301.db2.gz NHHVPCXCGJDDEW-UHFFFAOYSA-N 1 1 310.353 3.570 20 10 DHCDMO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000924649496 1030149082 /nfs/dbraw/zinc/14/90/82/1030149082.db2.gz QSJNFMYECBQRLP-QGZVFWFLSA-N 1 1 311.429 3.750 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@@H](c2ccsc2)O1 ZINC000245942390 1030209131 /nfs/dbraw/zinc/20/91/31/1030209131.db2.gz KAVPSZNBLCOJHS-ZBEGNZNMSA-N 1 1 307.390 3.555 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@@H](c2ccsc2)O1 ZINC000245942390 1030209147 /nfs/dbraw/zinc/20/91/47/1030209147.db2.gz KAVPSZNBLCOJHS-ZBEGNZNMSA-N 1 1 307.390 3.555 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866480905 1030318782 /nfs/dbraw/zinc/31/87/82/1030318782.db2.gz KATIPAINQQEOHJ-CXAGYDPISA-N 1 1 307.409 3.921 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1COc2ccccc2C1)c1ccc(F)cc1O ZINC000796724947 1030438408 /nfs/dbraw/zinc/43/84/08/1030438408.db2.gz LCLCVTHQVLUZCF-GDBMZVCRSA-N 1 1 301.361 3.576 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cc(Cl)c(C)cc2O)ccc1O ZINC000824548470 1030588366 /nfs/dbraw/zinc/58/83/66/1030588366.db2.gz NGTRQWWDELKPSK-UHFFFAOYSA-N 1 1 321.804 3.700 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H](CO)c1ccccc1 ZINC000824696443 1030613737 /nfs/dbraw/zinc/61/37/37/1030613737.db2.gz MYOOKFNMXVFZDI-OAQYLSRUSA-N 1 1 324.468 3.842 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c1O ZINC000824690805 1030614738 /nfs/dbraw/zinc/61/47/38/1030614738.db2.gz MKPYHQXUIHHHRP-INIZCTEOSA-N 1 1 305.805 3.519 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000824751050 1030639395 /nfs/dbraw/zinc/63/93/95/1030639395.db2.gz QUYGKCWDEBVPHS-LLVKDONJSA-N 1 1 313.800 3.624 20 10 DHCDMO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000824800525 1030640620 /nfs/dbraw/zinc/64/06/20/1030640620.db2.gz YZBVMRMGFFNDPO-ABAIWWIYSA-N 1 1 315.816 3.726 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1(C)C ZINC000824820224 1030648793 /nfs/dbraw/zinc/64/87/93/1030648793.db2.gz BOAQQXITCNQUDV-LJQANCHMSA-N 1 1 316.489 3.924 20 10 DHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000824843513 1030661899 /nfs/dbraw/zinc/66/18/99/1030661899.db2.gz PKAACWRDQFBCEA-SNVBAGLBSA-N 1 1 318.280 3.728 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1OCCc2sccc21)c1ccc(F)cc1O ZINC000291933686 1030706027 /nfs/dbraw/zinc/70/60/27/1030706027.db2.gz PDGQAGYPYUOCBD-DINDLPBHSA-N 1 1 321.417 3.946 20 10 DHCDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000825090703 1030725442 /nfs/dbraw/zinc/72/54/42/1030725442.db2.gz DZIYDRXWEHKQAP-IBGZPJMESA-N 1 1 316.489 3.660 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C2(C3(C)CC3)CC2)c1 ZINC000825124640 1030731733 /nfs/dbraw/zinc/73/17/33/1030731733.db2.gz VGPDWDGMUIKQCP-UHFFFAOYSA-N 1 1 310.235 3.885 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC3(CCCC3)[C@H]2C(C)C)cc1OC ZINC000825337146 1030781728 /nfs/dbraw/zinc/78/17/28/1030781728.db2.gz CVRNWDDFONRHGT-GOSISDBHSA-N 1 1 319.445 3.810 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](C)N1CCC(C)CC1)c1ccc(F)cc1O ZINC000796726137 1030995410 /nfs/dbraw/zinc/99/54/10/1030995410.db2.gz PERGUYJPFXHPPY-PBHICJAKSA-N 1 1 308.441 3.692 20 10 DHCDMO CC(C)O[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000844718288 1031304847 /nfs/dbraw/zinc/30/48/47/1031304847.db2.gz GEBUMAIMEWFZEX-INIZCTEOSA-N 1 1 321.461 3.785 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccc(F)cc1O ZINC000844927371 1031403474 /nfs/dbraw/zinc/40/34/74/1031403474.db2.gz ZKJDLJLVOKJCFJ-XJKSGUPXSA-N 1 1 314.404 3.999 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cc(O)ccc1F ZINC000872028562 1031413134 /nfs/dbraw/zinc/41/31/34/1031413134.db2.gz KMWRSPRXZHDSHW-NSHDSACASA-N 1 1 306.356 3.587 20 10 DHCDMO C[N@@H+](Cc1cc(Br)c(F)cc1O)CC1CCC1 ZINC001144299949 1031439387 /nfs/dbraw/zinc/43/93/87/1031439387.db2.gz NJFDPLRIURCUQX-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO C[N@H+](Cc1cc(Br)c(F)cc1O)CC1CCC1 ZINC001144299949 1031439392 /nfs/dbraw/zinc/43/93/92/1031439392.db2.gz NJFDPLRIURCUQX-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO CCc1ncc(C[N@@H+](C)Cc2ccc(N(CC)CC)cc2)o1 ZINC000929183589 1031458834 /nfs/dbraw/zinc/45/88/34/1031458834.db2.gz BXTUBBYDELLNQJ-UHFFFAOYSA-N 1 1 301.434 3.715 20 10 DHCDMO CCc1ncc(C[N@H+](C)Cc2ccc(N(CC)CC)cc2)o1 ZINC000929183589 1031458843 /nfs/dbraw/zinc/45/88/43/1031458843.db2.gz BXTUBBYDELLNQJ-UHFFFAOYSA-N 1 1 301.434 3.715 20 10 DHCDMO Cc1csc(C(C)(C)[NH2+]Cc2cc(Cl)c(F)cc2O)n1 ZINC000293511456 1031494667 /nfs/dbraw/zinc/49/46/67/1031494667.db2.gz CFHSPHWSOLWIQH-UHFFFAOYSA-N 1 1 314.813 3.975 20 10 DHCDMO Cc1nc(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)sc1C ZINC001144369698 1031507499 /nfs/dbraw/zinc/50/74/99/1031507499.db2.gz YIKDZIVQHZURFC-UHFFFAOYSA-N 1 1 315.486 3.992 20 10 DHCDMO Cc1nc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)sc1C ZINC001144369698 1031507507 /nfs/dbraw/zinc/50/75/07/1031507507.db2.gz YIKDZIVQHZURFC-UHFFFAOYSA-N 1 1 315.486 3.992 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c(O)c1 ZINC000872261068 1031564036 /nfs/dbraw/zinc/56/40/36/1031564036.db2.gz ZBGDYXWLZOXSBF-KRWDZBQOSA-N 1 1 319.445 3.715 20 10 DHCDMO COc1cc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2ccco2)cc1OC ZINC000872634352 1031636943 /nfs/dbraw/zinc/63/69/43/1031636943.db2.gz PLHUEZXNHGACGS-QGZVFWFLSA-N 1 1 317.385 3.586 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CC(C)(C)[C@H]2c2ccco2)cc1OC ZINC000872634352 1031636953 /nfs/dbraw/zinc/63/69/53/1031636953.db2.gz PLHUEZXNHGACGS-QGZVFWFLSA-N 1 1 317.385 3.586 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCCC[C@H]2c2ccccc2F)c(O)c1 ZINC001144509358 1031664363 /nfs/dbraw/zinc/66/43/63/1031664363.db2.gz UPWPHYJQMBXFOE-INIZCTEOSA-N 1 1 317.360 3.670 20 10 DHCDMO CCCOc1ccc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C ZINC000873014455 1031694431 /nfs/dbraw/zinc/69/44/31/1031694431.db2.gz RONAPINCOHFKHW-ROUUACIJSA-N 1 1 302.462 3.500 20 10 DHCDMO CCCOc1ccc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1C ZINC000873014455 1031694438 /nfs/dbraw/zinc/69/44/38/1031694438.db2.gz RONAPINCOHFKHW-ROUUACIJSA-N 1 1 302.462 3.500 20 10 DHCDMO C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)c1ccc(F)cc1O ZINC000873237492 1031770217 /nfs/dbraw/zinc/77/02/17/1031770217.db2.gz PVFRLWYRKWBWIN-STQMWFEESA-N 1 1 300.377 3.781 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846105811 1031878183 /nfs/dbraw/zinc/87/81/83/1031878183.db2.gz YPYMCFKEHVCBTA-CYBMUJFWSA-N 1 1 305.727 3.806 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846105811 1031878201 /nfs/dbraw/zinc/87/82/01/1031878201.db2.gz YPYMCFKEHVCBTA-CYBMUJFWSA-N 1 1 305.727 3.806 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898072130 1031944929 /nfs/dbraw/zinc/94/49/29/1031944929.db2.gz YKZBPEMMIZXNHS-LLVKDONJSA-N 1 1 308.834 3.567 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000846699580 1032042727 /nfs/dbraw/zinc/04/27/27/1032042727.db2.gz UTTGPDBGQXHJNO-WMZOPIPTSA-N 1 1 303.494 3.625 20 10 DHCDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877468854 1033310276 /nfs/dbraw/zinc/31/02/76/1033310276.db2.gz OEOJAPJEXLWOBD-IKGGRYGDSA-N 1 1 316.489 3.514 20 10 DHCDMO Cc1cccc(O)c1C[NH2+][C@H](C)c1nc(Cc2ccccc2)no1 ZINC000877470817 1033310511 /nfs/dbraw/zinc/31/05/11/1033310511.db2.gz NERRILJZHLQOOR-CQSZACIVSA-N 1 1 323.396 3.525 20 10 DHCDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877543182 1033347410 /nfs/dbraw/zinc/34/74/10/1033347410.db2.gz ZQIUXUKFDJDBKQ-INIZCTEOSA-N 1 1 304.478 3.658 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](O)C[C@H]1c1ccccc1 ZINC000877674335 1033408074 /nfs/dbraw/zinc/40/80/74/1033408074.db2.gz UBMLINZMECPMNT-RTWAWAEBSA-N 1 1 324.468 3.759 20 10 DHCDMO Oc1cccc2c1C[N@H+](Cc1ccc(OC(F)F)c(F)c1)C2 ZINC000877703089 1033417049 /nfs/dbraw/zinc/41/70/49/1033417049.db2.gz QXXKBSKHXHVJRJ-UHFFFAOYSA-N 1 1 309.287 3.649 20 10 DHCDMO Oc1cccc2c1C[N@@H+](Cc1ccc(OC(F)F)c(F)c1)C2 ZINC000877703089 1033417060 /nfs/dbraw/zinc/41/70/60/1033417060.db2.gz QXXKBSKHXHVJRJ-UHFFFAOYSA-N 1 1 309.287 3.649 20 10 DHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3O)C2)n1 ZINC000877812518 1033464429 /nfs/dbraw/zinc/46/44/29/1033464429.db2.gz BYXYNBIULURRKI-NSHDSACASA-N 1 1 308.834 3.800 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CC[C@H](C(F)(F)F)O1 ZINC000877823523 1033473260 /nfs/dbraw/zinc/47/32/60/1033473260.db2.gz MCKZFXXIVOMUBJ-TVQRCGJNSA-N 1 1 323.742 3.587 20 10 DHCDMO CC(C)(O)[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000877834953 1033481677 /nfs/dbraw/zinc/48/16/77/1033481677.db2.gz BSBCWGLWIAGFJD-SFHVURJKSA-N 1 1 311.425 3.652 20 10 DHCDMO CCSC[C@H](C)[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001173304806 1033658470 /nfs/dbraw/zinc/65/84/70/1033658470.db2.gz KDSWTHGDMNAIRB-ZDUSSCGKSA-N 1 1 318.486 3.687 20 10 DHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(C(F)F)CC2)cc1F ZINC000862246172 1033796168 /nfs/dbraw/zinc/79/61/68/1033796168.db2.gz KOECLRJILMUHMO-UHFFFAOYSA-N 1 1 304.331 3.508 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC000862366087 1033830683 /nfs/dbraw/zinc/83/06/83/1033830683.db2.gz CWZUHBFQSCMARX-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC000862366087 1033830693 /nfs/dbraw/zinc/83/06/93/1033830693.db2.gz CWZUHBFQSCMARX-QGZVFWFLSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[NH+]2CCC(OC3CCC3)CC2)cc1F ZINC000862396268 1033840079 /nfs/dbraw/zinc/84/00/79/1033840079.db2.gz KDOMLQNKYZNDQY-UHFFFAOYSA-N 1 1 324.415 3.564 20 10 DHCDMO Cc1cc(Br)cc(Cn2c[nH+]c3c2CCCC3)c1O ZINC000862431729 1033850756 /nfs/dbraw/zinc/85/07/56/1033850756.db2.gz RZORKQVWBTUFLX-UHFFFAOYSA-N 1 1 321.218 3.587 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+]Cc2cc(Cl)c(F)cc2O)nc1 ZINC000862480347 1033862372 /nfs/dbraw/zinc/86/23/72/1033862372.db2.gz CYVIRDDHDUSEMS-UHFFFAOYSA-N 1 1 322.811 3.956 20 10 DHCDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccccc3O)C2)cc1F ZINC000862540171 1033879766 /nfs/dbraw/zinc/87/97/66/1033879766.db2.gz APPRPHWNUIQHLN-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO CCc1cc(C[N@@H+](C)CC2(C)COC2)c(O)c(C(C)(C)C)c1 ZINC000863299096 1034059420 /nfs/dbraw/zinc/05/94/20/1034059420.db2.gz DBQOKSBZZFMZRA-UHFFFAOYSA-N 1 1 305.462 3.720 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[C@@H](C)[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000863548000 1034127381 /nfs/dbraw/zinc/12/73/81/1034127381.db2.gz SZDVOEKJWHVARL-NRUUGDAUSA-N 1 1 317.260 3.880 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000179557790 1034316013 /nfs/dbraw/zinc/31/60/13/1034316013.db2.gz WSEUYFSTFRJQAO-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO CCc1cc(C[N@H+]2CCC[C@@](C)(O)CC2)c(O)c(C(C)(C)C)c1 ZINC000794672991 1034334395 /nfs/dbraw/zinc/33/43/95/1034334395.db2.gz PEWFRUCRFIQGLP-HXUWFJFHSA-N 1 1 319.489 3.989 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000184998392 1034517783 /nfs/dbraw/zinc/51/77/83/1034517783.db2.gz LSJMPBKVLYXVSN-CABCVRRESA-N 1 1 314.404 3.708 20 10 DHCDMO C[C@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(F)cc1O ZINC000186354943 1034624303 /nfs/dbraw/zinc/62/43/03/1034624303.db2.gz VAVJYOITHPVARW-GQGQLFGLSA-N 1 1 305.393 3.530 20 10 DHCDMO CCSc1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)ccn1 ZINC000187799544 1034732579 /nfs/dbraw/zinc/73/25/79/1034732579.db2.gz OQSVKMUSFDCUMH-LLVKDONJSA-N 1 1 306.406 3.889 20 10 DHCDMO C[C@H]([NH2+]CCc1cccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192649421 1034812381 /nfs/dbraw/zinc/81/23/81/1034812381.db2.gz ULGNAXWMUQUBMM-JTQLQIEISA-N 1 1 311.212 3.987 20 10 DHCDMO Cc1ccn2cc(C[NH2+]Cc3c(O)cc(C)cc3Cl)nc2c1 ZINC001177733234 1035390441 /nfs/dbraw/zinc/39/04/41/1035390441.db2.gz IPCDCUDFBADWTA-UHFFFAOYSA-N 1 1 315.804 3.600 20 10 DHCDMO COc1c(Cl)cccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC001179690486 1035489697 /nfs/dbraw/zinc/48/96/97/1035489697.db2.gz HXCXPUGIPYAKSL-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)c(C)cc2[O-])CC1 ZINC001180125425 1035605618 /nfs/dbraw/zinc/60/56/18/1035605618.db2.gz ZHPUHFSPXPJXJM-UHFFFAOYSA-N 1 1 324.896 3.908 20 10 DHCDMO Cn1ccc([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000905720281 1035622183 /nfs/dbraw/zinc/62/21/83/1035622183.db2.gz CBZGDGVKIUIAQP-MRXNPFEDSA-N 1 1 321.424 3.659 20 10 DHCDMO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001180359944 1035654623 /nfs/dbraw/zinc/65/46/23/1035654623.db2.gz ZFCFBQARCLSLGW-HKUYNNGSSA-N 1 1 316.489 3.781 20 10 DHCDMO CCCOc1ccc(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)cc1C ZINC001181472812 1035919827 /nfs/dbraw/zinc/91/98/27/1035919827.db2.gz RQQZBCKITAOFCY-GOSISDBHSA-N 1 1 304.478 3.604 20 10 DHCDMO CCCOc1ccc(CNC[C@H]2CC[N@@H+](C(C)C)C2)cc1C ZINC001181472812 1035919834 /nfs/dbraw/zinc/91/98/34/1035919834.db2.gz RQQZBCKITAOFCY-GOSISDBHSA-N 1 1 304.478 3.604 20 10 DHCDMO CCCOc1ccc(CNC[C@H]2CC[N@H+](C(C)C)C2)cc1C ZINC001181472812 1035919848 /nfs/dbraw/zinc/91/98/48/1035919848.db2.gz RQQZBCKITAOFCY-GOSISDBHSA-N 1 1 304.478 3.604 20 10 DHCDMO Cc1ccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c(O)c1 ZINC001181575204 1035943356 /nfs/dbraw/zinc/94/33/56/1035943356.db2.gz FTJMNCKZFDQTKV-UHFFFAOYSA-N 1 1 314.404 3.552 20 10 DHCDMO COc1ccc(O)c(C[N@@H+]2CC=C(c3ccc(C)cc3)CC2)c1 ZINC000775644422 1036164323 /nfs/dbraw/zinc/16/43/23/1036164323.db2.gz GGFVVNXUEFRETL-UHFFFAOYSA-N 1 1 309.409 3.999 20 10 DHCDMO CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774120881 1036177344 /nfs/dbraw/zinc/17/73/44/1036177344.db2.gz VXEOZKDJERRPGH-WDEREUQCSA-N 1 1 317.260 3.834 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2[O-])cc1F ZINC000775644531 1036182626 /nfs/dbraw/zinc/18/26/26/1036182626.db2.gz NGBHGXXLQFVONO-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CCc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)[nH]n1 ZINC000774187767 1036213266 /nfs/dbraw/zinc/21/32/66/1036213266.db2.gz HCLLDCAYHIFGOI-QMMMGPOBSA-N 1 1 314.216 3.835 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)[nH]n1 ZINC000774202243 1036222856 /nfs/dbraw/zinc/22/28/56/1036222856.db2.gz QHTRRIXABIHCPJ-MRVPVSSYSA-N 1 1 300.189 3.581 20 10 DHCDMO C[C@@H]([NH2+]CCN1CC[C@@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774212081 1036232571 /nfs/dbraw/zinc/23/25/71/1036232571.db2.gz YGVOZKBSYWWALZ-GHMZBOCLSA-N 1 1 317.260 3.691 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]C2CCC3(CC3)CC2)c1 ZINC000774382879 1036309364 /nfs/dbraw/zinc/30/93/64/1036309364.db2.gz WDJYKSHLUWOCJM-LBPRGKRZSA-N 1 1 303.402 3.552 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)C1CC(OC(C)(C)C)C1 ZINC001182445370 1036310269 /nfs/dbraw/zinc/31/02/69/1036310269.db2.gz YDMHDERLRXOBLS-UHFFFAOYSA-N 1 1 315.816 3.963 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C1CC(OC(C)(C)C)C1 ZINC001182445370 1036310275 /nfs/dbraw/zinc/31/02/75/1036310275.db2.gz YDMHDERLRXOBLS-UHFFFAOYSA-N 1 1 315.816 3.963 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)CCC2=CCCCC2)cc1 ZINC001195788196 1036346877 /nfs/dbraw/zinc/34/68/77/1036346877.db2.gz GACQWAFHUYDZRN-UHFFFAOYSA-N 1 1 302.462 3.954 20 10 DHCDMO Cc1cc(Cl)cc(CN(C)CC[C@H]2CCCC[N@H+]2C)c1O ZINC000775716739 1036525418 /nfs/dbraw/zinc/52/54/18/1036525418.db2.gz MXJXTJMONOJTCJ-MRXNPFEDSA-N 1 1 310.869 3.660 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1C ZINC000029894391 1036555301 /nfs/dbraw/zinc/55/53/01/1036555301.db2.gz UBUVJKFYIVKBAX-LJQANCHMSA-N 1 1 315.388 3.722 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@H](O)c1ccccc1 ZINC001183698726 1036649156 /nfs/dbraw/zinc/64/91/56/1036649156.db2.gz ZBZANWRIUTXYBP-NVXWUHKLSA-N 1 1 323.795 3.787 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC001183919644 1036710390 /nfs/dbraw/zinc/71/03/90/1036710390.db2.gz NMVJBFKVOSJDAI-UHFFFAOYSA-N 1 1 308.356 3.883 20 10 DHCDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000775834722 1036991303 /nfs/dbraw/zinc/99/13/03/1036991303.db2.gz PNYOWHQLEHEPKR-GFCCVEGCSA-N 1 1 317.364 3.651 20 10 DHCDMO COc1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)ccn1 ZINC000762926563 1037070981 /nfs/dbraw/zinc/07/09/81/1037070981.db2.gz TZGVBKDAHSUWKT-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO COc1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)ccn1 ZINC000762926563 1037070999 /nfs/dbraw/zinc/07/09/99/1037070999.db2.gz TZGVBKDAHSUWKT-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO COc1c(O)c(C[N@H+](C)C2CCCCCCC2)ccc1[N+](=O)[O-] ZINC000774869833 1037129666 /nfs/dbraw/zinc/12/96/66/1037129666.db2.gz NMNJPAWGTXMETJ-UHFFFAOYSA-N 1 1 322.405 3.854 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)C2CCCCCCC2)ccc1[N+](=O)[O-] ZINC000774869833 1037129676 /nfs/dbraw/zinc/12/96/76/1037129676.db2.gz NMNJPAWGTXMETJ-UHFFFAOYSA-N 1 1 322.405 3.854 20 10 DHCDMO CC[C@H](C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879608 1037154282 /nfs/dbraw/zinc/15/42/82/1037154282.db2.gz JGTMWLMJSBYCPW-RYUDHWBXSA-N 1 1 322.405 3.708 20 10 DHCDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879608 1037154291 /nfs/dbraw/zinc/15/42/91/1037154291.db2.gz JGTMWLMJSBYCPW-RYUDHWBXSA-N 1 1 322.405 3.708 20 10 DHCDMO CN(CCC[NH2+]Cc1ccc2c(c1)CCCO2)Cc1ccccc1 ZINC001199038486 1037187386 /nfs/dbraw/zinc/18/73/86/1037187386.db2.gz RMXXHODUXRMYFY-UHFFFAOYSA-N 1 1 324.468 3.623 20 10 DHCDMO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902209 1037192374 /nfs/dbraw/zinc/19/23/74/1037192374.db2.gz HLSYJRPCVFOZKF-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902209 1037192384 /nfs/dbraw/zinc/19/23/84/1037192384.db2.gz HLSYJRPCVFOZKF-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001168499728 1037199482 /nfs/dbraw/zinc/19/94/82/1037199482.db2.gz FATFEDRIKCOHTE-OAHLLOKOSA-N 1 1 300.421 3.955 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](OCc3ccccc3)C2)cc1 ZINC001203933592 1037249027 /nfs/dbraw/zinc/24/90/27/1037249027.db2.gz AXPNNUDTTMULNA-HXUWFJFHSA-N 1 1 310.441 3.544 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cccc3cccnc32)c(O)c1 ZINC001203627740 1037259895 /nfs/dbraw/zinc/25/98/95/1037259895.db2.gz MRQRKTNQQSWKRS-UHFFFAOYSA-N 1 1 308.381 3.581 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776015665 1037309609 /nfs/dbraw/zinc/30/96/09/1037309609.db2.gz XBHMRFYVJSAFRX-JQWIXIFHSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1c(O)c(C[NH2+]CCCCC(C)(C)C)ccc1[N+](=O)[O-] ZINC000775016272 1037400970 /nfs/dbraw/zinc/40/09/70/1037400970.db2.gz MDIMXQHHXXAUMM-UHFFFAOYSA-N 1 1 310.394 3.615 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](Cc2cccs2)C2CC2)c1O ZINC000163936525 1038025434 /nfs/dbraw/zinc/02/54/34/1038025434.db2.gz NXEPASMRPLIXLW-UHFFFAOYSA-N 1 1 303.427 3.935 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cccc3cccnc32)cc1 ZINC000055527725 1038185308 /nfs/dbraw/zinc/18/53/08/1038185308.db2.gz LESXZWHVDDNVFL-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000164473033 1038202040 /nfs/dbraw/zinc/20/20/40/1038202040.db2.gz UGHZKGANSSYGIP-UHFFFAOYSA-N 1 1 317.351 3.874 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@H](c3cccs3)C2)c1 ZINC000164504083 1038205597 /nfs/dbraw/zinc/20/55/97/1038205597.db2.gz KNLNDFLZTNEPQT-HNNXBMFYSA-N 1 1 303.427 3.644 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)cn1 ZINC000156776176 1038282621 /nfs/dbraw/zinc/28/26/21/1038282621.db2.gz XJCNTHBKRAFXNU-UHFFFAOYSA-N 1 1 313.445 3.944 20 10 DHCDMO CC(C)[N@@H+](CCCOC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC001190437016 1038316543 /nfs/dbraw/zinc/31/65/43/1038316543.db2.gz QXENSFQWXXWCHY-UHFFFAOYSA-N 1 1 318.383 3.890 20 10 DHCDMO COC[C@H](C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C)C(C)C ZINC001190437281 1038319637 /nfs/dbraw/zinc/31/96/37/1038319637.db2.gz WKYGWTIOVJWOQC-SFHVURJKSA-N 1 1 306.494 3.882 20 10 DHCDMO CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Cl)ccc1[O-] ZINC000775548448 1038704090 /nfs/dbraw/zinc/70/40/90/1038704090.db2.gz RXLLRYDDFXSCPI-OAHLLOKOSA-N 1 1 310.869 3.818 20 10 DHCDMO COc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)n1 ZINC000172536771 1039938181 /nfs/dbraw/zinc/93/81/81/1039938181.db2.gz SWTSZVGBEWUNOY-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)n1 ZINC000172536771 1039938191 /nfs/dbraw/zinc/93/81/91/1039938191.db2.gz SWTSZVGBEWUNOY-UHFFFAOYSA-N 1 1 324.380 3.591 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)Nc1ccccc1 ZINC000174375190 1040624303 /nfs/dbraw/zinc/62/43/03/1040624303.db2.gz FLWQGPPRSGVGFZ-HNNXBMFYSA-N 1 1 312.413 3.631 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccc(OC)c1O ZINC000092705022 185334396 /nfs/dbraw/zinc/33/43/96/185334396.db2.gz NNLQWUUOBGELBV-UHFFFAOYSA-N 1 1 301.386 3.519 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)c(OC(F)F)c1 ZINC000091956604 193132562 /nfs/dbraw/zinc/13/25/62/193132562.db2.gz PMDJPAYWBIVRNH-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)c(Cl)c1OC ZINC000091974687 193134910 /nfs/dbraw/zinc/13/49/10/193134910.db2.gz DKRKVKUMBTXCLD-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cncc(F)c1 ZINC000275168954 130294867 /nfs/dbraw/zinc/29/48/67/130294867.db2.gz WQNUBFRNYCXZMI-UHFFFAOYSA-N 1 1 313.420 3.843 20 10 DHCDMO C[C@H]([NH2+]CC1=CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000286973726 131258823 /nfs/dbraw/zinc/25/88/23/131258823.db2.gz IPXWSGXHXLKDMH-VIFPVBQESA-N 1 1 302.201 3.696 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccc(F)cc1O ZINC000287357705 131276639 /nfs/dbraw/zinc/27/66/39/131276639.db2.gz HCEMMLPNWKIKLR-WBVHZDCISA-N 1 1 307.409 3.921 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1[O-] ZINC000287728641 131297337 /nfs/dbraw/zinc/29/73/37/131297337.db2.gz PAWLVEYWRJGUKS-LRDDRELGSA-N 1 1 321.852 3.928 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](CO)c2ccc(Cl)cc2)c1 ZINC000295046579 335130114 /nfs/dbraw/zinc/13/01/14/335130114.db2.gz NCOBYPCJFKMHLQ-INIZCTEOSA-N 1 1 305.805 3.519 20 10 DHCDMO C[C@H](CCCCO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296281563 335143062 /nfs/dbraw/zinc/14/30/62/335143062.db2.gz FAOJDBGCKCJFAO-ZJUUUORDSA-N 1 1 306.233 3.901 20 10 DHCDMO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)[nH]1 ZINC000277405170 334088290 /nfs/dbraw/zinc/08/82/90/334088290.db2.gz ZDZLYPVFKYSHNM-MWLCHTKSSA-N 1 1 322.840 3.836 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)[C@@H](C)C3(C)CC3)cc2)CC1 ZINC000295079394 334217716 /nfs/dbraw/zinc/21/77/16/334217716.db2.gz RAOAFDQGWLRBSX-INIZCTEOSA-N 1 1 316.489 3.922 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000375256591 337006605 /nfs/dbraw/zinc/00/66/05/337006605.db2.gz SUJQRTGGXMKBLT-QUCCMNQESA-N 1 1 309.409 3.975 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCCn2cc(C)nc21)c1ccc(F)cc1O ZINC000375843560 337021072 /nfs/dbraw/zinc/02/10/72/337021072.db2.gz YBDDBPDVINHUGQ-BBRMVZONSA-N 1 1 317.408 3.655 20 10 DHCDMO COc1cccc(C[N@H+]2CCSC[C@@H]2c2cccs2)c1O ZINC000377251313 337049444 /nfs/dbraw/zinc/04/94/44/337049444.db2.gz PXTPPXHJJBQZSF-CYBMUJFWSA-N 1 1 321.467 3.752 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@H]2c2nccs2)c1 ZINC000377641771 337057178 /nfs/dbraw/zinc/05/71/78/337057178.db2.gz AVBUBJAKGIZWHX-RISCZKNCSA-N 1 1 304.415 3.755 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@@H](O)C[C@@H]1c1cccc(F)c1 ZINC000377695787 337058829 /nfs/dbraw/zinc/05/88/29/337058829.db2.gz IJNLBZSDBITIPL-CGTJXYLNSA-N 1 1 315.388 3.790 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H](c3ncc(C)s3)C2)c1O ZINC000360075872 337084995 /nfs/dbraw/zinc/08/49/95/337084995.db2.gz NXZMXCXAADRUCO-CQSZACIVSA-N 1 1 318.442 3.545 20 10 DHCDMO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cc(F)ccc1O ZINC000186052901 337253217 /nfs/dbraw/zinc/25/32/17/337253217.db2.gz SJQAMOIUCAUPTP-CYBMUJFWSA-N 1 1 323.371 3.839 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1O ZINC000190131106 337285164 /nfs/dbraw/zinc/28/51/64/337285164.db2.gz NWHIOJMYCURTQE-QGZVFWFLSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1O ZINC000190131106 337285165 /nfs/dbraw/zinc/28/51/65/337285165.db2.gz NWHIOJMYCURTQE-QGZVFWFLSA-N 1 1 319.351 3.552 20 10 DHCDMO COc1ccccc1C[N@@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000130172300 524443169 /nfs/dbraw/zinc/44/31/69/524443169.db2.gz AJYLEJNNSHCBLS-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](n2cccn2)C1 ZINC000102393253 526355946 /nfs/dbraw/zinc/35/59/46/526355946.db2.gz QUBXIHOFEANHFZ-INIZCTEOSA-N 1 1 307.397 3.579 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1cccc(Cl)c1[O-] ZINC000287893453 535947072 /nfs/dbraw/zinc/94/70/72/535947072.db2.gz ZDMVIGZUKWNJIZ-HRCADAONSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1cccc(Cl)c1[O-] ZINC000287893453 535947075 /nfs/dbraw/zinc/94/70/75/535947075.db2.gz ZDMVIGZUKWNJIZ-HRCADAONSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nccs1 ZINC000152647854 1033533663 /nfs/dbraw/zinc/53/36/63/1033533663.db2.gz VJVFSHWXDYHTSJ-MRXNPFEDSA-N 1 1 307.438 3.763 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000796828058 1014101745 /nfs/dbraw/zinc/10/17/45/1014101745.db2.gz WGZWQDGYJCVVFS-PKOBYXMFSA-N 1 1 315.388 3.886 20 10 DHCDMO CN1CC[C@]2(C1)CCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474494 1014425913 /nfs/dbraw/zinc/42/59/13/1014425913.db2.gz ODXLFQOQZVIIPL-FQEVSTJZSA-N 1 1 316.489 3.607 20 10 DHCDMO CN1CC[C@]2(C1)CCC[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474494 1014425919 /nfs/dbraw/zinc/42/59/19/1014425919.db2.gz ODXLFQOQZVIIPL-FQEVSTJZSA-N 1 1 316.489 3.607 20 10 DHCDMO C[N@@H+](CC[C@H]1CCOC1)Cc1ccc(N2CCCCC2)cc1 ZINC000783498982 1014544926 /nfs/dbraw/zinc/54/49/26/1014544926.db2.gz ZDNYRMIZPWZDST-SFHVURJKSA-N 1 1 302.462 3.535 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC[C@@H]1O ZINC000276041770 1014589039 /nfs/dbraw/zinc/58/90/39/1014589039.db2.gz SSTNCQRYUSFSBV-IBGZPJMESA-N 1 1 311.425 3.652 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1CCCCO1 ZINC000070975725 1014815413 /nfs/dbraw/zinc/81/54/13/1014815413.db2.gz KAXMRJYRLQCRHG-INIZCTEOSA-N 1 1 301.386 3.557 20 10 DHCDMO Cc1nc(C(C)(C)[NH2+]Cc2ccc(N(C)C)c(F)c2)sc1C ZINC000076904542 1015153901 /nfs/dbraw/zinc/15/39/01/1015153901.db2.gz PHRGWEYYQIVUAB-UHFFFAOYSA-N 1 1 321.465 3.990 20 10 DHCDMO COc1cc(C)cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000895460352 1015163341 /nfs/dbraw/zinc/16/33/41/1015163341.db2.gz MJCUZOYSXPFWOT-HNNXBMFYSA-N 1 1 307.340 3.649 20 10 DHCDMO Cc1csc(C[C@H]2CCC[N@@H+](Cc3ccccc3O)C2)n1 ZINC000895824267 1015319945 /nfs/dbraw/zinc/31/99/45/1015319945.db2.gz YTXURCHXZMWJHB-CQSZACIVSA-N 1 1 302.443 3.612 20 10 DHCDMO CN(C)CC[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1O ZINC001140461222 1015430364 /nfs/dbraw/zinc/43/03/64/1015430364.db2.gz HKMUKJOLMZJAAH-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO CN(C)CC[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1O ZINC001140461222 1015430369 /nfs/dbraw/zinc/43/03/69/1015430369.db2.gz HKMUKJOLMZJAAH-UHFFFAOYSA-N 1 1 318.848 3.609 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]C[C@H](C(C)C)N2CCCC2)cc1 ZINC000320246196 1015468165 /nfs/dbraw/zinc/46/81/65/1015468165.db2.gz ZHRPBUUHLFQNHU-HXUWFJFHSA-N 1 1 317.521 3.743 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896228880 1015514413 /nfs/dbraw/zinc/51/44/13/1015514413.db2.gz VKEBVUQTQZOMGU-LBPRGKRZSA-N 1 1 323.717 3.912 20 10 DHCDMO C[C@@H](CCc1n[nH]c2ccccc21)[NH2+]Cc1c(O)cccc1F ZINC000896637915 1015693386 /nfs/dbraw/zinc/69/33/86/1015693386.db2.gz RHKMJHOBFFYIRH-LBPRGKRZSA-N 1 1 313.376 3.519 20 10 DHCDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)c(O)c1OC ZINC000891950091 1015784492 /nfs/dbraw/zinc/78/44/92/1015784492.db2.gz FQWHXWIISYEGRG-CYBMUJFWSA-N 1 1 313.397 3.529 20 10 DHCDMO Cc1ccccc1C[NH+]1CCN(Cc2cc(C)c(C)cc2O)CC1 ZINC000022815139 1016061125 /nfs/dbraw/zinc/06/11/25/1016061125.db2.gz MDDOQKUYUHPROZ-UHFFFAOYSA-N 1 1 324.468 3.635 20 10 DHCDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c(O)c1OC ZINC000892036764 1016141211 /nfs/dbraw/zinc/14/12/11/1016141211.db2.gz QADKMFAKQUHHSP-NFAWXSAZSA-N 1 1 305.418 3.562 20 10 DHCDMO C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1[O-] ZINC000185033851 1016524714 /nfs/dbraw/zinc/52/47/14/1016524714.db2.gz SFEYHNRYNCQKNB-CABCVRRESA-N 1 1 308.441 3.837 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(F)cc1O ZINC000185079817 1016545241 /nfs/dbraw/zinc/54/52/41/1016545241.db2.gz NOOYOSDGMFYIIX-SJCJKPOMSA-N 1 1 320.383 3.624 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)cc1 ZINC000281850034 1016761961 /nfs/dbraw/zinc/76/19/61/1016761961.db2.gz YHNQEEWCYLUWGI-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000294792428 1032156112 /nfs/dbraw/zinc/15/61/12/1032156112.db2.gz VHPXJGVZPMFYEE-OAHLLOKOSA-N 1 1 313.800 3.624 20 10 DHCDMO Cc1sccc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000294859262 1032186341 /nfs/dbraw/zinc/18/63/41/1032186341.db2.gz JHNRFJYKRLJSPB-UHFFFAOYSA-N 1 1 316.470 3.525 20 10 DHCDMO CCC[N@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1O ZINC000294883003 1032191472 /nfs/dbraw/zinc/19/14/72/1032191472.db2.gz FQKWTPMVEAZWGJ-UHFFFAOYSA-N 1 1 305.447 3.779 20 10 DHCDMO CCC[N@@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1O ZINC000294883003 1032191484 /nfs/dbraw/zinc/19/14/84/1032191484.db2.gz FQKWTPMVEAZWGJ-UHFFFAOYSA-N 1 1 305.447 3.779 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@@H]2Cn2ccnc2C(C)C)c1O ZINC000362042825 1032206160 /nfs/dbraw/zinc/20/61/60/1032206160.db2.gz CQDCLZWJEINAIH-QGZVFWFLSA-N 1 1 313.445 3.685 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCSC[C@@H]2C2CCC2)cc1 ZINC001171343931 1032493346 /nfs/dbraw/zinc/49/33/46/1032493346.db2.gz MOIYDVMVNUXLNH-GOSISDBHSA-N 1 1 304.503 3.860 20 10 DHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2cc(Cl)ccc2O)c1C ZINC000877664190 1033402062 /nfs/dbraw/zinc/40/20/62/1033402062.db2.gz MKBJOALJFWXYOW-UHFFFAOYSA-N 1 1 307.825 3.511 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)cc1 ZINC000773135301 1032568993 /nfs/dbraw/zinc/56/89/93/1032568993.db2.gz COGVFAIKZFPSCP-KBPBESRZSA-N 1 1 315.465 3.796 20 10 DHCDMO CC(C)Nc1cc[nH+]c(NCc2cc3ccccc3cc2O)n1 ZINC001171399029 1032582926 /nfs/dbraw/zinc/58/29/26/1032582926.db2.gz ZMQKKXGSLYNVIC-UHFFFAOYSA-N 1 1 308.385 3.768 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c(Cl)c1 ZINC000840921527 1017483892 /nfs/dbraw/zinc/48/38/92/1017483892.db2.gz VEVKZOLFICSJRA-KBPBESRZSA-N 1 1 309.837 3.603 20 10 DHCDMO C[C@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccc(F)cc1O ZINC000186033720 1017649128 /nfs/dbraw/zinc/64/91/28/1017649128.db2.gz VUDUEWSHCKTWRL-NSHDSACASA-N 1 1 320.433 3.760 20 10 DHCDMO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795565 1018325155 /nfs/dbraw/zinc/32/51/55/1018325155.db2.gz BALSMSSJHYCCGY-IRXDYDNUSA-N 1 1 303.494 3.524 20 10 DHCDMO CC(C)[N@H+]1CCC[C@@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795565 1018325165 /nfs/dbraw/zinc/32/51/65/1018325165.db2.gz BALSMSSJHYCCGY-IRXDYDNUSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000278367471 1018619932 /nfs/dbraw/zinc/61/99/32/1018619932.db2.gz BXDLISQLTRXBSK-KXUCPTDWSA-N 1 1 304.217 3.917 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(N2CCCCC2)cc1 ZINC000765449462 1018790091 /nfs/dbraw/zinc/79/00/91/1018790091.db2.gz KZEMOCOPFMSKCY-DLBZAZTESA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451085 1018790276 /nfs/dbraw/zinc/79/02/76/1018790276.db2.gz SMRUGJXDKBDXGG-JKSUJKDBSA-N 1 1 321.484 3.807 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765451085 1018790291 /nfs/dbraw/zinc/79/02/91/1018790291.db2.gz SMRUGJXDKBDXGG-JKSUJKDBSA-N 1 1 321.484 3.807 20 10 DHCDMO c1csc(SC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC000278577564 1018861704 /nfs/dbraw/zinc/86/17/04/1018861704.db2.gz OLLSUQMVIRKZHF-OAHLLOKOSA-N 1 1 320.483 3.526 20 10 DHCDMO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc(F)cc1O ZINC000842923593 1018921457 /nfs/dbraw/zinc/92/14/57/1018921457.db2.gz INRLHUZJAQRBJA-IAGOWNOFSA-N 1 1 321.367 3.835 20 10 DHCDMO CCOCc1cc(C[NH2+]C(C)(C)c2nccs2)ccc1OC ZINC000172078652 1018971495 /nfs/dbraw/zinc/97/14/95/1018971495.db2.gz JNFQSPQNYAFQKW-UHFFFAOYSA-N 1 1 320.458 3.713 20 10 DHCDMO CC(C)[N@H+](C)CCN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765625337 1019012234 /nfs/dbraw/zinc/01/22/34/1019012234.db2.gz XHIGNICDKUQGFR-INIZCTEOSA-N 1 1 321.484 3.807 20 10 DHCDMO CC(C)[N@@H+](C)CCN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000765625337 1019012248 /nfs/dbraw/zinc/01/22/48/1019012248.db2.gz XHIGNICDKUQGFR-INIZCTEOSA-N 1 1 321.484 3.807 20 10 DHCDMO Cc1cnc(Cl)c(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000921624856 1019293290 /nfs/dbraw/zinc/29/32/90/1019293290.db2.gz VVUHFKMHYPCGEE-UHFFFAOYSA-N 1 1 307.800 3.538 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1ccc(F)cc1O ZINC000170788880 1019435356 /nfs/dbraw/zinc/43/53/56/1019435356.db2.gz YMZGSZXGCSCMAD-BBRMVZONSA-N 1 1 318.392 3.612 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)cc1C ZINC000727432103 1019714015 /nfs/dbraw/zinc/71/40/15/1019714015.db2.gz ZWGJIADZDHOLNW-OXQOHEQNSA-N 1 1 311.425 3.971 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+](CC1CC1)C1CCCCC1)OCO2 ZINC000727825249 1019821159 /nfs/dbraw/zinc/82/11/59/1019821159.db2.gz ONTBESYFKGAJBS-UHFFFAOYSA-N 1 1 303.402 3.666 20 10 DHCDMO CN(C)c1ccc(C[NH2+][C@H]2CCCc3scnc32)cc1F ZINC000858357732 1032860755 /nfs/dbraw/zinc/86/07/55/1032860755.db2.gz KGUYVNOUXMEMDH-ZDUSSCGKSA-N 1 1 305.422 3.515 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000129913408 1032862476 /nfs/dbraw/zinc/86/24/76/1032862476.db2.gz TUHMNSUVNDXGFT-GOSISDBHSA-N 1 1 314.473 3.678 20 10 DHCDMO FC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccc(F)cc1 ZINC000922319144 1019996178 /nfs/dbraw/zinc/99/61/78/1019996178.db2.gz YWNUUAHTECZYED-KRWDZBQOSA-N 1 1 303.352 3.951 20 10 DHCDMO CN(CC[N@@H+](C)Cc1c(O)ccc2ccncc21)c1ccccc1 ZINC000730804776 1020030442 /nfs/dbraw/zinc/03/04/42/1020030442.db2.gz ZTMZZVYAWQBYHT-UHFFFAOYSA-N 1 1 321.424 3.509 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](c2ncccn2)C2CC2)cc1 ZINC000922583233 1020143414 /nfs/dbraw/zinc/14/34/14/1020143414.db2.gz RXJCXXHKBDIHMP-GOSISDBHSA-N 1 1 310.445 3.564 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CCC(C)([NH3+])CC2)cc1 ZINC000843104947 1020325184 /nfs/dbraw/zinc/32/51/84/1020325184.db2.gz NUJZBVUUHJYWTL-UHFFFAOYSA-N 1 1 303.494 3.626 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000179849760 1020503390 /nfs/dbraw/zinc/50/33/90/1020503390.db2.gz LAGPRHITZAQAFK-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000179849760 1020503394 /nfs/dbraw/zinc/50/33/94/1020503394.db2.gz LAGPRHITZAQAFK-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(F)cc2O)nc1 ZINC000858487598 1032919029 /nfs/dbraw/zinc/91/90/29/1032919029.db2.gz CUYFQCBOIPQYKZ-CYBMUJFWSA-N 1 1 302.393 3.863 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000738158584 1020863079 /nfs/dbraw/zinc/86/30/79/1020863079.db2.gz MTZFEZFPCKJUJX-MRXNPFEDSA-N 1 1 307.397 3.579 20 10 DHCDMO Cc1cc([C@@H](C)[NH2+]Cc2cc(C)n(-c3ccccc3)c2C)nn1C ZINC000858543724 1032940191 /nfs/dbraw/zinc/94/01/91/1032940191.db2.gz VVQXPOSLOYHRRV-MRXNPFEDSA-N 1 1 322.456 3.987 20 10 DHCDMO COC(=O)c1cc2ccccc2c(C[N@H+]2C[C@@H](C)C[C@H]2C)c1O ZINC000740859204 1020954798 /nfs/dbraw/zinc/95/47/98/1020954798.db2.gz JHRQIDJWSYWAEU-QWHCGFSZSA-N 1 1 313.397 3.562 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1(C)C ZINC000740863624 1020956548 /nfs/dbraw/zinc/95/65/48/1020956548.db2.gz VMNBLDQLJOGMBZ-ZWKOTPCHSA-N 1 1 303.446 3.516 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@@H](N(C)C)[C@@H]2C)ccc1N1CCCCC1 ZINC001171942400 1032947714 /nfs/dbraw/zinc/94/77/14/1032947714.db2.gz IKHOENBYLOZJTQ-FXAWDEMLSA-N 1 1 315.505 3.510 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](N(C)C)[C@@H]2C)ccc1N1CCCCC1 ZINC001171942400 1032947721 /nfs/dbraw/zinc/94/77/21/1032947721.db2.gz IKHOENBYLOZJTQ-FXAWDEMLSA-N 1 1 315.505 3.510 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000154293533 1021196872 /nfs/dbraw/zinc/19/68/72/1021196872.db2.gz LCYQKCNMOLLVJO-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc2c(cc1O)OCO2 ZINC000917462086 1021269648 /nfs/dbraw/zinc/26/96/48/1021269648.db2.gz FHRNNSRPOIVBIZ-UHFFFAOYSA-N 1 1 319.788 3.796 20 10 DHCDMO C[N@@H+](CCCCc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000917477611 1021270336 /nfs/dbraw/zinc/27/03/36/1021270336.db2.gz WJDCUXUGSLUXJE-UHFFFAOYSA-N 1 1 313.397 3.576 20 10 DHCDMO Cc1cc(C[N@H+]2CCC(=O)[C@@H](F)CC2)c(C)n1-c1ccccc1 ZINC001137854123 1021283977 /nfs/dbraw/zinc/28/39/77/1021283977.db2.gz JHZOVRFQFKJYLD-SFHVURJKSA-N 1 1 314.404 3.597 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](F)CC2)c(C)n1-c1ccccc1 ZINC001137854123 1021283986 /nfs/dbraw/zinc/28/39/86/1021283986.db2.gz JHZOVRFQFKJYLD-SFHVURJKSA-N 1 1 314.404 3.597 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccncc1Cl ZINC000743839843 1021375937 /nfs/dbraw/zinc/37/59/37/1021375937.db2.gz DMJAYOBVCBUDJI-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccncc1Cl ZINC000743839843 1021375955 /nfs/dbraw/zinc/37/59/55/1021375955.db2.gz DMJAYOBVCBUDJI-UHFFFAOYSA-N 1 1 303.837 3.823 20 10 DHCDMO CCC[N@H+](Cc1nc(C2CCCC2)no1)Cc1ccccc1O ZINC000154713964 1021508773 /nfs/dbraw/zinc/50/87/73/1021508773.db2.gz RWTIJUWZUUPVGR-UHFFFAOYSA-N 1 1 315.417 3.845 20 10 DHCDMO CCC[N@@H+](Cc1nc(C2CCCC2)no1)Cc1ccccc1O ZINC000154713964 1021508778 /nfs/dbraw/zinc/50/87/78/1021508778.db2.gz RWTIJUWZUUPVGR-UHFFFAOYSA-N 1 1 315.417 3.845 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2nccn2C)c(C)n1-c1cccc(C)c1 ZINC000850409930 1021517313 /nfs/dbraw/zinc/51/73/13/1021517313.db2.gz CWYSEUFFFXUSPA-MRXNPFEDSA-N 1 1 322.456 3.987 20 10 DHCDMO CCc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(O)c(C(C)(C)C)c1 ZINC000744436751 1021539228 /nfs/dbraw/zinc/53/92/28/1021539228.db2.gz SRTGEZRDXUXHMH-IYBDPMFKSA-N 1 1 303.446 3.615 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1ccc(F)cc1O ZINC000850524612 1021577226 /nfs/dbraw/zinc/57/72/26/1021577226.db2.gz CTKWKGRABVJHTC-BQFCYCMXSA-N 1 1 301.361 3.750 20 10 DHCDMO C[C@@H](N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537871 1021591721 /nfs/dbraw/zinc/59/17/21/1021591721.db2.gz ASYDIFTXLGSBTN-HIFRSBDPSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537871 1021591730 /nfs/dbraw/zinc/59/17/30/1021591730.db2.gz ASYDIFTXLGSBTN-HIFRSBDPSA-N 1 1 306.425 3.589 20 10 DHCDMO CO[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237085077 1021670068 /nfs/dbraw/zinc/67/00/68/1021670068.db2.gz UWVMWIZFHVECDJ-SNVBAGLBSA-N 1 1 304.217 3.700 20 10 DHCDMO CO[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237085077 1021670073 /nfs/dbraw/zinc/67/00/73/1021670073.db2.gz UWVMWIZFHVECDJ-SNVBAGLBSA-N 1 1 304.217 3.700 20 10 DHCDMO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@@H+](C)Cc1ccccc1O ZINC000109770818 1021745905 /nfs/dbraw/zinc/74/59/05/1021745905.db2.gz AXCXRONJFAVRIK-GFCCVEGCSA-N 1 1 318.804 3.505 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1Br ZINC000109768873 1021746241 /nfs/dbraw/zinc/74/62/41/1021746241.db2.gz OHEBREDCFYIHNC-UHFFFAOYSA-N 1 1 306.203 3.787 20 10 DHCDMO C[N@@H+](Cc1csc(Br)c1)Cc1ccccc1O ZINC000109773743 1021748054 /nfs/dbraw/zinc/74/80/54/1021748054.db2.gz PPIRSDIWELTUQS-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc(C)nc(C)n2)cc1 ZINC000851717281 1021972592 /nfs/dbraw/zinc/97/25/92/1021972592.db2.gz VRAXBAYXECXRTO-UHFFFAOYSA-N 1 1 312.461 3.572 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2cc(OC)ns2)cc1 ZINC000851716642 1021973206 /nfs/dbraw/zinc/97/32/06/1021973206.db2.gz OQHHZXDFNMYVCE-UHFFFAOYSA-N 1 1 319.474 3.630 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc(OC)ns2)cc1 ZINC000851716642 1021973212 /nfs/dbraw/zinc/97/32/12/1021973212.db2.gz OQHHZXDFNMYVCE-UHFFFAOYSA-N 1 1 319.474 3.630 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(F)ccc1OC(F)F ZINC000851840585 1022019593 /nfs/dbraw/zinc/01/95/93/1022019593.db2.gz HYHAAEIBMPUXEW-UHFFFAOYSA-N 1 1 311.303 3.765 20 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SKMZJJMXZBJTCV-UHFFFAOYSA-N 1 1 302.443 3.532 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2CC(=O)c2ccccc2)c1O ZINC000180459971 1022143299 /nfs/dbraw/zinc/14/32/99/1022143299.db2.gz XXXVPOUFJJHYMI-SFHVURJKSA-N 1 1 309.409 3.938 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1 ZINC000852598559 1022147690 /nfs/dbraw/zinc/14/76/90/1022147690.db2.gz XCEMFYYLCQKUHP-MJGOQNOKSA-N 1 1 302.462 3.534 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1 ZINC000852598556 1022148043 /nfs/dbraw/zinc/14/80/43/1022148043.db2.gz XCEMFYYLCQKUHP-HKUYNNGSSA-N 1 1 302.462 3.534 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H](CCF)C2)c1 ZINC000853565024 1022294928 /nfs/dbraw/zinc/29/49/28/1022294928.db2.gz YMTBGPRAAZPXIN-ZDUSSCGKSA-N 1 1 309.425 3.967 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@](C)(C(F)F)C2)cc1C(C)C ZINC000853632020 1022301692 /nfs/dbraw/zinc/30/16/92/1022301692.db2.gz BCUYUMZFQNUKRM-QGZVFWFLSA-N 1 1 313.388 3.680 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@](C)(C(F)F)C2)cc1C(C)C ZINC000853632020 1022301707 /nfs/dbraw/zinc/30/17/07/1022301707.db2.gz BCUYUMZFQNUKRM-QGZVFWFLSA-N 1 1 313.388 3.680 20 10 DHCDMO Cc1ccc([C@@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c(O)c1C ZINC000854221913 1022434167 /nfs/dbraw/zinc/43/41/67/1022434167.db2.gz BXHWEVMEOOKUPK-NSISKUIASA-N 1 1 324.468 3.805 20 10 DHCDMO CC(C)[C@H](C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000179496110 1022455072 /nfs/dbraw/zinc/45/50/72/1022455072.db2.gz ZHJOEMZRPAOAPE-INIZCTEOSA-N 1 1 302.462 3.532 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000179683256 1022509610 /nfs/dbraw/zinc/50/96/10/1022509610.db2.gz OHBQKBOOSRINAA-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1O ZINC000179695356 1022511417 /nfs/dbraw/zinc/51/14/17/1022511417.db2.gz OHLCYYAOXCCUEL-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(F)c1 ZINC000859081724 1033065480 /nfs/dbraw/zinc/06/54/80/1033065480.db2.gz ITUYQODAEUEQGO-UHFFFAOYSA-N 1 1 301.409 3.697 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876545743 1033086270 /nfs/dbraw/zinc/08/62/70/1033086270.db2.gz NEWNHTWANLRIRV-KRWDZBQOSA-N 1 1 324.468 3.841 20 10 DHCDMO Cc1noc(C)c1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000798181155 1022876436 /nfs/dbraw/zinc/87/64/36/1022876436.db2.gz QRRRVILEGFUJSA-MRVPVSSYSA-N 1 1 314.307 3.867 20 10 DHCDMO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768171652 1022910612 /nfs/dbraw/zinc/91/06/12/1022910612.db2.gz FXMDYRJYLTUPOA-WMZOPIPTSA-N 1 1 302.462 3.676 20 10 DHCDMO C[N@H+](Cc1ccc(F)cc1)Cc1cccc(Br)c1O ZINC000768175537 1022913660 /nfs/dbraw/zinc/91/36/60/1022913660.db2.gz SWBXOMCQWKRHIY-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1cccc(Br)c1O ZINC000768175537 1022913667 /nfs/dbraw/zinc/91/36/67/1022913667.db2.gz SWBXOMCQWKRHIY-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO CCc1ncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)s1 ZINC000768256291 1022933562 /nfs/dbraw/zinc/93/35/62/1022933562.db2.gz AVXCTBXHJHKBCH-UHFFFAOYSA-N 1 1 315.486 3.936 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000768257564 1022934267 /nfs/dbraw/zinc/93/42/67/1022934267.db2.gz MXBZXTTVWSOKCZ-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO CCC(CC)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000768258907 1022936154 /nfs/dbraw/zinc/93/61/54/1022936154.db2.gz YQTXKKYMGMDTQY-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO CCC1CCC([N@@H+](C)Cc2cc(OC)c(OC)cc2O)CC1 ZINC000768440087 1022966117 /nfs/dbraw/zinc/96/61/17/1022966117.db2.gz NSQLMGVMIHMJKA-UHFFFAOYSA-N 1 1 307.434 3.810 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)CCC2CCCCC2)cc1OC ZINC000768445929 1022968486 /nfs/dbraw/zinc/96/84/86/1022968486.db2.gz WBCXDKAXELUBNA-UHFFFAOYSA-N 1 1 307.434 3.812 20 10 DHCDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768465748 1022971897 /nfs/dbraw/zinc/97/18/97/1022971897.db2.gz KFHZWGVEDIXTPE-ZFWWWQNUSA-N 1 1 307.434 3.810 20 10 DHCDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(C)cc2O)C1 ZINC000768465367 1022973609 /nfs/dbraw/zinc/97/36/09/1022973609.db2.gz HJTARZOGVHTBBI-HUUCEWRRSA-N 1 1 309.475 3.815 20 10 DHCDMO CCC[N@@H+](CCc1cccs1)Cc1cc(OC)ccc1O ZINC000768522990 1022981096 /nfs/dbraw/zinc/98/10/96/1022981096.db2.gz AXGPFDXQYAFQIN-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)c(F)c2)on1 ZINC000768879144 1023046301 /nfs/dbraw/zinc/04/63/01/1023046301.db2.gz SKRMSAXSDTWYNT-MRXNPFEDSA-N 1 1 303.381 3.525 20 10 DHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(F)c2)on1 ZINC000768879144 1023046312 /nfs/dbraw/zinc/04/63/12/1023046312.db2.gz SKRMSAXSDTWYNT-MRXNPFEDSA-N 1 1 303.381 3.525 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)CCc2ccc(F)cc2)c1 ZINC000768921224 1023057162 /nfs/dbraw/zinc/05/71/62/1023057162.db2.gz PBIOTAHGEPHLNA-UHFFFAOYSA-N 1 1 303.377 3.605 20 10 DHCDMO CCc1nc([C@H](C)[NH2+]Cc2cc(F)cc(C(C)=O)c2O)cs1 ZINC000184718454 1023084261 /nfs/dbraw/zinc/08/42/61/1023084261.db2.gz ZPVMRYITWJGOCJ-VIFPVBQESA-N 1 1 322.405 3.604 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1C ZINC000769232830 1023103530 /nfs/dbraw/zinc/10/35/30/1023103530.db2.gz NQUHCFBWNHIDSV-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000769234479 1023105786 /nfs/dbraw/zinc/10/57/86/1023105786.db2.gz SZHBDAFOGFCRGQ-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1 ZINC000769244332 1023107725 /nfs/dbraw/zinc/10/77/25/1023107725.db2.gz NGGOEGFIXZGBKN-NHCUHLMSSA-N 1 1 324.468 3.841 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000769246316 1023107785 /nfs/dbraw/zinc/10/77/85/1023107785.db2.gz ZMPMLEWADLMCAG-CQSZACIVSA-N 1 1 310.235 3.919 20 10 DHCDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769312413 1023119453 /nfs/dbraw/zinc/11/94/53/1023119453.db2.gz LXCTXJBPFDITCW-SFHVURJKSA-N 1 1 320.452 3.673 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2Cc2ccccc2C)c1O ZINC000769317970 1023120722 /nfs/dbraw/zinc/12/07/22/1023120722.db2.gz CXTQEIGFBOLCPL-SFHVURJKSA-N 1 1 311.425 3.916 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1O ZINC000769379228 1023136447 /nfs/dbraw/zinc/13/64/47/1023136447.db2.gz LHUKSGBIDYBCLM-AWEZNQCLSA-N 1 1 315.388 3.920 20 10 DHCDMO CCn1cc(C[N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)cn1 ZINC000769427614 1023146464 /nfs/dbraw/zinc/14/64/64/1023146464.db2.gz NEUXNFWWPTXAIA-UHFFFAOYSA-N 1 1 321.424 3.908 20 10 DHCDMO CC[N@H+](Cc1cc(C)c(C)cc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000769484387 1023152677 /nfs/dbraw/zinc/15/26/77/1023152677.db2.gz UNMTVXQQNCTPDY-HXUWFJFHSA-N 1 1 313.441 3.873 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)CC1(O)CCCC1 ZINC000769448456 1023155623 /nfs/dbraw/zinc/15/56/23/1023155623.db2.gz RJYWEEZAIHRPAN-UHFFFAOYSA-N 1 1 311.425 3.796 20 10 DHCDMO CC[C@@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000769463928 1023159117 /nfs/dbraw/zinc/15/91/17/1023159117.db2.gz SZSDEERWJCPMTI-QGZVFWFLSA-N 1 1 302.462 3.535 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000769493008 1023165954 /nfs/dbraw/zinc/16/59/54/1023165954.db2.gz QDTYFOYHLFZQRB-MRXNPFEDSA-N 1 1 309.837 3.969 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000769502888 1023168799 /nfs/dbraw/zinc/16/87/99/1023168799.db2.gz DTWIKMXFBABZMX-IBGZPJMESA-N 1 1 309.457 3.829 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCOC3(C2)CCCCCC3)c(O)c1 ZINC000769515403 1023172241 /nfs/dbraw/zinc/17/22/41/1023172241.db2.gz RJZMLDJELOHWAN-UHFFFAOYSA-N 1 1 319.445 3.716 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H](CO)C(C)(C)C ZINC000769533855 1023173991 /nfs/dbraw/zinc/17/39/91/1023173991.db2.gz QHFVTBYSVSNQSX-LJQANCHMSA-N 1 1 313.441 3.898 20 10 DHCDMO Cc1ccc2c(c1)nc(C[NH2+]Cc1c(O)cccc1Cl)n2C ZINC000769554928 1023179459 /nfs/dbraw/zinc/17/94/59/1023179459.db2.gz GCPJPKWWCAWHBZ-UHFFFAOYSA-N 1 1 315.804 3.531 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C2CC(C)(C)N(O)C(C)(C)C2)cc1 ZINC001170009091 1023192629 /nfs/dbraw/zinc/19/26/29/1023192629.db2.gz MFOKTDNYJDKKKU-UHFFFAOYSA-N 1 1 319.493 3.595 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)cc1 ZINC000770305315 1023294423 /nfs/dbraw/zinc/29/44/23/1023294423.db2.gz SJYFTUQVFDLPMS-OAQYLSRUSA-N 1 1 324.468 3.586 20 10 DHCDMO Cc1ccc(C)c([C@@H]2C[N@@H+](Cc3ccccc3O)[C@@H](C)CO2)c1 ZINC000770506156 1023316050 /nfs/dbraw/zinc/31/60/50/1023316050.db2.gz VTTXOYCJTWBZPQ-JXFKEZNVSA-N 1 1 311.425 3.971 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CCCC3(CC3)C2)c1O ZINC000770677971 1023337083 /nfs/dbraw/zinc/33/70/83/1023337083.db2.gz XFAQDOHYMXCXNW-UHFFFAOYSA-N 1 1 310.235 3.839 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)c1O ZINC000785989095 1023648969 /nfs/dbraw/zinc/64/89/69/1023648969.db2.gz QUSUCOHOGMDVAW-UHFFFAOYSA-N 1 1 319.445 3.715 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2scnc2C2CC2)cc1 ZINC000787040957 1023752860 /nfs/dbraw/zinc/75/28/60/1023752860.db2.gz LLUKTKLUOVYIHQ-UHFFFAOYSA-N 1 1 301.459 3.719 20 10 DHCDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000093558526 1023773954 /nfs/dbraw/zinc/77/39/54/1023773954.db2.gz QBXPNAXBVSKBRY-SNVBAGLBSA-N 1 1 318.280 3.728 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1ccc(F)cc1O ZINC000796703407 1023856198 /nfs/dbraw/zinc/85/61/98/1023856198.db2.gz UMAALJQJOMPTIG-SJLPKXTDSA-N 1 1 303.377 3.614 20 10 DHCDMO C[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000788600899 1023911884 /nfs/dbraw/zinc/91/18/84/1023911884.db2.gz FHQYPHYBACQHPH-WDEREUQCSA-N 1 1 319.367 3.859 20 10 DHCDMO Cc1ccc(CN[C@H](C[NH+]2CCCC2)c2ccccc2)c(O)c1 ZINC000876880498 1033176081 /nfs/dbraw/zinc/17/60/81/1033176081.db2.gz JXOUMMDIILVVCO-LJQANCHMSA-N 1 1 310.441 3.627 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1)OCO2 ZINC000026237672 1024177072 /nfs/dbraw/zinc/17/70/72/1024177072.db2.gz CVKSXJNUXNATMF-HNNXBMFYSA-N 1 1 315.344 3.597 20 10 DHCDMO CC(C)c1nc(CC[NH2+]Cc2cc(F)cc(F)c2O)cs1 ZINC000882958744 1024189264 /nfs/dbraw/zinc/18/92/64/1024189264.db2.gz JFIYADJARRJYDO-UHFFFAOYSA-N 1 1 312.385 3.583 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CSc2ccccc21 ZINC000883131734 1024253903 /nfs/dbraw/zinc/25/39/03/1024253903.db2.gz PYFKZYLCGFRSBR-NSHDSACASA-N 1 1 307.365 3.650 20 10 DHCDMO CCCC1CCC([N@@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)CC1 ZINC000790480958 1024310772 /nfs/dbraw/zinc/31/07/72/1024310772.db2.gz OEMVNGRSZCFZGU-RWKZGTHUSA-N 1 1 319.445 3.609 20 10 DHCDMO CCCC1CCC([N@@H+](C)Cc2cc3c(cc2O)OC[C@H]3O)CC1 ZINC000790480957 1024312686 /nfs/dbraw/zinc/31/26/86/1024312686.db2.gz OEMVNGRSZCFZGU-LEHRNKBSSA-N 1 1 319.445 3.609 20 10 DHCDMO CO[C@H]1C[C@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000883272057 1024342643 /nfs/dbraw/zinc/34/26/43/1024342643.db2.gz CGTHWECXWOSQOW-OPRDCNLKSA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@H](Cn1cccn1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278893479 1024355575 /nfs/dbraw/zinc/35/55/75/1024355575.db2.gz YTQCXBBKJLKHQW-ZJUUUORDSA-N 1 1 314.216 3.635 20 10 DHCDMO COc1ccc(CNC[C@]2([NH+](C)C)CCC[C@@H](C)C2)cc1C ZINC000314856906 1024387354 /nfs/dbraw/zinc/38/73/54/1024387354.db2.gz DAGSWWADEAYDCK-BEFAXECRSA-N 1 1 304.478 3.604 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc2c(c1)COC2 ZINC000790977353 1024421979 /nfs/dbraw/zinc/42/19/79/1024421979.db2.gz IOABTNNNSYUUBA-UHFFFAOYSA-N 1 1 307.752 3.505 20 10 DHCDMO CCc1[nH+]ccn1CC(=O)c1cc(C)n(-c2ccccc2)c1C ZINC000756927098 1024441147 /nfs/dbraw/zinc/44/11/47/1024441147.db2.gz NCQSZWZDWZIHET-UHFFFAOYSA-N 1 1 307.397 3.736 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cscn2)cc1F ZINC000271146051 1024462190 /nfs/dbraw/zinc/46/21/90/1024462190.db2.gz PLABGIKTAQIYOP-LBPRGKRZSA-N 1 1 307.438 3.979 20 10 DHCDMO CC(C)[C@H]([NH3+])CC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000133399847 1024633222 /nfs/dbraw/zinc/63/32/22/1024633222.db2.gz BHBQZBYYCICOPA-CYBMUJFWSA-N 1 1 305.249 3.504 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](CC)C(=O)OC(C)(C)C ZINC000792233607 1024650433 /nfs/dbraw/zinc/65/04/33/1024650433.db2.gz REAPDXKDXKXEAG-HNNXBMFYSA-N 1 1 307.434 3.725 20 10 DHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1ccc(C)cc1 ZINC000760179400 1024698644 /nfs/dbraw/zinc/69/86/44/1024698644.db2.gz LXGMADYBIWDNMU-UHFFFAOYSA-N 1 1 307.397 3.790 20 10 DHCDMO CC[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001170225030 1024711725 /nfs/dbraw/zinc/71/17/25/1024711725.db2.gz WVWXXJBNONHNAR-RTBURBONSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[C@@H]([NH2+]CCCOCC(F)(F)F)c1ccc(F)cc1O ZINC000796698304 1024904348 /nfs/dbraw/zinc/90/43/48/1024904348.db2.gz XIFXEAMXGSUINX-GFCCVEGCSA-N 1 1 309.303 3.541 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1O ZINC000793573485 1025126360 /nfs/dbraw/zinc/12/63/60/1025126360.db2.gz OOKYRQVUCXUGBS-GOSISDBHSA-N 1 1 312.413 3.687 20 10 DHCDMO Cc1cnc([C@H](C)[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)cn1 ZINC000794257223 1025243621 /nfs/dbraw/zinc/24/36/21/1025243621.db2.gz LISAHESSNIWGAI-KRWDZBQOSA-N 1 1 324.472 3.968 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1C[C@@]12CCOC2 ZINC000885940676 1025412647 /nfs/dbraw/zinc/41/26/47/1025412647.db2.gz OWEZCRFPMYDJHP-UYAOXDASSA-N 1 1 314.473 3.535 20 10 DHCDMO CCC[N@@H+](Cc1cn2cccc(C)c2n1)Cc1ccccc1O ZINC000728927764 1025484502 /nfs/dbraw/zinc/48/45/02/1025484502.db2.gz YBRNNQOYLLNMTM-UHFFFAOYSA-N 1 1 309.413 3.761 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1c(O)cccc1F ZINC000886490063 1025649360 /nfs/dbraw/zinc/64/93/60/1025649360.db2.gz YMDFTIMDBZAAAP-YPMHNXCESA-N 1 1 308.422 3.546 20 10 DHCDMO CCN(C)c1ccccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886524052 1025674783 /nfs/dbraw/zinc/67/47/83/1025674783.db2.gz BQAICBACBVKYMA-CYBMUJFWSA-N 1 1 302.393 3.838 20 10 DHCDMO C[C@@H]([NH2+]CCCSc1nccs1)c1c(O)cccc1F ZINC000886527974 1025678276 /nfs/dbraw/zinc/67/82/76/1025678276.db2.gz DNHUZRPTFXJBEK-SNVBAGLBSA-N 1 1 312.435 3.821 20 10 DHCDMO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886533142 1025680871 /nfs/dbraw/zinc/68/08/71/1025680871.db2.gz VTKXNEXZWSAXFD-IAQYHMDHSA-N 1 1 317.360 3.714 20 10 DHCDMO COc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1c(O)cccc1F ZINC000886547972 1025694757 /nfs/dbraw/zinc/69/47/57/1025694757.db2.gz VLIZJOFZUKLGRF-RISCZKNCSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)c1c(O)cccc1F ZINC000886558231 1025702412 /nfs/dbraw/zinc/70/24/12/1025702412.db2.gz FCESFVUBDYCWDO-AGNJHWRGSA-N 1 1 313.463 3.562 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1c([O-])cccc1F ZINC000886588727 1025728465 /nfs/dbraw/zinc/72/84/65/1025728465.db2.gz XXONVWGFNGYVCD-KKUMJFAQSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H]1OCCc2sccc21 ZINC000886613939 1025742016 /nfs/dbraw/zinc/74/20/16/1025742016.db2.gz ISZRCJNGUAALGW-WVQJBOLRSA-N 1 1 321.417 3.946 20 10 DHCDMO COc1ccccc1C1([NH2+][C@@H](C)c2c(O)cccc2F)CC1 ZINC000886630008 1025751560 /nfs/dbraw/zinc/75/15/60/1025751560.db2.gz SJUGVGGKIPZYSO-LBPRGKRZSA-N 1 1 301.361 3.880 20 10 DHCDMO COc1cccc([C@@H](C[NH2+][C@H](C)c2c(O)cccc2F)OC)c1 ZINC000886641661 1025753145 /nfs/dbraw/zinc/75/31/45/1025753145.db2.gz OTTIDDYWEMAZHZ-SJKOYZFVSA-N 1 1 319.376 3.578 20 10 DHCDMO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1c(O)cccc1F ZINC000886639930 1025753400 /nfs/dbraw/zinc/75/34/00/1025753400.db2.gz NWJJACFDRZDIAA-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO CC(C)[C@H](CO)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000806170037 1025797079 /nfs/dbraw/zinc/79/70/79/1025797079.db2.gz VTBJXOGRRDWUAV-ZJUUUORDSA-N 1 1 306.233 3.614 20 10 DHCDMO CC[N@@H+](Cc1cccnc1)Cc1cc(Br)ccc1O ZINC000076118432 1025861817 /nfs/dbraw/zinc/86/18/17/1025861817.db2.gz RFWCGHJVLBKWBE-UHFFFAOYSA-N 1 1 321.218 3.572 20 10 DHCDMO Cc1ccnc([C@H](C)[NH2+]Cc2cccc(Br)c2O)c1 ZINC000289793996 1026176135 /nfs/dbraw/zinc/17/61/35/1026176135.db2.gz RYFNEWGOSGYTEO-NSHDSACASA-N 1 1 321.218 3.709 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)c1O ZINC000808707087 1026358392 /nfs/dbraw/zinc/35/83/92/1026358392.db2.gz ZZCUTRSCDJDZNA-YGRLFVJLSA-N 1 1 305.809 3.805 20 10 DHCDMO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808712735 1026362243 /nfs/dbraw/zinc/36/22/43/1026362243.db2.gz AYVQHWJGHVKSOK-IUCAKERBSA-N 1 1 311.838 3.926 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC=C(c3ccco3)C2)cc1F ZINC000809689308 1026595877 /nfs/dbraw/zinc/59/58/77/1026595877.db2.gz XJSMNGJVTYRFDN-UHFFFAOYSA-N 1 1 300.377 3.774 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@]2(C)CCCO)cc1 ZINC000809757950 1026619087 /nfs/dbraw/zinc/61/90/87/1026619087.db2.gz XBSMTYDRDPQTQE-IBGZPJMESA-N 1 1 304.478 3.660 20 10 DHCDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1cc(OC)ccc1O ZINC000809784391 1026624447 /nfs/dbraw/zinc/62/44/47/1026624447.db2.gz UMEZUMJPBGMDSG-SFHVURJKSA-N 1 1 315.413 3.993 20 10 DHCDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000809791434 1026629059 /nfs/dbraw/zinc/62/90/59/1026629059.db2.gz YQYPDBBTGVJHOX-IBGZPJMESA-N 1 1 304.478 3.517 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1 ZINC000810047906 1026668629 /nfs/dbraw/zinc/66/86/29/1026668629.db2.gz OWHGAHUOKRRUQI-NRFANRHFSA-N 1 1 322.452 3.722 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000811512287 1027027629 /nfs/dbraw/zinc/02/76/29/1027027629.db2.gz KHKVXZVDTTWEPV-FQEVSTJZSA-N 1 1 309.409 3.670 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1C ZINC000811513367 1027029637 /nfs/dbraw/zinc/02/96/37/1027029637.db2.gz UUCMVDWTGWPXAJ-LJQANCHMSA-N 1 1 322.452 3.646 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C)[C@@H](C)C3)cc2)CC1 ZINC000828576522 1027205702 /nfs/dbraw/zinc/20/57/02/1027205702.db2.gz NCEYNBUMTVJLIQ-SJORKVTESA-N 1 1 316.489 3.780 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cc1 ZINC000931910191 1027300909 /nfs/dbraw/zinc/30/09/09/1027300909.db2.gz AXYCECIKDBNFMW-AWEZNQCLSA-N 1 1 316.342 3.619 20 10 DHCDMO COCC1(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)CCC1 ZINC000812824366 1027416113 /nfs/dbraw/zinc/41/61/13/1027416113.db2.gz ZOIKMFYHXNSQET-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@H](F)C2)c(OC)c1 ZINC001138386819 1027454413 /nfs/dbraw/zinc/45/44/13/1027454413.db2.gz XIQVGIOUOGIQTO-INIZCTEOSA-N 1 1 308.441 3.865 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706700 1027643201 /nfs/dbraw/zinc/64/32/01/1027643201.db2.gz KOOXSSGCSYORCT-OAHLLOKOSA-N 1 1 303.352 3.660 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000778996964 1027741265 /nfs/dbraw/zinc/74/12/65/1027741265.db2.gz XTEGBAWJBAQJFC-HXUWFJFHSA-N 1 1 322.383 3.938 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000778996964 1027741276 /nfs/dbraw/zinc/74/12/76/1027741276.db2.gz XTEGBAWJBAQJFC-HXUWFJFHSA-N 1 1 322.383 3.938 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC4(CCC4)C3)cc2)CC1 ZINC000296843235 1027742235 /nfs/dbraw/zinc/74/22/35/1027742235.db2.gz SYTZZJQUJPQCQA-UHFFFAOYSA-N 1 1 314.473 3.678 20 10 DHCDMO C[C@@H]1C[C@H](C[N@@H+](Cc2ccccc2O)C2CCCC2)CCO1 ZINC000779015112 1027818497 /nfs/dbraw/zinc/81/84/97/1027818497.db2.gz MYYBRUAYDAYNPL-HZPDHXFCSA-N 1 1 303.446 3.952 20 10 DHCDMO CCc1nc([C@H]2CCC[N@H+]([C@@H](CC)c3ccccc3O)C2)no1 ZINC000364624510 1027861357 /nfs/dbraw/zinc/86/13/57/1027861357.db2.gz SYFKONWGEGQECP-ZFWWWQNUSA-N 1 1 315.417 3.668 20 10 DHCDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC12CCC2 ZINC000814171301 1027906957 /nfs/dbraw/zinc/90/69/57/1027906957.db2.gz NYUHJEVGHXHIOB-IBGZPJMESA-N 1 1 314.473 3.534 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1O ZINC000814178133 1027914850 /nfs/dbraw/zinc/91/48/50/1027914850.db2.gz CYYVFPUTATXPFF-OAHLLOKOSA-N 1 1 309.837 3.603 20 10 DHCDMO COc1ccc([C@H]([NH2+][C@@H](C)c2ccc(F)cc2O)C2CC2)cn1 ZINC000528045457 1028072951 /nfs/dbraw/zinc/07/29/51/1028072951.db2.gz ZCWJJZYUHYOHPR-BBATYDOGSA-N 1 1 316.376 3.737 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1COc2cccc(F)c21)c1ccc(F)cc1O ZINC000367620535 1028215991 /nfs/dbraw/zinc/21/59/91/1028215991.db2.gz YFCUKPDANWSEQX-ZIAGYGMSSA-N 1 1 305.324 3.845 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137219 1028312343 /nfs/dbraw/zinc/31/23/43/1028312343.db2.gz YGDHAAGYDYYVEV-AEFFLSMTSA-N 1 1 302.462 3.507 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137219 1028312361 /nfs/dbraw/zinc/31/23/61/1028312361.db2.gz YGDHAAGYDYYVEV-AEFFLSMTSA-N 1 1 302.462 3.507 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)[C@H]1C=CCCCCC1 ZINC000815011730 1028325054 /nfs/dbraw/zinc/32/50/54/1028325054.db2.gz YDYYGMDKSMVSRD-IBGZPJMESA-N 1 1 314.473 3.844 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1N(C)C ZINC000815009605 1028326169 /nfs/dbraw/zinc/32/61/69/1028326169.db2.gz HHAGUNCGHNQXEE-UHFFFAOYSA-N 1 1 313.401 3.601 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](c3ccnc(C)n3)C2)ccc1N(C)C ZINC000815020170 1028328042 /nfs/dbraw/zinc/32/80/42/1028328042.db2.gz ZONKCFHBRVNSST-GOSISDBHSA-N 1 1 324.472 3.539 20 10 DHCDMO COc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000368329290 1028337496 /nfs/dbraw/zinc/33/74/96/1028337496.db2.gz RYLRGTBPKKCYAC-ABAIWWIYSA-N 1 1 317.360 3.714 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1O ZINC000779150595 1028439216 /nfs/dbraw/zinc/43/92/16/1028439216.db2.gz RUKWQZSQZVVDBE-RNCFNFMXSA-N 1 1 316.214 3.643 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c1O ZINC000779150595 1028439222 /nfs/dbraw/zinc/43/92/22/1028439222.db2.gz RUKWQZSQZVVDBE-RNCFNFMXSA-N 1 1 316.214 3.643 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c1O ZINC000779150596 1028439571 /nfs/dbraw/zinc/43/95/71/1028439571.db2.gz RUKWQZSQZVVDBE-TVQRCGJNSA-N 1 1 316.214 3.643 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c1O ZINC000779150596 1028439579 /nfs/dbraw/zinc/43/95/79/1028439579.db2.gz RUKWQZSQZVVDBE-TVQRCGJNSA-N 1 1 316.214 3.643 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1c(F)cccc1F ZINC000075829124 1028536812 /nfs/dbraw/zinc/53/68/12/1028536812.db2.gz RHMXYRIZYKKHAB-KRWDZBQOSA-N 1 1 321.367 3.616 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1cccc(C(F)(F)F)c1O ZINC000815576131 1028549175 /nfs/dbraw/zinc/54/91/75/1028549175.db2.gz KFSLHLXGQQKWTQ-GHMZBOCLSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583711 1028557235 /nfs/dbraw/zinc/55/72/35/1028557235.db2.gz MRVSTXXVFPPALT-GRYCIOLGSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583711 1028557245 /nfs/dbraw/zinc/55/72/45/1028557245.db2.gz MRVSTXXVFPPALT-GRYCIOLGSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H](C[C@@H]1CCOC1)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815588350 1028559810 /nfs/dbraw/zinc/55/98/10/1028559810.db2.gz LHPQLDADUMAQOS-UTUOFQBUSA-N 1 1 317.351 3.877 20 10 DHCDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000779165602 1028585062 /nfs/dbraw/zinc/58/50/62/1028585062.db2.gz JRDFTPJMDYHKIT-LJQANCHMSA-N 1 1 311.425 3.795 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C(C)(C)O ZINC000815652379 1028595081 /nfs/dbraw/zinc/59/50/81/1028595081.db2.gz ZXRQUSOYWYZUGH-AMIZOPFISA-N 1 1 306.233 3.899 20 10 DHCDMO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000371871233 1028770338 /nfs/dbraw/zinc/77/03/38/1028770338.db2.gz YLNVKQBFUFOLRA-BDJLRTHQSA-N 1 1 317.360 3.714 20 10 DHCDMO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2nccs2)c1O ZINC000372433063 1028854314 /nfs/dbraw/zinc/85/43/14/1028854314.db2.gz ADHOQCBGLFILGW-ZDUSSCGKSA-N 1 1 304.415 3.585 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H]2c2nccs2)c1O ZINC000372433063 1028854331 /nfs/dbraw/zinc/85/43/31/1028854331.db2.gz ADHOQCBGLFILGW-ZDUSSCGKSA-N 1 1 304.415 3.585 20 10 DHCDMO Oc1c(C[N@H+]2CCCC3(CCOCC3)C2)ccc2ccccc21 ZINC000816513469 1028911192 /nfs/dbraw/zinc/91/11/92/1028911192.db2.gz RCJPDNIYORQQIR-UHFFFAOYSA-N 1 1 311.425 3.938 20 10 DHCDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2ccccc2c1O ZINC000816520610 1028919392 /nfs/dbraw/zinc/91/93/92/1028919392.db2.gz TXRQCTXZIGIXOW-MSOLQXFVSA-N 1 1 310.441 3.604 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]CCc1c(F)cccc1F ZINC000816536321 1028924089 /nfs/dbraw/zinc/92/40/89/1028924089.db2.gz RPFOFSLVVFXNBZ-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO CCN(C)c1ccccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816547574 1028929366 /nfs/dbraw/zinc/92/93/66/1028929366.db2.gz AZDQSLXHAOGHLB-UHFFFAOYSA-N 1 1 322.811 3.931 20 10 DHCDMO CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816548392 1028930111 /nfs/dbraw/zinc/93/01/11/1028930111.db2.gz FZXYKWQNBQSHDI-MRXNPFEDSA-N 1 1 312.457 3.755 20 10 DHCDMO CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816548392 1028930130 /nfs/dbraw/zinc/93/01/30/1028930130.db2.gz FZXYKWQNBQSHDI-MRXNPFEDSA-N 1 1 312.457 3.755 20 10 DHCDMO CC(C)(C[NH2+]Cc1ccc2ccccc2c1[O-])C[NH+]1CCCC1 ZINC000816591809 1028939745 /nfs/dbraw/zinc/93/97/45/1028939745.db2.gz ONRAIADOAKZVDE-UHFFFAOYSA-N 1 1 312.457 3.757 20 10 DHCDMO COC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816555428 1028940654 /nfs/dbraw/zinc/94/06/54/1028940654.db2.gz DIOGQXFNMLVZLG-CQSZACIVSA-N 1 1 323.795 3.532 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H]2C2CCOCC2)ccc2ccccc21 ZINC000816560476 1028945885 /nfs/dbraw/zinc/94/58/85/1028945885.db2.gz PZEXEYQYYOJPAV-IBGZPJMESA-N 1 1 311.425 3.936 20 10 DHCDMO Cc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000816569724 1028949160 /nfs/dbraw/zinc/94/91/60/1028949160.db2.gz UTHIZAJYPMXXKB-UHFFFAOYSA-N 1 1 308.784 3.913 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC3(CCC3)[C@@H]1c1ccccc1)OCO2 ZINC000816630363 1028952639 /nfs/dbraw/zinc/95/26/39/1028952639.db2.gz BLAIDKDDBGXDNJ-IBGZPJMESA-N 1 1 323.392 3.848 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000816574908 1028952749 /nfs/dbraw/zinc/95/27/49/1028952749.db2.gz WJMNMDUQIZLULA-CYBMUJFWSA-N 1 1 313.800 3.576 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000816574908 1028952760 /nfs/dbraw/zinc/95/27/60/1028952760.db2.gz WJMNMDUQIZLULA-CYBMUJFWSA-N 1 1 313.800 3.576 20 10 DHCDMO Cn1nccc1C1=CC[N@@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816607904 1028958825 /nfs/dbraw/zinc/95/88/25/1028958825.db2.gz JDYGTULZJJCVAD-UHFFFAOYSA-N 1 1 319.408 3.568 20 10 DHCDMO CCc1ccc([C@H](O)C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816607680 1028960675 /nfs/dbraw/zinc/96/06/75/1028960675.db2.gz BPZYHYIIUQLIOC-QGZVFWFLSA-N 1 1 323.795 3.570 20 10 DHCDMO Oc1c(C[NH2+]Cc2nccc(C(F)F)n2)ccc2ccccc21 ZINC000816612185 1028966028 /nfs/dbraw/zinc/96/60/28/1028966028.db2.gz IPDWQXZMLFCGSI-UHFFFAOYSA-N 1 1 315.323 3.563 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@@H](O)CC2)cc1 ZINC000816667426 1028982980 /nfs/dbraw/zinc/98/29/80/1028982980.db2.gz NCAFJASJEHBUAK-LJQANCHMSA-N 1 1 304.478 3.660 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000817934793 1029279376 /nfs/dbraw/zinc/27/93/76/1029279376.db2.gz PGJKFTNIYQMKRX-ONGXBYRLSA-N 1 1 323.484 3.726 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1Cl ZINC000817939017 1029282508 /nfs/dbraw/zinc/28/25/08/1029282508.db2.gz XPOYKPQSCXNHRE-FZKQIMNGSA-N 1 1 317.864 3.757 20 10 DHCDMO CCc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938621 1029284073 /nfs/dbraw/zinc/28/40/73/1029284073.db2.gz OMGHHVTXLJIEOJ-SUMWQHHRSA-N 1 1 317.502 3.727 20 10 DHCDMO CC(C)[NH2+]CCCN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952933 1029294561 /nfs/dbraw/zinc/29/45/61/1029294561.db2.gz JJVDBROVQHACFG-INIZCTEOSA-N 1 1 321.484 3.855 20 10 DHCDMO CCC([NH3+])(CC)CN[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817959611 1029297636 /nfs/dbraw/zinc/29/76/36/1029297636.db2.gz DKKVGVWEVZQKER-INIZCTEOSA-N 1 1 303.494 3.845 20 10 DHCDMO C[C@H](NCC1([NH3+])CCC1)c1ccc(N2CCCCCC2)cc1 ZINC000817965168 1029305810 /nfs/dbraw/zinc/30/58/10/1029305810.db2.gz QMHLCPIXXCFAAV-INIZCTEOSA-N 1 1 301.478 3.599 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000817967029 1029306676 /nfs/dbraw/zinc/30/66/76/1029306676.db2.gz CRJUUHFOUYBZHZ-DIFFPNOSSA-N 1 1 300.377 3.842 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817969022 1029306935 /nfs/dbraw/zinc/30/69/35/1029306935.db2.gz POQLSNCHMKFIMQ-JSGCOSHPSA-N 1 1 316.367 3.594 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817969021 1029307802 /nfs/dbraw/zinc/30/78/02/1029307802.db2.gz POQLSNCHMKFIMQ-GXTWGEPZSA-N 1 1 316.367 3.594 20 10 DHCDMO C[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000817971201 1029309883 /nfs/dbraw/zinc/30/98/83/1029309883.db2.gz KLBWDKKKEHTXCU-ZWOKBUDYSA-N 1 1 315.505 3.716 20 10 DHCDMO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817971643 1029311955 /nfs/dbraw/zinc/31/19/55/1029311955.db2.gz ONUDMFOJSGISKE-ZHALLVOQSA-N 1 1 315.505 3.858 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Cl)ccc1[O-] ZINC000817976298 1029313853 /nfs/dbraw/zinc/31/38/53/1029313853.db2.gz XAXULWSYNUHRKM-XJKCOSOUSA-N 1 1 310.869 3.851 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000373519756 1029784612 /nfs/dbraw/zinc/78/46/12/1029784612.db2.gz GNKMENCQAQBXOC-PPDQVPDSSA-N 1 1 315.505 3.810 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)c1ccc(Cl)c(Cl)c1[O-] ZINC000530215825 1029785626 /nfs/dbraw/zinc/78/56/26/1029785626.db2.gz JLKGQSYPUOXNTL-JOYOIKCWSA-N 1 1 315.244 3.634 20 10 DHCDMO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC000865731493 1029994230 /nfs/dbraw/zinc/99/42/30/1029994230.db2.gz PUHKIDLVCXPWIC-GOSISDBHSA-N 1 1 323.484 3.598 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1O ZINC000245951909 1030212803 /nfs/dbraw/zinc/21/28/03/1030212803.db2.gz XFHAZDSCKUFOEO-CZUORRHYSA-N 1 1 303.427 3.724 20 10 DHCDMO C[C@H]1COCC[N@@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823408729 1030282697 /nfs/dbraw/zinc/28/26/97/1030282697.db2.gz PUBAWJWTDFVHIX-HNNXBMFYSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@H]1COCC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823408729 1030282715 /nfs/dbraw/zinc/28/27/15/1030282715.db2.gz PUBAWJWTDFVHIX-HNNXBMFYSA-N 1 1 316.470 3.605 20 10 DHCDMO C[C@@H]([NH2+][C@H]1C[C@@H](C)O[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000866446314 1030300775 /nfs/dbraw/zinc/30/07/75/1030300775.db2.gz FKRYJWRFCIMGGT-PRFIWBCESA-N 1 1 303.324 3.628 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000291038277 1030304478 /nfs/dbraw/zinc/30/44/78/1030304478.db2.gz YXZJLHVQCCMWLH-HOTGVXAUSA-N 1 1 307.821 3.579 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCC(=O)c2ccccc2)C2CC2)cc1 ZINC000777558502 1030345539 /nfs/dbraw/zinc/34/55/39/1030345539.db2.gz IHIANMBBHYSCAG-UHFFFAOYSA-N 1 1 322.452 3.990 20 10 DHCDMO COC[C@H]1CC[N@H+]1Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000824433767 1030553518 /nfs/dbraw/zinc/55/35/18/1030553518.db2.gz NPGOYZZFSHGZRC-QGZVFWFLSA-N 1 1 316.470 3.605 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccco2)c(O)c(C(C)(C)C)c1 ZINC000824522787 1030572620 /nfs/dbraw/zinc/57/26/20/1030572620.db2.gz SFYAWDYCVPQZSY-UHFFFAOYSA-N 1 1 303.402 3.923 20 10 DHCDMO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000824800528 1030640969 /nfs/dbraw/zinc/64/09/69/1030640969.db2.gz YZBVMRMGFFNDPO-XHDPSFHLSA-N 1 1 315.816 3.726 20 10 DHCDMO CC(C)[C@H]1C[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000824798637 1030641702 /nfs/dbraw/zinc/64/17/02/1030641702.db2.gz GLHNUSCACIFZOW-BDJLRTHQSA-N 1 1 315.816 3.726 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](OC)[C@@H](C)C2)cc1F ZINC000824815724 1030644497 /nfs/dbraw/zinc/64/44/97/1030644497.db2.gz XQWZCFBMHZOEKS-KSSFIOAISA-N 1 1 308.441 3.529 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000824815587 1030646550 /nfs/dbraw/zinc/64/65/50/1030646550.db2.gz UGQAJOSFRGDURJ-QFBILLFUSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1cccnc1CCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000824783975 1030652177 /nfs/dbraw/zinc/65/21/77/1030652177.db2.gz YOGPSIVOGMWOPL-UHFFFAOYSA-N 1 1 308.784 3.611 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1Cl ZINC000824926813 1030673930 /nfs/dbraw/zinc/67/39/30/1030673930.db2.gz HKQBZJPCJVZJTC-MLGOLLRUSA-N 1 1 319.836 3.634 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2C2CCOCC2)cc1Cl ZINC000825412170 1030805490 /nfs/dbraw/zinc/80/54/90/1030805490.db2.gz DPVVOOYUUCOWAX-INIZCTEOSA-N 1 1 309.837 3.745 20 10 DHCDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825451726 1030816223 /nfs/dbraw/zinc/81/62/23/1030816223.db2.gz ZHBIVJOXTXHKIO-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cn(C)cn2)c(C)n1-c1cccc(C)c1 ZINC000926765534 1030910319 /nfs/dbraw/zinc/91/03/19/1030910319.db2.gz XMOIIDGYDFTEGV-MRXNPFEDSA-N 1 1 322.456 3.987 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccc(N)c1 ZINC000844220308 1030997464 /nfs/dbraw/zinc/99/74/64/1030997464.db2.gz CXFVLWCEFUHUJW-UHFFFAOYSA-N 1 1 309.457 3.891 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](C3CCC3)C2)c1O ZINC001171154538 1031386394 /nfs/dbraw/zinc/38/63/94/1031386394.db2.gz AGNRLZUZAZAUMU-CYBMUJFWSA-N 1 1 307.821 3.870 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2F)cc1 ZINC000844924829 1031400608 /nfs/dbraw/zinc/40/06/08/1031400608.db2.gz RBXPMZWHMLQLRS-CQSZACIVSA-N 1 1 315.436 3.591 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2cccc(O)c2Cl)cc1F ZINC000293487127 1031487425 /nfs/dbraw/zinc/48/74/25/1031487425.db2.gz GHBURLKDKWYUGI-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO COC[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000293545092 1031511337 /nfs/dbraw/zinc/51/13/37/1031511337.db2.gz GJVDNMASQALJOV-OAHLLOKOSA-N 1 1 309.768 3.662 20 10 DHCDMO CC(=O)Nc1cccc2c1C[N@@H+](Cc1cc(C)c(C)cc1O)CC2 ZINC000872660803 1031640344 /nfs/dbraw/zinc/64/03/44/1031640344.db2.gz XUCONPYEYDTUBS-UHFFFAOYSA-N 1 1 324.424 3.526 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nccn2CC)cc1C ZINC000873130050 1031720521 /nfs/dbraw/zinc/72/05/21/1031720521.db2.gz WTBZHKPUXZMQHX-HNNXBMFYSA-N 1 1 301.434 3.851 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@](O)(c2ccc(Cl)cc2)C1 ZINC000846010866 1031805584 /nfs/dbraw/zinc/80/55/84/1031805584.db2.gz RUUDVSCXMZZESU-SFHVURJKSA-N 1 1 317.816 3.529 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000897748928 1031811398 /nfs/dbraw/zinc/81/13/98/1031811398.db2.gz LOCPUEFCJCVOTK-PBINXNQUSA-N 1 1 301.814 3.701 20 10 DHCDMO CC1(C)CC2(CC([NH2+]Cc3c(O)ccc(Cl)c3F)C2)CO1 ZINC000897971414 1031885628 /nfs/dbraw/zinc/88/56/28/1031885628.db2.gz XKAYANKQCIEDJA-UHFFFAOYSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC(Cc2ccncc2)CC1 ZINC001142527134 1031907956 /nfs/dbraw/zinc/90/79/56/1031907956.db2.gz LWFFVHMTWBNVFC-UHFFFAOYSA-N 1 1 318.367 3.520 20 10 DHCDMO CCc1cccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)c1 ZINC000846210124 1031909745 /nfs/dbraw/zinc/90/97/45/1031909745.db2.gz XQKJFHBRVHFQRX-ZDUSSCGKSA-N 1 1 313.397 3.592 20 10 DHCDMO C[C@H]([NH2+]CCC1(CO)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000846209907 1031909888 /nfs/dbraw/zinc/90/98/88/1031909888.db2.gz ITVORHYBXIJVQB-JTQLQIEISA-N 1 1 318.244 3.902 20 10 DHCDMO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001142527512 1031910797 /nfs/dbraw/zinc/91/07/97/1031910797.db2.gz XKWMBDZIFALVLG-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001142527512 1031910808 /nfs/dbraw/zinc/91/08/08/1031910808.db2.gz XKWMBDZIFALVLG-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001142527420 1031911224 /nfs/dbraw/zinc/91/12/24/1031911224.db2.gz UEADETLECBAQSF-UHFFFAOYSA-N 1 1 301.336 3.960 20 10 DHCDMO Oc1cc(F)c(F)cc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001142527420 1031911235 /nfs/dbraw/zinc/91/12/35/1031911235.db2.gz UEADETLECBAQSF-UHFFFAOYSA-N 1 1 301.336 3.960 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1ccccc1F)[C@@H](C)O)c1ccc(F)cc1O ZINC000846181884 1031913616 /nfs/dbraw/zinc/91/36/16/1031913616.db2.gz FOVZEUCZNWCNEG-DPZKZMLUSA-N 1 1 321.367 3.833 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1 ZINC000846179783 1031914374 /nfs/dbraw/zinc/91/43/74/1031914374.db2.gz MTUDCZUPBINPHX-SGIREYDYSA-N 1 1 323.458 3.504 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1Cc2ccc(OC)cc2C1 ZINC001168286851 1032049368 /nfs/dbraw/zinc/04/93/68/1032049368.db2.gz KTJZZPYPOWNVNA-HXUWFJFHSA-N 1 1 324.468 3.751 20 10 DHCDMO Cc1cc(C[N@@H+]2CC[C@@H](CO)C[C@H]2C)ccc1N1CCCCC1 ZINC000860089744 1033298865 /nfs/dbraw/zinc/29/88/65/1033298865.db2.gz MDFQHPFHKVVVBE-IEBWSBKVSA-N 1 1 316.489 3.578 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000877437202 1033299735 /nfs/dbraw/zinc/29/97/35/1033299735.db2.gz ZCFGFCYYCNPXST-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000877437202 1033299747 /nfs/dbraw/zinc/29/97/47/1033299747.db2.gz ZCFGFCYYCNPXST-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000877516613 1033330413 /nfs/dbraw/zinc/33/04/13/1033330413.db2.gz GYAPVKDWLIOIKB-VAMGGRTRSA-N 1 1 323.436 3.705 20 10 DHCDMO Cc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(O)c1 ZINC000877519673 1033334346 /nfs/dbraw/zinc/33/43/46/1033334346.db2.gz ZEHHAKMEENOLML-VAMGGRTRSA-N 1 1 323.436 3.705 20 10 DHCDMO OC1CCN(c2ccc(CNc3cccc(C4CC4)[nH+]3)cc2)CC1 ZINC000877550028 1033351705 /nfs/dbraw/zinc/35/17/05/1033351705.db2.gz LMDNSFFLMDWVPJ-UHFFFAOYSA-N 1 1 323.440 3.532 20 10 DHCDMO CCn1nc(C)c(C[N@H+](C)Cc2c(O)cccc2Cl)c1C ZINC000877664605 1033401639 /nfs/dbraw/zinc/40/16/39/1033401639.db2.gz UKOMBOVBILZHPQ-UHFFFAOYSA-N 1 1 307.825 3.511 20 10 DHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2c(O)cccc2Cl)c1C ZINC000877664605 1033401649 /nfs/dbraw/zinc/40/16/49/1033401649.db2.gz UKOMBOVBILZHPQ-UHFFFAOYSA-N 1 1 307.825 3.511 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)c1O ZINC000877672697 1033407600 /nfs/dbraw/zinc/40/76/00/1033407600.db2.gz KXWDLWPCIRPNRY-OALUTQOASA-N 1 1 311.425 3.653 20 10 DHCDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000877796470 1033454304 /nfs/dbraw/zinc/45/43/04/1033454304.db2.gz NVRJYFOJPVSNSM-SFHVURJKSA-N 1 1 316.489 3.660 20 10 DHCDMO CC[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCOC1)c1ccc(F)cc1O ZINC000927070456 1033518790 /nfs/dbraw/zinc/51/87/90/1033518790.db2.gz SDIXUFXESQFFOJ-QANKJYHBSA-N 1 1 307.409 3.777 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)cc1Cl ZINC000826016410 1033584114 /nfs/dbraw/zinc/58/41/14/1033584114.db2.gz IOUJZYNWOAHNIH-KRWDZBQOSA-N 1 1 311.853 3.585 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl ZINC000826049738 1033751565 /nfs/dbraw/zinc/75/15/65/1033751565.db2.gz YJJYOJTZWURZMP-UAGQMJEPSA-N 1 1 323.864 3.870 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000862242788 1033793357 /nfs/dbraw/zinc/79/33/57/1033793357.db2.gz QXWKKEMQBPZZBW-LLVKDONJSA-N 1 1 322.202 3.737 20 10 DHCDMO CSC[C@H]1CCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC000862373994 1033833055 /nfs/dbraw/zinc/83/30/55/1033833055.db2.gz JMYSYBQHWYUFKE-LBPRGKRZSA-N 1 1 314.445 3.606 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1 ZINC000862476389 1033863754 /nfs/dbraw/zinc/86/37/54/1033863754.db2.gz SAVUNZGRDGMCNC-APWZRJJASA-N 1 1 316.489 3.833 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862482679 1033866520 /nfs/dbraw/zinc/86/65/20/1033866520.db2.gz KWAAUSQVHMNSDN-SFHVURJKSA-N 1 1 317.816 3.529 20 10 DHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3O)C2)cc1 ZINC000862541641 1033881671 /nfs/dbraw/zinc/88/16/71/1033881671.db2.gz YVXVBSUJXBMAMU-CYBMUJFWSA-N 1 1 303.789 3.741 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@](C)(OC)C2)c(O)c(C(C)(C)C)c1 ZINC000794650934 1034328891 /nfs/dbraw/zinc/32/88/91/1034328891.db2.gz UJUXDRDRVFYNQJ-IBGZPJMESA-N 1 1 321.461 3.699 20 10 DHCDMO C[C@@H](N[C@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1O ZINC000183396415 1034383342 /nfs/dbraw/zinc/38/33/42/1034383342.db2.gz GGRHMOVDMZHYTA-VQIMIIECSA-N 1 1 310.441 3.880 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000184691613 1034492075 /nfs/dbraw/zinc/49/20/75/1034492075.db2.gz LOUWZSAKHKQYAJ-NSHDSACASA-N 1 1 321.804 3.953 20 10 DHCDMO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccc(F)cc1O ZINC000185532208 1034554822 /nfs/dbraw/zinc/55/48/22/1034554822.db2.gz RHQYLOFGXFBOPO-SUMWQHHRSA-N 1 1 303.377 3.696 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1[O-] ZINC000186518254 1034638637 /nfs/dbraw/zinc/63/86/37/1034638637.db2.gz UGACFSIQHDCTFH-SOUVJXGZSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@H]([NH2+]CCCn1cccn1)c1cc(Cl)c(Cl)cc1O ZINC000192640383 1034812258 /nfs/dbraw/zinc/81/22/58/1034812258.db2.gz DVVNHQOHAANHGL-JTQLQIEISA-N 1 1 314.216 3.636 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193071685 1034828483 /nfs/dbraw/zinc/82/84/83/1034828483.db2.gz NJJILHPMGIPEPN-VHSXEESVSA-N 1 1 304.217 3.919 20 10 DHCDMO Cc1cccc(C[NH2+]Cc2cccc(Br)c2O)c1 ZINC000042411790 1035118519 /nfs/dbraw/zinc/11/85/19/1035118519.db2.gz VEANGIOHPMYZFM-UHFFFAOYSA-N 1 1 306.203 3.753 20 10 DHCDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 ZINC001180042932 1035573059 /nfs/dbraw/zinc/57/30/59/1035573059.db2.gz MLJGNIROTSASLE-IOASZLSFSA-N 1 1 324.415 3.508 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC001180086434 1035590388 /nfs/dbraw/zinc/59/03/88/1035590388.db2.gz IKCHXUQFMOGMFZ-UHFFFAOYSA-N 1 1 311.372 3.594 20 10 DHCDMO C[N@H+](Cc1ccsc1Br)Cc1ccccc1O ZINC001180238780 1035630590 /nfs/dbraw/zinc/63/05/90/1035630590.db2.gz BBTJYEMTYMRAHV-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO C[N@@H+](Cc1ccsc1Br)Cc1ccccc1O ZINC001180238780 1035630596 /nfs/dbraw/zinc/63/05/96/1035630596.db2.gz BBTJYEMTYMRAHV-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC001180430598 1035669935 /nfs/dbraw/zinc/66/99/35/1035669935.db2.gz OXGYBJXYIJKICO-AEFFLSMTSA-N 1 1 305.462 3.745 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1 ZINC000773862462 1035704603 /nfs/dbraw/zinc/70/46/03/1035704603.db2.gz YVRZWMVPQHFKQR-OAQYLSRUSA-N 1 1 322.452 3.774 20 10 DHCDMO Oc1ccc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(O)c1 ZINC001204278877 1035740704 /nfs/dbraw/zinc/74/07/04/1035740704.db2.gz LMJOHLNKWCYUEA-CYBMUJFWSA-N 1 1 303.789 3.741 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3cc(Cl)c(F)cc3O)ccc21 ZINC000816563823 1035809904 /nfs/dbraw/zinc/80/99/04/1035809904.db2.gz KUXURSJVXNBMKX-UHFFFAOYSA-N 1 1 305.740 3.684 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c1 ZINC001182109121 1036098304 /nfs/dbraw/zinc/09/83/04/1036098304.db2.gz JDNZUQFWVCNVLM-IBGZPJMESA-N 1 1 313.441 3.551 20 10 DHCDMO CCN(CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O)C1CC1 ZINC000774162632 1036207343 /nfs/dbraw/zinc/20/73/43/1036207343.db2.gz QWTIYOFTRTYQPT-SNVBAGLBSA-N 1 1 317.260 3.834 20 10 DHCDMO CCC[C@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774185954 1036234755 /nfs/dbraw/zinc/23/47/55/1036234755.db2.gz WKAZYQINFDHPAU-XPTSAGLGSA-N 1 1 306.233 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCO)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774252171 1036256502 /nfs/dbraw/zinc/25/65/02/1036256502.db2.gz JRUMSMCPQXROKI-AMIZOPFISA-N 1 1 304.217 3.511 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c1 ZINC000775664559 1036283898 /nfs/dbraw/zinc/28/38/98/1036283898.db2.gz YBYWADATJONXMY-KRWDZBQOSA-N 1 1 315.388 3.747 20 10 DHCDMO C[N@@H+](Cc1c([O-])ccc(Cl)c1F)C1CC(OC(C)(C)C)C1 ZINC001182443478 1036302479 /nfs/dbraw/zinc/30/24/79/1036302479.db2.gz JUSGXARWCHZIKX-UHFFFAOYSA-N 1 1 315.816 3.963 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C1CC(OC(C)(C)C)C1 ZINC001182443478 1036302492 /nfs/dbraw/zinc/30/24/92/1036302492.db2.gz JUSGXARWCHZIKX-UHFFFAOYSA-N 1 1 315.816 3.963 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1cc(F)cc(F)c1O ZINC000774441501 1036333263 /nfs/dbraw/zinc/33/32/63/1036333263.db2.gz JRDHVWHMMNOAFH-LLVKDONJSA-N 1 1 318.367 3.795 20 10 DHCDMO CC[N@H+](Cc1nc2ccccc2n1C)Cc1ccc(N(C)C)cc1 ZINC000153370361 1036356141 /nfs/dbraw/zinc/35/61/41/1036356141.db2.gz YNDNNPXBJIPOPR-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO CC[N@@H+](Cc1nc2ccccc2n1C)Cc1ccc(N(C)C)cc1 ZINC000153370361 1036356153 /nfs/dbraw/zinc/35/61/53/1036356153.db2.gz YNDNNPXBJIPOPR-UHFFFAOYSA-N 1 1 322.456 3.661 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(Cc3ccccc3)CC[C@H]2C)c1O ZINC000775674654 1036383412 /nfs/dbraw/zinc/38/34/12/1036383412.db2.gz HRAJVXMKUUDQPD-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)Cc2cc(C)ccc2C)cc1OC ZINC000762069361 1036499609 /nfs/dbraw/zinc/49/96/09/1036499609.db2.gz SKLOWTNYZZEFOS-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO COc1cccc(C2([NH2+]Cc3cc(F)c(F)cc3O)CCC2)c1 ZINC001183036419 1036503420 /nfs/dbraw/zinc/50/34/20/1036503420.db2.gz PGMUXDLWERVIEV-UHFFFAOYSA-N 1 1 319.351 3.848 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@@H]2CCCN(c3ccccc3)C2)c1O ZINC000775709140 1036505921 /nfs/dbraw/zinc/50/59/21/1036505921.db2.gz QTEBYNDNNXCUPR-LJQANCHMSA-N 1 1 310.441 3.801 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](C1CCC1)[C@@H]1CCCO1 ZINC001183123212 1036520154 /nfs/dbraw/zinc/52/01/54/1036520154.db2.gz MVJVIZMJFFISPH-JKSUJKDBSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1c(F)cccc1C[N@@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001183410934 1036582505 /nfs/dbraw/zinc/58/25/05/1036582505.db2.gz XSCVFCCKFDIWME-GOSISDBHSA-N 1 1 303.352 3.992 20 10 DHCDMO Oc1c(F)cccc1C[N@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001183410934 1036582517 /nfs/dbraw/zinc/58/25/17/1036582517.db2.gz XSCVFCCKFDIWME-GOSISDBHSA-N 1 1 303.352 3.992 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+]C1(Cc2ccc(F)cc2)CC1 ZINC001205801906 1036696017 /nfs/dbraw/zinc/69/60/17/1036696017.db2.gz AMHHWQZMGDWWLV-UHFFFAOYSA-N 1 1 307.315 3.674 20 10 DHCDMO C[C@@H](CCOCc1ccccc1)[NH2+]Cc1c(O)cccc1F ZINC001183918701 1036710964 /nfs/dbraw/zinc/71/09/64/1036710964.db2.gz BUAMFNYGIVJQES-AWEZNQCLSA-N 1 1 303.377 3.616 20 10 DHCDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(O)cccc1F ZINC001183919791 1036711519 /nfs/dbraw/zinc/71/15/19/1036711519.db2.gz QAVHCSFQFLGAIB-GFCCVEGCSA-N 1 1 318.348 3.550 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCC[C@@H]1c1ccccc1)OCO2 ZINC000762468866 1036775681 /nfs/dbraw/zinc/77/56/81/1036775681.db2.gz XRPGSZFYVGRUAH-MRXNPFEDSA-N 1 1 311.381 3.848 20 10 DHCDMO Oc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)cc1O ZINC001203879712 1036789752 /nfs/dbraw/zinc/78/97/52/1036789752.db2.gz YZOJURQTVLKKIW-MRXNPFEDSA-N 1 1 301.361 3.964 20 10 DHCDMO Oc1ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)cc1O ZINC001203879712 1036789769 /nfs/dbraw/zinc/78/97/69/1036789769.db2.gz YZOJURQTVLKKIW-MRXNPFEDSA-N 1 1 301.361 3.964 20 10 DHCDMO C[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(N(C)C)cc1 ZINC000775832723 1036987123 /nfs/dbraw/zinc/98/71/23/1036987123.db2.gz AULRYMHXWDBMJF-GFCCVEGCSA-N 1 1 313.376 3.884 20 10 DHCDMO COc1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)ccn1 ZINC000762926958 1037079599 /nfs/dbraw/zinc/07/95/99/1037079599.db2.gz YGPWWBJMHTVJMN-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO COc1c(O)c(C[N@H+](C)CCC2CCCCC2)ccc1[N+](=O)[O-] ZINC000774869981 1037126876 /nfs/dbraw/zinc/12/68/76/1037126876.db2.gz PRPDJZQSGCNQFF-UHFFFAOYSA-N 1 1 322.405 3.711 20 10 DHCDMO COc1c(O)c(C[N@@H+](C)CCC2CCCCC2)ccc1[N+](=O)[O-] ZINC000774869981 1037126883 /nfs/dbraw/zinc/12/68/83/1037126883.db2.gz PRPDJZQSGCNQFF-UHFFFAOYSA-N 1 1 322.405 3.711 20 10 DHCDMO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911337 1037205335 /nfs/dbraw/zinc/20/53/35/1037205335.db2.gz YYSFZFKMVLZCNE-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911337 1037205353 /nfs/dbraw/zinc/20/53/53/1037205353.db2.gz YYSFZFKMVLZCNE-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911339 1037206061 /nfs/dbraw/zinc/20/60/61/1037206061.db2.gz YYSFZFKMVLZCNE-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911339 1037206078 /nfs/dbraw/zinc/20/60/78/1037206078.db2.gz YYSFZFKMVLZCNE-JSGCOSHPSA-N 1 1 322.405 3.710 20 10 DHCDMO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775982011 1037279559 /nfs/dbraw/zinc/27/95/59/1037279559.db2.gz XHMOYFRNSWPGPB-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)CCC(=O)c2cccs2)cc1 ZINC001203937393 1037283053 /nfs/dbraw/zinc/28/30/53/1037283053.db2.gz PLZUPVWJKAAJFT-UHFFFAOYSA-N 1 1 302.443 3.519 20 10 DHCDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccn(C)n1)Cc1ccccc1O ZINC000776004377 1037299239 /nfs/dbraw/zinc/29/92/39/1037299239.db2.gz OJKOWMAFDPZRDP-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](Cc1ccn(C)n1)Cc1ccccc1O ZINC000776004377 1037299251 /nfs/dbraw/zinc/29/92/51/1037299251.db2.gz OJKOWMAFDPZRDP-INIZCTEOSA-N 1 1 321.424 3.889 20 10 DHCDMO CO[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C ZINC000784668951 1037458896 /nfs/dbraw/zinc/45/88/96/1037458896.db2.gz WXZRFDARWQCJJI-LPHOPBHVSA-N 1 1 302.462 3.534 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c(O)c1 ZINC000775136791 1037689637 /nfs/dbraw/zinc/68/96/37/1037689637.db2.gz LTUQUKXKPGRKRN-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccccc1O ZINC000153881291 1037703178 /nfs/dbraw/zinc/70/31/78/1037703178.db2.gz REJIHLXTFVUHOQ-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491788 1038568137 /nfs/dbraw/zinc/56/81/37/1038568137.db2.gz JUMZOESCHPTYQJ-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2[O-])C1 ZINC000775491788 1038568144 /nfs/dbraw/zinc/56/81/44/1038568144.db2.gz JUMZOESCHPTYQJ-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)Cc1cc(C)[nH]n1)c1cc(Cl)ccc1O ZINC000775522631 1038631972 /nfs/dbraw/zinc/63/19/72/1038631972.db2.gz WIXXXSZYAFOYIZ-BMIGLBTASA-N 1 1 307.825 3.749 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1cc(F)ccc1F ZINC000170779215 1038960084 /nfs/dbraw/zinc/96/00/84/1038960084.db2.gz CSFWUOAQZMSFHY-GOSISDBHSA-N 1 1 321.367 3.616 20 10 DHCDMO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000170789450 1038964642 /nfs/dbraw/zinc/96/46/42/1038964642.db2.gz LMKJLRWJZBWQHU-STQMWFEESA-N 1 1 303.377 3.909 20 10 DHCDMO C[C@@H]1C[C@H]([NH2+]CC2(CN(C)C)CCCC2)c2c1c(F)ccc2O ZINC000760896577 1039031781 /nfs/dbraw/zinc/03/17/81/1039031781.db2.gz HGAOYXZFZVQWJS-HIFRSBDPSA-N 1 1 320.452 3.791 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](C)C(=O)Nc1ccccc1 ZINC000174375204 1040624451 /nfs/dbraw/zinc/62/44/51/1040624451.db2.gz FLWQGPPRSGVGFZ-OAHLLOKOSA-N 1 1 312.413 3.631 20 10 DHCDMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(N(C)C)cc1 ZINC000090459427 185297616 /nfs/dbraw/zinc/29/76/16/185297616.db2.gz ZDRCFVFVTWBBFN-LBPRGKRZSA-N 1 1 301.459 3.937 20 10 DHCDMO C[N@@H+](CCc1ccncc1)Cc1ccc(N2CCCCC2)cc1 ZINC000078681628 191910533 /nfs/dbraw/zinc/91/05/33/191910533.db2.gz SJWLIXSDRYJPFS-UHFFFAOYSA-N 1 1 309.457 3.746 20 10 DHCDMO COc1ccc(OC(F)F)c(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000091956795 193132735 /nfs/dbraw/zinc/13/27/35/193132735.db2.gz SAWUMNZPGXEBCN-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO C[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1ccc(F)cc1O ZINC000062745232 184252190 /nfs/dbraw/zinc/25/21/90/184252190.db2.gz ZETPFIUTIRZRGS-SMDDNHRTSA-N 1 1 308.422 3.546 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(F)cc1O ZINC000273481201 130126278 /nfs/dbraw/zinc/12/62/78/130126278.db2.gz MBKJQYSMPFBLEI-WNDFPBNNSA-N 1 1 321.417 3.681 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273491835 130127589 /nfs/dbraw/zinc/12/75/89/130127589.db2.gz NKXPKYACSRHRPX-IEBWSBKVSA-N 1 1 315.388 3.883 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)c(O)c1C ZINC000273525900 130132572 /nfs/dbraw/zinc/13/25/72/130132572.db2.gz VCLLMCATTRIGHI-LRDDRELGSA-N 1 1 321.367 3.671 20 10 DHCDMO CC[C@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(F)cc1O ZINC000287357661 131276632 /nfs/dbraw/zinc/27/66/32/131276632.db2.gz HBUVSWPBIIFILI-HNNXBMFYSA-N 1 1 304.365 3.678 20 10 DHCDMO C[C@@H](c1ccccc1)[N@@H+](CCc1cn[nH]c1)Cc1ccccc1O ZINC000298553886 132067599 /nfs/dbraw/zinc/06/75/99/132067599.db2.gz VBSIRRVSRIRJOH-INIZCTEOSA-N 1 1 321.424 3.921 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c1O ZINC000294031539 335117132 /nfs/dbraw/zinc/11/71/32/335117132.db2.gz VQURTXYLTXLISG-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)ccc1O ZINC000185634804 333211045 /nfs/dbraw/zinc/21/10/45/333211045.db2.gz PREBVPKUVJCONV-CQSZACIVSA-N 1 1 320.452 3.979 20 10 DHCDMO C[C@@H](NC1CC[NH+](C(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000119860727 333261129 /nfs/dbraw/zinc/26/11/29/333261129.db2.gz UTRVGQWRZWGVKW-OAHLLOKOSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000119860727 333261130 /nfs/dbraw/zinc/26/11/30/333261130.db2.gz UTRVGQWRZWGVKW-OAHLLOKOSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H]([NH2+]CCC(C)(C)CO)c1cc(Cl)c(Cl)cc1O ZINC000296557374 335146085 /nfs/dbraw/zinc/14/60/85/335146085.db2.gz RZIGBGCMFIEBHO-VIFPVBQESA-N 1 1 306.233 3.758 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000271362385 334021387 /nfs/dbraw/zinc/02/13/87/334021387.db2.gz NPNMQTASPHGNMK-GOEBONIOSA-N 1 1 303.427 3.542 20 10 DHCDMO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc(F)ccc2O)cs1 ZINC000273460895 334047230 /nfs/dbraw/zinc/04/72/30/334047230.db2.gz CQDIWLMCQHGBMN-NXEZZACHSA-N 1 1 310.394 3.546 20 10 DHCDMO CC[C@@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccc(F)cc1O ZINC000286207569 334151908 /nfs/dbraw/zinc/15/19/08/334151908.db2.gz RWPTZLULYMKNFJ-QLJPJBMISA-N 1 1 306.381 3.808 20 10 DHCDMO CO[C@@]1(C)CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294652427 334211734 /nfs/dbraw/zinc/21/17/34/334211734.db2.gz KWFBYJXYQWZQRT-HNNXBMFYSA-N 1 1 301.789 3.576 20 10 DHCDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294652427 334211735 /nfs/dbraw/zinc/21/17/35/334211735.db2.gz KWFBYJXYQWZQRT-HNNXBMFYSA-N 1 1 301.789 3.576 20 10 DHCDMO Cc1csc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)n1 ZINC000299646550 334257002 /nfs/dbraw/zinc/25/70/02/334257002.db2.gz UREUQBCYCHOSJH-UHFFFAOYSA-N 1 1 300.427 3.555 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC(c2ncccc2Cl)CC1 ZINC000372965323 336943726 /nfs/dbraw/zinc/94/37/26/336943726.db2.gz CBVICAZDESBGRR-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1O ZINC000375531172 337012974 /nfs/dbraw/zinc/01/29/74/337012974.db2.gz ZPMLVTZMZIMWRM-LMMKCTJWSA-N 1 1 303.446 3.606 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000377641556 337057113 /nfs/dbraw/zinc/05/71/13/337057113.db2.gz AVBUBJAKGIZWHX-BXUZGUMPSA-N 1 1 304.415 3.755 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000377835783 337062191 /nfs/dbraw/zinc/06/21/91/337062191.db2.gz WLVGGUYVJYCQJA-HRCADAONSA-N 1 1 319.445 3.600 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H](c3ncc(C)s3)C2)c1O ZINC000360075871 337084906 /nfs/dbraw/zinc/08/49/06/337084906.db2.gz NXZMXCXAADRUCO-AWEZNQCLSA-N 1 1 318.442 3.545 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000179556292 337170304 /nfs/dbraw/zinc/17/03/04/337170304.db2.gz KBAMQOUQGQNLDH-OAHLLOKOSA-N 1 1 308.381 3.913 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1nnc(C)[nH]1)c1ccccc1)c1ccccc1O ZINC000185210254 337203475 /nfs/dbraw/zinc/20/34/75/337203475.db2.gz DGHHCYUEFXBOBO-FUHWJXTLSA-N 1 1 322.412 3.649 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccsc2)cc1OC ZINC000159840849 522773678 /nfs/dbraw/zinc/77/36/78/522773678.db2.gz MQZDMPUEMJFHBL-CQSZACIVSA-N 1 1 319.426 3.808 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c1 ZINC000189926462 524740852 /nfs/dbraw/zinc/74/08/52/524740852.db2.gz ICIAOUXVGGTKOQ-OAHLLOKOSA-N 1 1 304.415 3.503 20 10 DHCDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2[O-])o1 ZINC000894474725 1013383369 /nfs/dbraw/zinc/38/33/69/1013383369.db2.gz DZZCZIVRVZJTNF-OAHLLOKOSA-N 1 1 323.339 3.747 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000894491207 1013388121 /nfs/dbraw/zinc/38/81/21/1013388121.db2.gz LESNXOYQGBYNSA-WCQYABFASA-N 1 1 317.351 3.872 20 10 DHCDMO C[N@H+](Cc1ccc(F)cc1)Cc1c(O)cccc1Br ZINC001140098506 1013430401 /nfs/dbraw/zinc/43/04/01/1013430401.db2.gz CGXLNNOPRHJDLF-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1)C[C@@H]1CCCO1 ZINC000070976152 1014080056 /nfs/dbraw/zinc/08/00/56/1014080056.db2.gz GXRDQLUDFPVHCQ-SFHVURJKSA-N 1 1 315.388 3.713 20 10 DHCDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)C[C@H](C)N1Cc1ccccc1 ZINC001168007555 1014433079 /nfs/dbraw/zinc/43/30/79/1014433079.db2.gz AWTPYQNQFJFCAT-XEMDLRDOSA-N 1 1 324.468 3.923 20 10 DHCDMO COc1ccc(C[N@H+]2CC3(CC=CC3)[C@@H]2C(C)C)c(O)c1OC ZINC000895121199 1014471843 /nfs/dbraw/zinc/47/18/43/1014471843.db2.gz JRTHEIFJMPFEPS-SFHVURJKSA-N 1 1 317.429 3.586 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCCc3sccc3C2)c1O ZINC000754726174 1015115671 /nfs/dbraw/zinc/11/56/71/1015115671.db2.gz FTKMSZMBRCXFKN-UHFFFAOYSA-N 1 1 303.427 3.719 20 10 DHCDMO COc1cc(C)cc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000895460353 1015164355 /nfs/dbraw/zinc/16/43/55/1015164355.db2.gz MJCUZOYSXPFWOT-OAHLLOKOSA-N 1 1 307.340 3.649 20 10 DHCDMO Cc1cc(C[NH2+]Cc2nccn2C2CC2)c(C)n1-c1ccccc1 ZINC000895631354 1015235980 /nfs/dbraw/zinc/23/59/80/1015235980.db2.gz IMXHONYWBGMZSZ-UHFFFAOYSA-N 1 1 320.440 3.915 20 10 DHCDMO C[N@@H+](CC/C=C/c1cccnc1)Cc1ccc(Cl)cc1O ZINC001140464355 1015503125 /nfs/dbraw/zinc/50/31/25/1015503125.db2.gz MMALTBNVCVIXJM-GORDUTHDSA-N 1 1 302.805 3.976 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896224881 1015510067 /nfs/dbraw/zinc/51/00/67/1015510067.db2.gz PUGUYICSPHQWOD-CYBMUJFWSA-N 1 1 303.299 3.567 20 10 DHCDMO COc1ccccc1CC[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001140466680 1015572002 /nfs/dbraw/zinc/57/20/02/1015572002.db2.gz KVSPWWDHZYIAFE-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO CCCOc1cc(C[NH2+]Cc2c(O)cccc2F)ccc1OC ZINC000896639689 1015693808 /nfs/dbraw/zinc/69/38/08/1015693808.db2.gz DEGHKJJXYHKVBN-UHFFFAOYSA-N 1 1 319.376 3.619 20 10 DHCDMO CCC[N@@H+](CCSc1ccncc1)Cc1ccccc1O ZINC001167522275 1016296294 /nfs/dbraw/zinc/29/62/94/1016296294.db2.gz XCYAQGZAMJNRBO-UHFFFAOYSA-N 1 1 302.443 3.792 20 10 DHCDMO COc1cccc(O[C@H](C)C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185574387 1017023756 /nfs/dbraw/zinc/02/37/56/1017023756.db2.gz XEMOTTMPSCEWEI-CHWSQXEVSA-N 1 1 319.376 3.658 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@H]2Cn2ccnc2C(C)C)c1O ZINC000362042824 1032207656 /nfs/dbraw/zinc/20/76/56/1032207656.db2.gz CQDCLZWJEINAIH-KRWDZBQOSA-N 1 1 313.445 3.685 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1 ZINC000294943815 1032222632 /nfs/dbraw/zinc/22/26/32/1032222632.db2.gz YCMNPCXSTAKEKL-OAHLLOKOSA-N 1 1 304.478 3.923 20 10 DHCDMO C[C@H]1CCc2nc(C[N@H+](C)Cc3ccccc3O)sc2C1 ZINC000091956819 1012347722 /nfs/dbraw/zinc/34/77/22/1012347722.db2.gz JHSPZYFMXKHKLY-LBPRGKRZSA-N 1 1 302.443 3.606 20 10 DHCDMO C[C@H]1CCc2nc(C[N@@H+](C)Cc3ccccc3O)sc2C1 ZINC000091956819 1012347736 /nfs/dbraw/zinc/34/77/36/1012347736.db2.gz JHSPZYFMXKHKLY-LBPRGKRZSA-N 1 1 302.443 3.606 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](OC)C[C@@H]2C)cc1F ZINC000799736361 1012495743 /nfs/dbraw/zinc/49/57/43/1012495743.db2.gz OZELKHKMNBIDPZ-HOCLYGCPSA-N 1 1 308.441 3.671 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1cc(F)cc(F)c1OC ZINC001143563015 1012840811 /nfs/dbraw/zinc/84/08/11/1012840811.db2.gz ILCKYUWSSRGPJI-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cc1C ZINC000773256188 1032661323 /nfs/dbraw/zinc/66/13/23/1032661323.db2.gz BFYJGAWEQRCGSU-SJORKVTESA-N 1 1 303.446 3.648 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)CCOc2ccccc2C)c1O ZINC000748090716 1013037155 /nfs/dbraw/zinc/03/71/55/1013037155.db2.gz WASLUSGRXQMQMC-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO COc1c(Cl)ccc(F)c1C[N@H+](C)Cc1ccccc1O ZINC001238347472 1017151292 /nfs/dbraw/zinc/15/12/92/1017151292.db2.gz YQVLPVMJUQRDDJ-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1c(Cl)ccc(F)c1C[N@@H+](C)Cc1ccccc1O ZINC001238347472 1017151322 /nfs/dbraw/zinc/15/13/22/1017151322.db2.gz YQVLPVMJUQRDDJ-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO Cc1csc(C[C@@H]2CC[N@@H+](Cc3cc(C)ccc3O)C2)n1 ZINC000897298535 1017341965 /nfs/dbraw/zinc/34/19/65/1017341965.db2.gz ATLBEZHAXAILCB-AWEZNQCLSA-N 1 1 302.443 3.530 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c(Cl)c1 ZINC000840921528 1017484158 /nfs/dbraw/zinc/48/41/58/1017484158.db2.gz VEVKZOLFICSJRA-KGLIPLIRSA-N 1 1 309.837 3.603 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858010825 1032741647 /nfs/dbraw/zinc/74/16/47/1032741647.db2.gz NFHWCLDIXPOUPV-SFHVURJKSA-N 1 1 324.424 3.708 20 10 DHCDMO c1cc2cc[nH+]cc2c(NCc2ccc(N3CCOCC3)cc2)c1 ZINC000325204533 1018159763 /nfs/dbraw/zinc/15/97/63/1018159763.db2.gz FCRBJTLEMYXLCH-UHFFFAOYSA-N 1 1 319.408 3.684 20 10 DHCDMO CCCN1CCC([NH2+][C@@H](CC)c2ccc(N(C)C)cc2)CC1 ZINC000161621082 1018253284 /nfs/dbraw/zinc/25/32/84/1018253284.db2.gz LRDIODPKPXRGFE-IBGZPJMESA-N 1 1 303.494 3.668 20 10 DHCDMO CCN1CCC([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000125205867 1032760431 /nfs/dbraw/zinc/76/04/31/1032760431.db2.gz LOTIKDTVHFUMSM-UHFFFAOYSA-N 1 1 315.505 3.593 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1ccc(F)cc1O ZINC000796682017 1018428901 /nfs/dbraw/zinc/42/89/01/1018428901.db2.gz GOEKBNZFLFOOIL-HZPDHXFCSA-N 1 1 322.449 3.936 20 10 DHCDMO CC(C)[N@@H+](CCCc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000764955756 1018436949 /nfs/dbraw/zinc/43/69/49/1018436949.db2.gz YVUMRBLESZDNNY-UHFFFAOYSA-N 1 1 311.473 3.991 20 10 DHCDMO C[C@H](Cn1ccnc1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278257995 1018470439 /nfs/dbraw/zinc/47/04/39/1018470439.db2.gz NKLUOLZNMMTCGA-ZJUUUORDSA-N 1 1 314.216 3.635 20 10 DHCDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000765099784 1018475809 /nfs/dbraw/zinc/47/58/09/1018475809.db2.gz KEWGZLSTKRQTLS-OLZOCXBDSA-N 1 1 311.381 3.901 20 10 DHCDMO CCOc1ccccc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858105813 1032768800 /nfs/dbraw/zinc/76/88/00/1032768800.db2.gz NQTXODUAFMEPHY-UHFFFAOYSA-N 1 1 320.383 3.719 20 10 DHCDMO COc1cccc(C[N@H+]2CCCCC[C@H]2c2ccncc2)c1O ZINC000157022746 1018578995 /nfs/dbraw/zinc/57/89/95/1018578995.db2.gz KOXFCQBMQTWMFS-KRWDZBQOSA-N 1 1 312.413 3.913 20 10 DHCDMO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(O)cccc1F ZINC001137839826 1018766867 /nfs/dbraw/zinc/76/68/67/1018766867.db2.gz LNUBAGRXLKSAJV-CYBMUJFWSA-N 1 1 303.377 3.603 20 10 DHCDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1c(O)cccc1F ZINC001137839826 1018766878 /nfs/dbraw/zinc/76/68/78/1018766878.db2.gz LNUBAGRXLKSAJV-CYBMUJFWSA-N 1 1 303.377 3.603 20 10 DHCDMO c1oc(-c2ccccc2)nc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921778444 1018814942 /nfs/dbraw/zinc/81/49/42/1018814942.db2.gz KTAISJSTHNKATR-UHFFFAOYSA-N 1 1 320.392 3.956 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc3c(c2)CCCO3)o1 ZINC000921779098 1018818013 /nfs/dbraw/zinc/81/80/13/1018818013.db2.gz YXWBECDPYZWHII-QGZVFWFLSA-N 1 1 315.413 3.644 20 10 DHCDMO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000715718488 1018950887 /nfs/dbraw/zinc/95/08/87/1018950887.db2.gz NXVCEBFCGJMOIC-ZDUSSCGKSA-N 1 1 316.214 3.914 20 10 DHCDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000715718488 1018950900 /nfs/dbraw/zinc/95/09/00/1018950900.db2.gz NXVCEBFCGJMOIC-ZDUSSCGKSA-N 1 1 316.214 3.914 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)cc1C ZINC000091958197 1019495519 /nfs/dbraw/zinc/49/55/19/1019495519.db2.gz ICOFHCCFGSXIAV-AEFFLSMTSA-N 1 1 315.413 3.690 20 10 DHCDMO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727429372 1019713522 /nfs/dbraw/zinc/71/35/22/1019713522.db2.gz JRSRSKVXTWJAGM-YCRPNKLZSA-N 1 1 323.436 3.843 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cccc2c1OCCO2 ZINC000727830553 1019816973 /nfs/dbraw/zinc/81/69/73/1019816973.db2.gz BKUFLUVBPWYFLS-UHFFFAOYSA-N 1 1 313.397 3.576 20 10 DHCDMO CCC[N@@H+](Cc1ccc(-n2ccnc2)cc1)Cc1ccccc1O ZINC000727831242 1019818131 /nfs/dbraw/zinc/81/81/31/1019818131.db2.gz QELUOYQUTHCRPW-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC001171760093 1032862838 /nfs/dbraw/zinc/86/28/38/1032862838.db2.gz QMRYLPUTXQHILR-XLIONFOSSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171760093 1032862854 /nfs/dbraw/zinc/86/28/54/1032862854.db2.gz QMRYLPUTXQHILR-XLIONFOSSA-N 1 1 324.468 3.877 20 10 DHCDMO CCN(Cc1ccccc1O)[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171760093 1032862871 /nfs/dbraw/zinc/86/28/71/1032862871.db2.gz QMRYLPUTXQHILR-XLIONFOSSA-N 1 1 324.468 3.877 20 10 DHCDMO Fc1ccc2onc(C[NH2+]Cc3ccc4c(c3)CCCO4)c2c1 ZINC000922314102 1019990226 /nfs/dbraw/zinc/99/02/26/1019990226.db2.gz IMHBXIVJXGFBDR-UHFFFAOYSA-N 1 1 312.344 3.582 20 10 DHCDMO c1cnc([C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C2CC2)nc1 ZINC000922582893 1020140530 /nfs/dbraw/zinc/14/05/30/1020140530.db2.gz OQVGAZSPKRANBU-LJQANCHMSA-N 1 1 322.456 3.708 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc(Cl)nc2)C2CC2)cc1 ZINC000731752012 1020146532 /nfs/dbraw/zinc/14/65/32/1020146532.db2.gz KVLRXLDWUHZQOH-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO C[N@@H+](CC(=O)C12CC3CC(CC(C3)C1)C2)Cc1ccccc1O ZINC000732202712 1020211231 /nfs/dbraw/zinc/21/12/31/1020211231.db2.gz DQACZMMWBCARRD-UHFFFAOYSA-N 1 1 313.441 3.610 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310081246 1020329844 /nfs/dbraw/zinc/32/98/44/1020329844.db2.gz JLBRBZKNMDZVKV-LAUBAEHRSA-N 1 1 324.468 3.955 20 10 DHCDMO [O-]c1cccc(Cl)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000733326440 1020373269 /nfs/dbraw/zinc/37/32/69/1020373269.db2.gz CPELWLDIYDWRGG-UHFFFAOYSA-N 1 1 310.869 3.791 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1Cc2cccc(F)c2C1 ZINC001171810821 1032896727 /nfs/dbraw/zinc/89/67/27/1032896727.db2.gz VYALFXSQVRONDZ-GOSISDBHSA-N 1 1 312.432 3.881 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000179568251 1020410319 /nfs/dbraw/zinc/41/03/19/1020410319.db2.gz NAOGQGXKGFMHPG-MRXNPFEDSA-N 1 1 311.381 3.501 20 10 DHCDMO CC(C)C[C@H]1COCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000733790216 1020446298 /nfs/dbraw/zinc/44/62/98/1020446298.db2.gz HMQBKGKWVSHHAX-INIZCTEOSA-N 1 1 321.461 3.642 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C)C2CCCC2)c1O ZINC000179796853 1020449757 /nfs/dbraw/zinc/44/97/57/1020449757.db2.gz OKZZWJBNNSWARS-UHFFFAOYSA-N 1 1 314.223 3.538 20 10 DHCDMO Cc1c(O)ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC001140741986 1020573900 /nfs/dbraw/zinc/57/39/00/1020573900.db2.gz GHDDMOFINLOJLW-UHFFFAOYSA-N 1 1 303.789 3.618 20 10 DHCDMO CCc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000735364618 1020722422 /nfs/dbraw/zinc/72/24/22/1020722422.db2.gz VXFODMKIDMCUEU-UHFFFAOYSA-N 1 1 324.468 3.718 20 10 DHCDMO CCc1cc(C[N@H+]2CCCO[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000738160313 1020861902 /nfs/dbraw/zinc/86/19/02/1020861902.db2.gz IKTLCBQNIGZJHV-AWEZNQCLSA-N 1 1 305.462 3.863 20 10 DHCDMO Cc1cc(C[NH2+][C@@H]2CCn3ccnc32)c(C)n1-c1ccccc1 ZINC000858541523 1032938942 /nfs/dbraw/zinc/93/89/42/1032938942.db2.gz BFCSWYWNTQCAMR-GOSISDBHSA-N 1 1 306.413 3.525 20 10 DHCDMO CCc1cc(C[N@H+](C)Cc2ccon2)c(O)c(C(C)(C)C)c1 ZINC000739881256 1020918854 /nfs/dbraw/zinc/91/88/54/1020918854.db2.gz YFQBZGZYDBWLEK-UHFFFAOYSA-N 1 1 302.418 3.872 20 10 DHCDMO CCc1cc(C[N@@H+](C)Cc2ccon2)c(O)c(C(C)(C)C)c1 ZINC000739881256 1020918863 /nfs/dbraw/zinc/91/88/63/1020918863.db2.gz YFQBZGZYDBWLEK-UHFFFAOYSA-N 1 1 302.418 3.872 20 10 DHCDMO CC[C@@H](CNCc1ccc(N(CC)CC)c(F)c1)[NH+]1CCCC1 ZINC000740000421 1020922684 /nfs/dbraw/zinc/92/26/84/1020922684.db2.gz CBTQAPITPKCSCE-KRWDZBQOSA-N 1 1 321.484 3.636 20 10 DHCDMO CCN(CC)c1ccc(CNC[C@H](C)[NH+]2CCCCC2)cc1F ZINC000740004248 1020923761 /nfs/dbraw/zinc/92/37/61/1020923761.db2.gz LSQWCVKNTDZKLH-INIZCTEOSA-N 1 1 321.484 3.636 20 10 DHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2c(O)ccc3ccncc32)C1(C)C ZINC000740861864 1020956387 /nfs/dbraw/zinc/95/63/87/1020956387.db2.gz SCXPEBSMSXWPHS-MSOLQXFVSA-N 1 1 314.429 3.576 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)Cc2ccc3c(c2)OCO3)cc1 ZINC000741752614 1021048548 /nfs/dbraw/zinc/04/85/48/1021048548.db2.gz COKCRKQMNAZCOO-UHFFFAOYSA-N 1 1 312.413 3.503 20 10 DHCDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)cs1 ZINC000264521945 1032950562 /nfs/dbraw/zinc/95/05/62/1032950562.db2.gz AIAUHUKCCFCBAU-ZDUSSCGKSA-N 1 1 301.459 3.903 20 10 DHCDMO CCC[N@@H+](Cc1cnc(OC)c(Cl)c1)Cc1ccccc1O ZINC000751996308 1021100996 /nfs/dbraw/zinc/10/09/96/1021100996.db2.gz CYHUKXIIDBCFQD-UHFFFAOYSA-N 1 1 320.820 3.861 20 10 DHCDMO COC1(C)CC[NH+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001236792590 1021272002 /nfs/dbraw/zinc/27/20/02/1021272002.db2.gz FOGHAZHPPSVIBC-UHFFFAOYSA-N 1 1 304.217 3.700 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCN(c3ccccc3)CC1)CCC2 ZINC000917484900 1021274670 /nfs/dbraw/zinc/27/46/70/1021274670.db2.gz KALXQORGNLAGQD-UHFFFAOYSA-N 1 1 322.452 3.593 20 10 DHCDMO CCN(CC)[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743394075 1021281911 /nfs/dbraw/zinc/28/19/11/1021281911.db2.gz CINLEZHZRJXFSH-QGZVFWFLSA-N 1 1 304.478 3.740 20 10 DHCDMO CCN(CC)[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743394075 1021281918 /nfs/dbraw/zinc/28/19/18/1021281918.db2.gz CINLEZHZRJXFSH-QGZVFWFLSA-N 1 1 304.478 3.740 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)S[C@@H](C)C3)c2c1 ZINC000743377544 1021284602 /nfs/dbraw/zinc/28/46/02/1021284602.db2.gz PSGHADVZFIUKBH-BETUJISGSA-N 1 1 317.454 3.880 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)cc1C ZINC000743408855 1021289484 /nfs/dbraw/zinc/28/94/84/1021289484.db2.gz 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CN(C)c1ccc(C[N@@H+](C)Cc2cccc(-n3cccn3)c2)cc1 ZINC000155180383 1022037721 /nfs/dbraw/zinc/03/77/21/1022037721.db2.gz OHHKAFUDHXGEMT-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc(N(C)C)cc3)[nH]c2c1 ZINC000766377888 1022086827 /nfs/dbraw/zinc/08/68/27/1022086827.db2.gz NCDCCZHPIHJVNN-CQSZACIVSA-N 1 1 308.429 3.788 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(-c2ncco2)cc1F ZINC001167733762 1022198102 /nfs/dbraw/zinc/19/81/02/1022198102.db2.gz COIXROGTBQQYIA-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@](C)(C(F)F)O1 ZINC000853631259 1022301199 /nfs/dbraw/zinc/30/11/99/1022301199.db2.gz UQQOLVZOYMFBEF-KZULUSFZSA-N 1 1 321.367 3.790 20 10 DHCDMO CC[C@@]1(C)C[N@@H+](Cc2ccc(N3CCCCC3)c(C)c2)CCO1 ZINC001169340915 1022360732 /nfs/dbraw/zinc/36/07/32/1022360732.db2.gz BYPZEHLJPUVNBU-FQEVSTJZSA-N 1 1 316.489 3.986 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1O ZINC000179562952 1022471386 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C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876545744 1033085891 /nfs/dbraw/zinc/08/58/91/1033085891.db2.gz NEWNHTWANLRIRV-QGZVFWFLSA-N 1 1 324.468 3.841 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)cc1F ZINC000768200360 1022912764 /nfs/dbraw/zinc/91/27/64/1022912764.db2.gz NAAGSUGHJQLPRI-UHFFFAOYSA-N 1 1 320.383 3.671 20 10 DHCDMO Cc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1C ZINC000768209018 1022915138 /nfs/dbraw/zinc/91/51/38/1022915138.db2.gz XAUKCPAYIAQQQF-UHFFFAOYSA-N 1 1 324.468 3.772 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)CC1CCCCC1 ZINC000876563219 1033091676 /nfs/dbraw/zinc/09/16/76/1033091676.db2.gz ZTLTWUFBYCECLD-UHFFFAOYSA-N 1 1 316.489 3.660 20 10 DHCDMO CC1CCC([N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)CC1 ZINC000768196562 1022924070 /nfs/dbraw/zinc/92/40/70/1022924070.db2.gz DXJYAQWDYZEVOB-UHFFFAOYSA-N 1 1 320.452 3.673 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)CCOc2ccccc2C)c1O ZINC000768212388 1022924653 /nfs/dbraw/zinc/92/46/53/1022924653.db2.gz HSZBBIYIVYIIGZ-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CCOc1ccc(C[N@@H+](CCOC)Cc2cccs2)c(O)c1 ZINC000768197680 1022926191 /nfs/dbraw/zinc/92/61/91/1022926191.db2.gz LUCKESXEGYOPKK-UHFFFAOYSA-N 1 1 321.442 3.501 20 10 DHCDMO CC(C)CC[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000768257126 1022936600 /nfs/dbraw/zinc/93/66/00/1022936600.db2.gz GZAVSQQNXWXCAH-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1O ZINC000768363850 1022953226 /nfs/dbraw/zinc/95/32/26/1022953226.db2.gz DRXLCKVBZBHTAB-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCSC(CC)(CC)C2)c1O ZINC000768529267 1022980769 /nfs/dbraw/zinc/98/07/69/1022980769.db2.gz RQUUMRQNEZVMCG-UHFFFAOYSA-N 1 1 309.475 3.899 20 10 DHCDMO COCC[C@H]1CCCC[N@@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000768541273 1022985860 /nfs/dbraw/zinc/98/58/60/1022985860.db2.gz MGTJVICNUMHIME-CQSZACIVSA-N 1 1 311.853 3.993 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCOC[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000278831198 1022992964 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CCC[N@@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1O ZINC000769201308 1023101877 /nfs/dbraw/zinc/10/18/77/1023101877.db2.gz RPTCDAWSRQSWJH-UHFFFAOYSA-N 1 1 309.413 3.691 20 10 DHCDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000769339493 1023128357 /nfs/dbraw/zinc/12/83/57/1023128357.db2.gz QIOKKLRYCFCTCB-DLBZAZTESA-N 1 1 316.489 3.922 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000769340754 1023128645 /nfs/dbraw/zinc/12/86/45/1023128645.db2.gz XUITVVNUUDVOBN-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)c1O ZINC000769339374 1023129481 /nfs/dbraw/zinc/12/94/81/1023129481.db2.gz WCXAIZRNBAMKCE-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO COc1cccc(O)c1C[N@H+](C)Cc1ccc(F)cc1Cl ZINC000769382138 1023135819 /nfs/dbraw/zinc/13/58/19/1023135819.db2.gz VCGRDZYRZSEYNK-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000769382138 1023135822 /nfs/dbraw/zinc/13/58/22/1023135822.db2.gz 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ZOLSUMXHJLAZRN-MRXNPFEDSA-N 1 1 315.816 3.558 20 10 DHCDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792181270 1024643895 /nfs/dbraw/zinc/64/38/95/1024643895.db2.gz ZOLSUMXHJLAZRN-MRXNPFEDSA-N 1 1 315.816 3.558 20 10 DHCDMO CC[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CCO1 ZINC001170170547 1024679728 /nfs/dbraw/zinc/67/97/28/1024679728.db2.gz UAYNPDFKYFIEJC-STQMWFEESA-N 1 1 320.820 3.641 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccncc2)c(C(F)(F)F)c1 ZINC000793076252 1024878738 /nfs/dbraw/zinc/87/87/38/1024878738.db2.gz MZPUPBLGFMSMGC-UHFFFAOYSA-N 1 1 323.362 3.798 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCC(C)(C)C1 ZINC000793355277 1024998813 /nfs/dbraw/zinc/99/88/13/1024998813.db2.gz BWAIZSSQLMGSER-INIZCTEOSA-N 1 1 320.452 3.673 20 10 DHCDMO C[C@]12CC[N@@H+](Cc3cc4c(cc3O)CCCC4)C[C@H]1C2(F)F ZINC000793517215 1025068530 /nfs/dbraw/zinc/06/85/30/1025068530.db2.gz FIWHCEJRASWKRX-SJORKVTESA-N 1 1 307.384 3.748 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1cccc(F)c1O)[C@@H](O)c1ccccc1 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/nfs/dbraw/zinc/75/31/78/1025753178.db2.gz DXFNIPMXLFHXOH-BKTGTZMESA-N 1 1 317.404 3.940 20 10 DHCDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(O)cccc2F)c(OC)c1 ZINC000886641480 1025755268 /nfs/dbraw/zinc/75/52/68/1025755268.db2.gz KSHNSDRKXRADNU-NWDGAFQWSA-N 1 1 319.376 3.960 20 10 DHCDMO CCc1cccc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1O ZINC000691527935 1025807186 /nfs/dbraw/zinc/80/71/86/1025807186.db2.gz VNYUFNPOMPMKNN-SFHVURJKSA-N 1 1 324.468 3.566 20 10 DHCDMO CC[C@H]([NH2+]CCCc1c(C)nn(C)c1C)c1ccc(F)cc1O ZINC000796857080 1025866596 /nfs/dbraw/zinc/86/65/96/1025866596.db2.gz YVYPXRNRQZYITP-KRWDZBQOSA-N 1 1 319.424 3.555 20 10 DHCDMO Cc1noc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)ccc2O)n1 ZINC000729684160 1025946860 /nfs/dbraw/zinc/94/68/60/1025946860.db2.gz KADQARAPYRILLY-LBPRGKRZSA-N 1 1 309.369 3.601 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000245711977 1026151946 /nfs/dbraw/zinc/15/19/46/1026151946.db2.gz GDUHADOYZBSRBI-ICSRJNTNSA-N 1 1 314.473 3.678 20 10 DHCDMO COCC(C)(C)CCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808428764 1026298837 /nfs/dbraw/zinc/29/88/37/1026298837.db2.gz OODUAFWLTNZPHE-UHFFFAOYSA-N 1 1 303.805 3.727 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000178853576 1026324317 /nfs/dbraw/zinc/32/43/17/1026324317.db2.gz DGHDJIBGWZOXHK-UHFFFAOYSA-N 1 1 300.358 3.549 20 10 DHCDMO CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])CC1 ZINC000808691407 1026349367 /nfs/dbraw/zinc/34/93/67/1026349367.db2.gz MACMFWJMBIRTDP-ZDUSSCGKSA-N 1 1 310.869 3.737 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)c1O ZINC000808707086 1026357314 /nfs/dbraw/zinc/35/73/14/1026357314.db2.gz ZZCUTRSCDJDZNA-QMTHXVAHSA-N 1 1 305.809 3.805 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cncc(OC)c2)cc1 ZINC000808705910 1026358550 /nfs/dbraw/zinc/35/85/50/1026358550.db2.gz BATUJFYPARFTCZ-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700203 1026586855 /nfs/dbraw/zinc/58/68/55/1026586855.db2.gz ACNVTONEKXUGKH-RYUDHWBXSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700203 1026586863 /nfs/dbraw/zinc/58/68/63/1026586863.db2.gz ACNVTONEKXUGKH-RYUDHWBXSA-N 1 1 315.816 3.700 20 10 DHCDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000809766978 1026606372 /nfs/dbraw/zinc/60/63/72/1026606372.db2.gz CTFBHLKHHQHSHH-LBPRGKRZSA-N 1 1 303.855 3.628 20 10 DHCDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765520 1026619729 /nfs/dbraw/zinc/61/97/29/1026619729.db2.gz NSEGANLEUGTAJA-OXJNMPFZSA-N 1 1 324.468 3.831 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+](Cc2cccnc2)C2CC2)c1O ZINC000809763743 1026619896 /nfs/dbraw/zinc/61/98/96/1026619896.db2.gz QOBQYAUYOBBDJH-UHFFFAOYSA-N 1 1 302.805 3.914 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H](C)c1cccnc1 ZINC000809765318 1026620470 /nfs/dbraw/zinc/62/04/70/1026620470.db2.gz MQIYIUUUNVYKIR-AWEZNQCLSA-N 1 1 301.409 3.870 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+](Cc2ccccn2)C2CC2)c1O ZINC000809763799 1026620612 /nfs/dbraw/zinc/62/06/12/1026620612.db2.gz RKXFKSPSMODISK-UHFFFAOYSA-N 1 1 302.805 3.914 20 10 DHCDMO Cc1nc(C)c(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000809935904 1026641409 /nfs/dbraw/zinc/64/14/09/1026641409.db2.gz ODGUJNBCWIIATF-UHFFFAOYSA-N 1 1 301.434 3.768 20 10 DHCDMO Oc1c(F)cccc1C[NH2+]CC1CCN(c2ccccc2)CC1 ZINC000280518080 1026661974 /nfs/dbraw/zinc/66/19/74/1026661974.db2.gz HKOCOQFOBBMZTR-UHFFFAOYSA-N 1 1 314.404 3.538 20 10 DHCDMO CCCCC[N@@H+](CCO)Cc1ccc(N2CCCCC2)cc1 ZINC000768241637 1026683848 /nfs/dbraw/zinc/68/38/48/1026683848.db2.gz ZTPWHRHUDWTFRE-UHFFFAOYSA-N 1 1 304.478 3.661 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1F ZINC000295348192 1027215610 /nfs/dbraw/zinc/21/56/10/1027215610.db2.gz YSKWGYLLVUDRFM-CZUORRHYSA-N 1 1 316.424 3.664 20 10 DHCDMO CC[N@H+](Cc1cc(OC)cc(C(C)(C)C)c1O)C[C@H](C)OC ZINC000812303629 1027239995 /nfs/dbraw/zinc/23/99/95/1027239995.db2.gz QSNANJDTQDVIBZ-ZDUSSCGKSA-N 1 1 309.450 3.555 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1ccc(N(C)C)cc1 ZINC000812345714 1027257557 /nfs/dbraw/zinc/25/75/57/1027257557.db2.gz KLIUQSRLYBMVSX-UHFFFAOYSA-N 1 1 313.445 3.729 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1 ZINC000812840010 1027439578 /nfs/dbraw/zinc/43/95/78/1027439578.db2.gz FHERIZOHDBNQJE-XUVXKRRUSA-N 1 1 316.489 3.658 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812854098 1027452476 /nfs/dbraw/zinc/45/24/76/1027452476.db2.gz VJUWEMPMEWVSBV-JXFKEZNVSA-N 1 1 312.457 3.697 20 10 DHCDMO CCOCc1cc(C[NH2+]Cc2ccc(Cl)o2)ccc1OC ZINC000747854620 1027626471 /nfs/dbraw/zinc/62/64/71/1027626471.db2.gz SZAAOGNMEIPBSV-UHFFFAOYSA-N 1 1 309.793 3.768 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)[C@@H](C)C(C)C)cc2)CC1 ZINC000296662450 1027702612 /nfs/dbraw/zinc/70/26/12/1027702612.db2.gz YNXJJNHYSDGGLD-INIZCTEOSA-N 1 1 304.478 3.778 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CCCC1 ZINC000159129522 1027731976 /nfs/dbraw/zinc/73/19/76/1027731976.db2.gz UIGZMFDFYJRLGT-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCO[C@H](C)C1 ZINC000778996876 1027740195 /nfs/dbraw/zinc/74/01/95/1027740195.db2.gz UYTZBWACOZJKDV-AEFFLSMTSA-N 1 1 304.478 3.778 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCO[C@@H](C)C1 ZINC000778996877 1027741716 /nfs/dbraw/zinc/74/17/16/1027741716.db2.gz UYTZBWACOZJKDV-FUHWJXTLSA-N 1 1 304.478 3.778 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@@H]4CCC[C@@H]4C3)cc2)CC1 ZINC000296819170 1027742690 /nfs/dbraw/zinc/74/26/90/1027742690.db2.gz QULBXZUOJJAOFO-HDICACEKSA-N 1 1 314.473 3.534 20 10 DHCDMO C[C@H](CN[C@H](C)c1ccc(N2CCCCC2)c(F)c1)C[NH+](C)C ZINC000813879192 1027749654 /nfs/dbraw/zinc/74/96/54/1027749654.db2.gz SYENLHDPFJCATA-HZPDHXFCSA-N 1 1 321.484 3.664 20 10 DHCDMO C[C@@H](CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1)C[NH+](C)C ZINC000813879191 1027750343 /nfs/dbraw/zinc/75/03/43/1027750343.db2.gz SYENLHDPFJCATA-HOTGVXAUSA-N 1 1 321.484 3.664 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000779002753 1027750705 /nfs/dbraw/zinc/75/07/05/1027750705.db2.gz NUQBYWDSJGHHKI-MJGOQNOKSA-N 1 1 315.388 3.619 20 10 DHCDMO C[N@H+](Cc1ccccc1O)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000779001453 1027751959 /nfs/dbraw/zinc/75/19/59/1027751959.db2.gz DZVRXESVPUHIBI-UYAOXDASSA-N 1 1 311.425 3.992 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@H+]([C@@H](CC)c3ccccc3O)C2)no1 ZINC000364624508 1027858889 /nfs/dbraw/zinc/85/88/89/1027858889.db2.gz SYFKONWGEGQECP-HIFRSBDPSA-N 1 1 315.417 3.668 20 10 DHCDMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000008186368 1028051638 /nfs/dbraw/zinc/05/16/38/1028051638.db2.gz MDVFXMFDOASGIT-ZDUSSCGKSA-N 1 1 317.410 3.692 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1 ZINC000366544074 1028098113 /nfs/dbraw/zinc/09/81/13/1028098113.db2.gz KNYCBRCAZHLMCY-FZKQIMNGSA-N 1 1 312.413 3.940 20 10 DHCDMO CN(C)c1ccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000368040587 1028288983 /nfs/dbraw/zinc/28/89/83/1028288983.db2.gz ZAQYXIBHAGMRHJ-UHFFFAOYSA-N 1 1 309.413 3.517 20 10 DHCDMO CN(C)c1ccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000368040587 1028289000 /nfs/dbraw/zinc/28/90/00/1028289000.db2.gz ZAQYXIBHAGMRHJ-UHFFFAOYSA-N 1 1 309.413 3.517 20 10 DHCDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(N(C)C)c(C)c2)o1 ZINC000815089844 1028358368 /nfs/dbraw/zinc/35/83/68/1028358368.db2.gz OBPVFPXIVIROHK-QGZVFWFLSA-N 1 1 316.445 3.694 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@@H]2c2ccnn2C)cc1 ZINC000815107557 1028379884 /nfs/dbraw/zinc/37/98/84/1028379884.db2.gz QQPMWOQOPFKTNQ-LJQANCHMSA-N 1 1 312.461 3.603 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cncc(F)c2)cc1 ZINC000779147916 1028431841 /nfs/dbraw/zinc/43/18/41/1028431841.db2.gz RLCWSKPBPCKSFB-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1c(F)cccc1F ZINC000075829126 1028539081 /nfs/dbraw/zinc/53/90/81/1028539081.db2.gz RHMXYRIZYKKHAB-QGZVFWFLSA-N 1 1 321.367 3.616 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCCO1)c1cccc(C(F)(F)F)c1O ZINC000815566289 1028545907 /nfs/dbraw/zinc/54/59/07/1028545907.db2.gz OLGSPOXINSQFBJ-WDEREUQCSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cccc(C(F)(F)F)c1O ZINC000815576134 1028548457 /nfs/dbraw/zinc/54/84/57/1028548457.db2.gz KFSLHLXGQQKWTQ-WDEREUQCSA-N 1 1 316.367 3.544 20 10 DHCDMO CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1(C)C ZINC000815587472 1028557417 /nfs/dbraw/zinc/55/74/17/1028557417.db2.gz KUBTYQCMBCDWKV-TVYUQYBPSA-N 1 1 317.351 3.875 20 10 DHCDMO C[C@@H]([NH2+]C1CCSCC1)c1cccc(C(F)(F)F)c1O ZINC000815591995 1028559161 /nfs/dbraw/zinc/55/91/61/1028559161.db2.gz WAXYQRDNBSGLBU-SECBINFHSA-N 1 1 305.365 3.957 20 10 DHCDMO Cc1cncc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)c1 ZINC000815598721 1028563998 /nfs/dbraw/zinc/56/39/98/1028563998.db2.gz AXUJGAAAABTMGP-LLVKDONJSA-N 1 1 310.319 3.965 20 10 DHCDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816494403 1028897575 /nfs/dbraw/zinc/89/75/75/1028897575.db2.gz JWQQYALKTMEKDE-MRXNPFEDSA-N 1 1 321.424 3.659 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC(c2ccccn2)CC1 ZINC000816496514 1028902468 /nfs/dbraw/zinc/90/24/68/1028902468.db2.gz MUYPDAUDFDXKJH-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO COc1ccc(C)cc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816531223 1028922944 /nfs/dbraw/zinc/92/29/44/1028922944.db2.gz KGPXRCAUFFVCPK-UHFFFAOYSA-N 1 1 309.768 3.792 20 10 DHCDMO C[C@@H](COc1ccccc1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816541936 1028927854 /nfs/dbraw/zinc/92/78/54/1028927854.db2.gz YNXBGBHJCXOLMN-NSHDSACASA-N 1 1 309.768 3.742 20 10 DHCDMO C[C@](CO)([NH2+]Cc1cc(Cl)c(F)cc1O)C1CCCCC1 ZINC000816552112 1028939545 /nfs/dbraw/zinc/93/95/45/1028939545.db2.gz BAOHUBAKMDKDDY-MRXNPFEDSA-N 1 1 315.816 3.606 20 10 DHCDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cc2c(cc1O)OCO2 ZINC000190390269 1028939992 /nfs/dbraw/zinc/93/99/92/1028939992.db2.gz VOEAOVCFFBBICW-UHFFFAOYSA-N 1 1 324.380 3.624 20 10 DHCDMO CC(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554780 1028940756 /nfs/dbraw/zinc/94/07/56/1028940756.db2.gz IVUPRMPHZVHJGT-MEDUHNTESA-N 1 1 315.816 3.726 20 10 DHCDMO CCO[C@H](CC[NH2+]Cc1cc(Cl)c(F)cc1O)C(C)C ZINC000816555818 1028941830 /nfs/dbraw/zinc/94/18/30/1028941830.db2.gz QYWNJHFZNLFHKR-OAHLLOKOSA-N 1 1 303.805 3.726 20 10 DHCDMO CC(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554778 1028942858 /nfs/dbraw/zinc/94/28/58/1028942858.db2.gz IVUPRMPHZVHJGT-BDJLRTHQSA-N 1 1 315.816 3.726 20 10 DHCDMO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000816559661 1028945929 /nfs/dbraw/zinc/94/59/29/1028945929.db2.gz QURPPPZNGPWRTH-XHDPSFHLSA-N 1 1 315.816 3.868 20 10 DHCDMO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2O)[C@H]1[C@H]1CCCO1 ZINC000816614084 1028962474 /nfs/dbraw/zinc/96/24/74/1028962474.db2.gz MIFPCLDBJVDPMG-MJGOQNOKSA-N 1 1 311.425 3.935 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c1 ZINC000816642593 1028969495 /nfs/dbraw/zinc/96/94/95/1028969495.db2.gz DYSZZHWLOJBZBZ-HNNXBMFYSA-N 1 1 317.351 3.632 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1[O-] ZINC000817585494 1029212410 /nfs/dbraw/zinc/21/24/10/1029212410.db2.gz FILHNIVIYREHNR-GRTSSRMGSA-N 1 1 310.869 3.877 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000817934792 1029277991 /nfs/dbraw/zinc/27/79/91/1029277991.db2.gz PGJKFTNIYQMKRX-JHVJFLLYSA-N 1 1 323.484 3.726 20 10 DHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)s1 ZINC000817938781 1029279867 /nfs/dbraw/zinc/27/98/67/1029279867.db2.gz SIIWKQFJUXCEKF-BXUZGUMPSA-N 1 1 323.893 3.818 20 10 DHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc2c(c1)CCC2 ZINC000817938629 1029282582 /nfs/dbraw/zinc/28/25/82/1029282582.db2.gz OPXQOPVOYHPBRW-QVKFZJNVSA-N 1 1 323.484 3.592 20 10 DHCDMO C[C@@H]1C[C@@H](NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c2ccccc21 ZINC000817939501 1029282619 /nfs/dbraw/zinc/28/26/19/1029282619.db2.gz BXAWYCGDTJCNOE-JSNMRZPZSA-N 1 1 309.457 3.591 20 10 DHCDMO Cc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1C ZINC000817938050 1029284170 /nfs/dbraw/zinc/28/41/70/1029284170.db2.gz CKTWTVSTCDOSLU-OXJNMPFZSA-N 1 1 311.473 3.720 20 10 DHCDMO C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817964780 1029301639 /nfs/dbraw/zinc/30/16/39/1029301639.db2.gz IHNYTJQMJNSEOA-YLJYHZDGSA-N 1 1 315.505 3.717 20 10 DHCDMO C[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000817971200 1029311529 /nfs/dbraw/zinc/31/15/29/1029311529.db2.gz KLBWDKKKEHTXCU-UWVAXJGDSA-N 1 1 315.505 3.716 20 10 DHCDMO C[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817971169 1029311751 /nfs/dbraw/zinc/31/17/51/1029311751.db2.gz JWUOMTHYUJIDGG-HLLBOEOZSA-N 1 1 319.468 3.607 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cn(C(C)C)nn2)cc1 ZINC000924710316 1030167901 /nfs/dbraw/zinc/16/79/01/1030167901.db2.gz JHTSAUWDLZNQCV-HNNXBMFYSA-N 1 1 315.465 3.556 20 10 DHCDMO COCCc1cc[nH+]c(N[C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841758729 1030231651 /nfs/dbraw/zinc/23/16/51/1030231651.db2.gz UULZHICOSYRBHJ-NSHDSACASA-N 1 1 306.793 3.803 20 10 DHCDMO CCC(O)(CC)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000777541899 1030250659 /nfs/dbraw/zinc/25/06/59/1030250659.db2.gz SDOQWYRCJDEWLF-UHFFFAOYSA-N 1 1 304.478 3.660 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1C ZINC000291011993 1030288225 /nfs/dbraw/zinc/28/82/25/1030288225.db2.gz WXKDBDPPGYYPJR-QZTJIDSGSA-N 1 1 301.430 3.543 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](OCC3CC3)C1)CCCC2 ZINC000777547531 1030294773 /nfs/dbraw/zinc/29/47/73/1030294773.db2.gz CLPMQWGOFSAIAF-IBGZPJMESA-N 1 1 315.457 3.662 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)c1ccc(Cl)cc1O ZINC000866538561 1030359419 /nfs/dbraw/zinc/35/94/19/1030359419.db2.gz CBBCQUCFFFTTHX-RBOXIYTFSA-N 1 1 309.837 3.759 20 10 DHCDMO C[C@@H]([NH2+]CCSCCC(F)(F)F)c1ccc(F)cc1O ZINC000866543690 1030364588 /nfs/dbraw/zinc/36/45/88/1030364588.db2.gz ULMVCYUPYJZPRX-SECBINFHSA-N 1 1 311.344 3.868 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1n1ccnc1 ZINC000121626386 1030448311 /nfs/dbraw/zinc/44/83/11/1030448311.db2.gz SLIMOMTWXNTFOL-BEFAXECRSA-N 1 1 321.424 3.825 20 10 DHCDMO Cc1cc(C(=O)C[N@H+](C)C(C)(C)C)c(C)n1-c1ccc(F)cn1 ZINC000830566100 1030477113 /nfs/dbraw/zinc/47/71/13/1030477113.db2.gz HZFZAUJTJPTJAE-UHFFFAOYSA-N 1 1 317.408 3.541 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1O ZINC000291443768 1030505748 /nfs/dbraw/zinc/50/57/48/1030505748.db2.gz CBNVFMNKJJKEKF-SECBINFHSA-N 1 1 305.752 3.531 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc3ccncc3s2)cc1 ZINC000824474521 1030560194 /nfs/dbraw/zinc/56/01/94/1030560194.db2.gz PBNZQMLZRLLPOY-UHFFFAOYSA-N 1 1 311.454 3.994 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@H]1CCc3c(Cl)cccc3C1)CC2 ZINC001171057124 1030569937 /nfs/dbraw/zinc/56/99/37/1030569937.db2.gz UTSXLAUCBQWLBB-HNNXBMFYSA-N 1 1 313.828 3.961 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCn3ccnc32)cc1 ZINC000824522401 1030574429 /nfs/dbraw/zinc/57/44/29/1030574429.db2.gz VVHRULWKFXGUCT-SFHVURJKSA-N 1 1 312.461 3.744 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCn3ccnc32)cc1 ZINC000824522399 1030574523 /nfs/dbraw/zinc/57/45/23/1030574523.db2.gz VVHRULWKFXGUCT-GOSISDBHSA-N 1 1 312.461 3.744 20 10 DHCDMO CC[C@H](CO)[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000824537602 1030584130 /nfs/dbraw/zinc/58/41/30/1030584130.db2.gz FJLFTBAGIBUTOT-MRXNPFEDSA-N 1 1 318.486 3.587 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1Cl ZINC000824926814 1030674238 /nfs/dbraw/zinc/67/42/38/1030674238.db2.gz HKQBZJPCJVZJTC-WBMJQRKESA-N 1 1 319.836 3.634 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)c(O)c1 ZINC000825215076 1030750193 /nfs/dbraw/zinc/75/01/93/1030750193.db2.gz FYHGBPNBZHRSME-QGZVFWFLSA-N 1 1 307.459 3.510 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)cc1F ZINC000825215436 1030750958 /nfs/dbraw/zinc/75/09/58/1030750958.db2.gz OWMWQCGKXWVYRK-QGZVFWFLSA-N 1 1 308.466 3.611 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2c(c1)COC2 ZINC001137028850 1030796581 /nfs/dbraw/zinc/79/65/81/1030796581.db2.gz ICNREHIYJXTZFR-UHFFFAOYSA-N 1 1 310.441 3.805 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1OCCc2ccccc21)c1ccc(F)cc1O ZINC000927115373 1031100315 /nfs/dbraw/zinc/10/03/15/1031100315.db2.gz LGJWXQHCBHRFJC-DJJJIMSYSA-N 1 1 315.388 3.886 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844745708 1031311586 /nfs/dbraw/zinc/31/15/86/1031311586.db2.gz FEQMEKDMPCBLMV-INIZCTEOSA-N 1 1 304.340 3.562 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@@]3(CC3(F)F)C1)CCCC2 ZINC000844749189 1031312876 /nfs/dbraw/zinc/31/28/76/1031312876.db2.gz FPHKDZMDYKWKBQ-QGZVFWFLSA-N 1 1 307.384 3.892 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CC[C@@]4(CC4(F)F)C3)c2c1 ZINC000844759860 1031319004 /nfs/dbraw/zinc/31/90/04/1031319004.db2.gz MTNSOTGGFKTYLF-QGZVFWFLSA-N 1 1 319.351 3.785 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1[O-] ZINC000844924111 1031403337 /nfs/dbraw/zinc/40/33/37/1031403337.db2.gz MPINBDDNGDKRCO-INIZCTEOSA-N 1 1 322.811 3.884 20 10 DHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000844926409 1031403739 /nfs/dbraw/zinc/40/37/39/1031403739.db2.gz ZRXXUCOXVHWBMC-LBPRGKRZSA-N 1 1 304.821 3.616 20 10 DHCDMO C[C@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299106 1031439114 /nfs/dbraw/zinc/43/91/14/1031439114.db2.gz PKWBEFNLMVUDJD-VIFPVBQESA-N 1 1 302.187 3.526 20 10 DHCDMO C[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299106 1031439122 /nfs/dbraw/zinc/43/91/22/1031439122.db2.gz PKWBEFNLMVUDJD-VIFPVBQESA-N 1 1 302.187 3.526 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001144299030 1031439476 /nfs/dbraw/zinc/43/94/76/1031439476.db2.gz PESFBTHBWMEFFJ-SNVBAGLBSA-N 1 1 320.177 3.618 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CCC[C@@H](F)CC1 ZINC001144299030 1031439480 /nfs/dbraw/zinc/43/94/80/1031439480.db2.gz PESFBTHBWMEFFJ-SNVBAGLBSA-N 1 1 320.177 3.618 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cc(C)nnc2C)cc1 ZINC000929184878 1031459034 /nfs/dbraw/zinc/45/90/34/1031459034.db2.gz MOGWMAHAXKKSDF-UHFFFAOYSA-N 1 1 312.461 3.572 20 10 DHCDMO Cc1cnc([C@H](C)C[NH2+]Cc2cc(Cl)c(F)cc2O)s1 ZINC000293651898 1031558587 /nfs/dbraw/zinc/55/85/87/1031558587.db2.gz OUOZPYYTLGGUOL-MRVPVSSYSA-N 1 1 314.813 3.843 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1 ZINC000872261074 1031566281 /nfs/dbraw/zinc/56/62/81/1031566281.db2.gz ZIXJGRQXJORYGR-IBGZPJMESA-N 1 1 302.462 3.676 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)c1O ZINC000872746837 1031651266 /nfs/dbraw/zinc/65/12/66/1031651266.db2.gz MCIOEBVDWLNSKM-UHFFFAOYSA-N 1 1 310.397 3.823 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1)Cc1c(O)cc(O)cc1O ZINC001144509560 1031665346 /nfs/dbraw/zinc/66/53/46/1031665346.db2.gz ZDSLGNXCARQKAG-UHFFFAOYSA-N 1 1 301.386 3.606 20 10 DHCDMO Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2c(O)cc(O)cc2O)c1 ZINC001144516240 1031675499 /nfs/dbraw/zinc/67/54/99/1031675499.db2.gz UVODGKPNCSIQRD-KRWDZBQOSA-N 1 1 313.397 3.757 20 10 DHCDMO CC(C)c1nccn1C[C@H]1CCC[N@@H+]1Cc1cccc(F)c1O ZINC000361064768 1031705206 /nfs/dbraw/zinc/70/52/06/1031705206.db2.gz BQYQUSITWXUGFF-OAHLLOKOSA-N 1 1 317.408 3.516 20 10 DHCDMO CC(C)c1nccn1C[C@H]1CCC[N@H+]1Cc1cccc(F)c1O ZINC000361064768 1031705218 /nfs/dbraw/zinc/70/52/18/1031705218.db2.gz BQYQUSITWXUGFF-OAHLLOKOSA-N 1 1 317.408 3.516 20 10 DHCDMO COc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)cc1C ZINC000873175872 1031740658 /nfs/dbraw/zinc/74/06/58/1031740658.db2.gz UYVCFOBXYGXNAE-UHFFFAOYSA-N 1 1 314.429 3.796 20 10 DHCDMO C[C@H]([NH2+]CC[C@@H]1CNc2ccccc21)c1ccc(F)cc1O ZINC000873237491 1031770609 /nfs/dbraw/zinc/77/06/09/1031770609.db2.gz PVFRLWYRKWBWIN-QWHCGFSZSA-N 1 1 300.377 3.781 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc2ccccc2c1[O-] ZINC000873264407 1031779424 /nfs/dbraw/zinc/77/94/24/1031779424.db2.gz OXRUTAZXDTXNHW-DIECFANBSA-N 1 1 310.441 3.727 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846103876 1031875719 /nfs/dbraw/zinc/87/57/19/1031875719.db2.gz AXXLRZHTWLXMFY-CYBMUJFWSA-N 1 1 305.727 3.806 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846103876 1031875731 /nfs/dbraw/zinc/87/57/31/1031875731.db2.gz AXXLRZHTWLXMFY-CYBMUJFWSA-N 1 1 305.727 3.806 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2c(C)cccc2O)o1 ZINC000877396003 1033294975 /nfs/dbraw/zinc/29/49/75/1033294975.db2.gz QLSGULNPCRJFED-INIZCTEOSA-N 1 1 301.386 3.777 20 10 DHCDMO Cc1ccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c(O)c1 ZINC000877470000 1033310452 /nfs/dbraw/zinc/31/04/52/1033310452.db2.gz CJGKSYRQISRIPG-AWEZNQCLSA-N 1 1 323.396 3.525 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ncc[nH]2)cc1 ZINC000877674355 1033408238 /nfs/dbraw/zinc/40/82/38/1033408238.db2.gz UQTKGISLPJUYHJ-UHFFFAOYSA-N 1 1 320.440 3.726 20 10 DHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)n1 ZINC000877813679 1033462942 /nfs/dbraw/zinc/46/29/42/1033462942.db2.gz NPALWDKCVKGYBT-LLVKDONJSA-N 1 1 308.834 3.800 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@@H](C(F)(F)F)O1 ZINC000877824114 1033473198 /nfs/dbraw/zinc/47/31/98/1033473198.db2.gz OVVLNYMMSORTJT-RNCFNFMXSA-N 1 1 323.742 3.587 20 10 DHCDMO CO[C@H]1C[C@@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC000877921205 1033515972 /nfs/dbraw/zinc/51/59/72/1033515972.db2.gz DKTPEDAUZUFEMQ-IZAXUBKRSA-N 1 1 302.462 3.534 20 10 DHCDMO CCSC[C@@H](C)[NH2+]Cc1cc(Cl)c2cccnc2c1O ZINC001173287665 1033679600 /nfs/dbraw/zinc/67/96/00/1033679600.db2.gz KOKZFNYEMMSSNC-SNVBAGLBSA-N 1 1 310.850 3.825 20 10 DHCDMO Cc1nc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)[nH]c1C ZINC000862221961 1033782650 /nfs/dbraw/zinc/78/26/50/1033782650.db2.gz LEABMZRYWJQOEN-UHFFFAOYSA-N 1 1 300.450 3.503 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)[nH]c1C ZINC000862221961 1033782662 /nfs/dbraw/zinc/78/26/62/1033782662.db2.gz LEABMZRYWJQOEN-UHFFFAOYSA-N 1 1 300.450 3.503 20 10 DHCDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862323071 1033815941 /nfs/dbraw/zinc/81/59/41/1033815941.db2.gz RTHGGEBBOPLIOW-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862323071 1033815954 /nfs/dbraw/zinc/81/59/54/1033815954.db2.gz RTHGGEBBOPLIOW-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1F ZINC000862367123 1033831749 /nfs/dbraw/zinc/83/17/49/1033831749.db2.gz WUUDFVYQVXBKJC-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2c2cccnc2)cc1F ZINC000862367123 1033831756 /nfs/dbraw/zinc/83/17/56/1033831756.db2.gz WUUDFVYQVXBKJC-KRWDZBQOSA-N 1 1 317.383 3.763 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473535 1033862565 /nfs/dbraw/zinc/86/25/65/1033862565.db2.gz UUEPWTSAYXVTGI-MNOVXSKESA-N 1 1 301.814 3.655 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473535 1033862579 /nfs/dbraw/zinc/86/25/79/1033862579.db2.gz UUEPWTSAYXVTGI-MNOVXSKESA-N 1 1 301.814 3.655 20 10 DHCDMO Oc1ccc([C@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)cc1 ZINC000862541553 1033884627 /nfs/dbraw/zinc/88/46/27/1033884627.db2.gz WECUDPXBUQHTST-ZDUSSCGKSA-N 1 1 303.789 3.741 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)c1O ZINC000863320976 1034065153 /nfs/dbraw/zinc/06/51/53/1034065153.db2.gz MMHJMTMHYIXZKI-YTQUADARSA-N 1 1 323.436 3.945 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1nc(Cc2ccccc2)no1 ZINC000879648150 1034070096 /nfs/dbraw/zinc/07/00/96/1034070096.db2.gz AACPIZSIMBKGKR-ZIAGYGMSSA-N 1 1 323.396 3.778 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000863543549 1034122917 /nfs/dbraw/zinc/12/29/17/1034122917.db2.gz QKAGCQFRUVPFDV-RWMBFGLXSA-N 1 1 317.260 3.880 20 10 DHCDMO CCn1cc(CC[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000794555489 1034188286 /nfs/dbraw/zinc/18/82/86/1034188286.db2.gz MEBVVRGZFHRDMU-UHFFFAOYSA-N 1 1 313.445 3.596 20 10 DHCDMO CC[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000178255392 1034222417 /nfs/dbraw/zinc/22/24/17/1034222417.db2.gz LFABQGZRVXZXMM-HXUWFJFHSA-N 1 1 315.505 3.668 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000178254263 1034223682 /nfs/dbraw/zinc/22/36/82/1034223682.db2.gz XEZOPHMOBHFKKX-MRXNPFEDSA-N 1 1 315.505 3.668 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)NC2CC[NH+](CC3CC3)CC2)cc1 ZINC000178254263 1034223698 /nfs/dbraw/zinc/22/36/98/1034223698.db2.gz XEZOPHMOBHFKKX-MRXNPFEDSA-N 1 1 315.505 3.668 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000179570244 1034313878 /nfs/dbraw/zinc/31/38/78/1034313878.db2.gz RDICXUMHOQRNCF-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000179570244 1034313895 /nfs/dbraw/zinc/31/38/95/1034313895.db2.gz RDICXUMHOQRNCF-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000184691634 1034493216 /nfs/dbraw/zinc/49/32/16/1034493216.db2.gz LOUWZSAKHKQYAJ-LLVKDONJSA-N 1 1 321.804 3.953 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1ccc(F)cc1O ZINC000185323143 1034540017 /nfs/dbraw/zinc/54/00/17/1034540017.db2.gz NUGCOSAKBRKYSB-LBPRGKRZSA-N 1 1 317.360 3.543 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000211486735 1034570450 /nfs/dbraw/zinc/57/04/50/1034570450.db2.gz BOZPLQMWOGUUFR-RISCZKNCSA-N 1 1 310.235 3.919 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(F)cc1O ZINC000186354911 1034624514 /nfs/dbraw/zinc/62/45/14/1034624514.db2.gz VAVJYOITHPVARW-WPUCRFQZSA-N 1 1 305.393 3.530 20 10 DHCDMO C[C@H](O)C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192888595 1034820851 /nfs/dbraw/zinc/82/08/51/1034820851.db2.gz KGUOGFBVTCROHF-GUBZILKMSA-N 1 1 306.233 3.757 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)cc1 ZINC000773755681 1035439694 /nfs/dbraw/zinc/43/96/94/1035439694.db2.gz MTWUAKGSCAQDNW-NRFANRHFSA-N 1 1 324.468 3.889 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CCCO)Cc2ccccc2)cc1 ZINC000773766753 1035442923 /nfs/dbraw/zinc/44/29/23/1035442923.db2.gz VFRDDWLDVDNWFH-UHFFFAOYSA-N 1 1 312.457 3.527 20 10 DHCDMO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204240292 1035468580 /nfs/dbraw/zinc/46/85/80/1035468580.db2.gz NOTMNTHLMDGMGI-QGZVFWFLSA-N 1 1 312.457 3.905 20 10 DHCDMO COc1ccc(CN[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1C ZINC001179193963 1035470569 /nfs/dbraw/zinc/47/05/69/1035470569.db2.gz OQEBSBPIYUUPQH-QGZVFWFLSA-N 1 1 302.462 3.500 20 10 DHCDMO COc1ccc(C[NH2+][C@@H]2CCN(C3CCCCC3)C2)cc1C ZINC001179193963 1035470570 /nfs/dbraw/zinc/47/05/70/1035470570.db2.gz OQEBSBPIYUUPQH-QGZVFWFLSA-N 1 1 302.462 3.500 20 10 DHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC001179579532 1035483342 /nfs/dbraw/zinc/48/33/42/1035483342.db2.gz SBSRJEVHBLCAJB-VIFPVBQESA-N 1 1 324.739 3.944 20 10 DHCDMO CC1(C)CCC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)O1 ZINC001179740386 1035496089 /nfs/dbraw/zinc/49/60/89/1035496089.db2.gz NAYHSIDSCXTFGL-JTQLQIEISA-N 1 1 301.789 3.622 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c(O)c1 ZINC001180149090 1035610474 /nfs/dbraw/zinc/61/04/74/1035610474.db2.gz UOAQEJJUAQKDJT-OXJNMPFZSA-N 1 1 311.425 3.971 20 10 DHCDMO CCC[C@@H](C)[N@@H+](C)Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC001180275084 1035628510 /nfs/dbraw/zinc/62/85/10/1035628510.db2.gz GDBSHRAVJKEFLQ-GFCCVEGCSA-N 1 1 320.408 3.724 20 10 DHCDMO COCCC[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC001180257922 1035634129 /nfs/dbraw/zinc/63/41/29/1035634129.db2.gz KTUXRZLPRJNAME-UHFFFAOYSA-N 1 1 318.486 3.853 20 10 DHCDMO CCOc1ccc(C[N@H+](C)Cc2cccc(F)c2O)cc1OC ZINC001180489375 1035686019 /nfs/dbraw/zinc/68/60/19/1035686019.db2.gz ZCGWZPKISUJHTQ-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cccc(F)c2O)cc1OC ZINC001180489375 1035686026 /nfs/dbraw/zinc/68/60/26/1035686026.db2.gz ZCGWZPKISUJHTQ-UHFFFAOYSA-N 1 1 319.376 3.571 20 10 DHCDMO CCc1cccc(C[N@H+](CCO)C2CCC(CC)CC2)c1O ZINC001181418883 1035904501 /nfs/dbraw/zinc/90/45/01/1035904501.db2.gz QKGPVTGVCSREHW-UHFFFAOYSA-N 1 1 305.462 3.718 20 10 DHCDMO CC(C)C[C@H](O)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774160634 1036208287 /nfs/dbraw/zinc/20/82/87/1036208287.db2.gz XYAOLRQUJPDFMB-ZJUUUORDSA-N 1 1 306.233 3.757 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1O ZINC000775649097 1036217215 /nfs/dbraw/zinc/21/72/15/1036217215.db2.gz ZWWWLLXVBFTYHT-KRWDZBQOSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1O ZINC000775649097 1036217234 /nfs/dbraw/zinc/21/72/34/1036217234.db2.gz ZWWWLLXVBFTYHT-KRWDZBQOSA-N 1 1 317.816 3.928 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1O ZINC000775655266 1036239471 /nfs/dbraw/zinc/23/94/71/1036239471.db2.gz XDVAASQNXIWFEG-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO Cc1cccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1O ZINC000775655266 1036239483 /nfs/dbraw/zinc/23/94/83/1036239483.db2.gz XDVAASQNXIWFEG-UHFFFAOYSA-N 1 1 310.372 3.879 20 10 DHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1(CC)CC ZINC001204335840 1036251866 /nfs/dbraw/zinc/25/18/66/1036251866.db2.gz XMDUBUCTRAMKHR-ROUUACIJSA-N 1 1 321.461 3.816 20 10 DHCDMO Cc1cc(Cl)cc(CN2CCC[N@H+](C(C)(C)C)CC2)c1O ZINC000775665760 1036289731 /nfs/dbraw/zinc/28/97/31/1036289731.db2.gz YAMFKVKWHVTXJU-UHFFFAOYSA-N 1 1 310.869 3.660 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC3(CCOCC3)C2)c1O ZINC000775703384 1036482708 /nfs/dbraw/zinc/48/27/08/1036482708.db2.gz QCBHCFBMUPVOOL-UHFFFAOYSA-N 1 1 309.837 3.747 20 10 DHCDMO COc1cccc([C@@H]2CSCC[N@H+]2Cc2ccccc2O)c1 ZINC001203561119 1036549357 /nfs/dbraw/zinc/54/93/57/1036549357.db2.gz LSRJESSQWUQXAB-KRWDZBQOSA-N 1 1 315.438 3.691 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(OC(F)F)cc1F ZINC001183919625 1036712441 /nfs/dbraw/zinc/71/24/41/1036712441.db2.gz NGUBZLAOTSVPIC-UHFFFAOYSA-N 1 1 315.266 3.562 20 10 DHCDMO C[C@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1ccc(N(C)C)cc1 ZINC000775832329 1036981301 /nfs/dbraw/zinc/98/13/01/1036981301.db2.gz YYMNYSVIOWSLAH-AWEZNQCLSA-N 1 1 322.412 3.653 20 10 DHCDMO CC[C@@H](C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879609 1037153867 /nfs/dbraw/zinc/15/38/67/1037153867.db2.gz JGTMWLMJSBYCPW-VXGBXAGGSA-N 1 1 322.405 3.708 20 10 DHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 ZINC000774879609 1037153876 /nfs/dbraw/zinc/15/38/76/1037153876.db2.gz JGTMWLMJSBYCPW-VXGBXAGGSA-N 1 1 322.405 3.708 20 10 DHCDMO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903234 1037192722 /nfs/dbraw/zinc/19/27/22/1037192722.db2.gz JRXPOZSAYJJBMR-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774903234 1037192745 /nfs/dbraw/zinc/19/27/45/1037192745.db2.gz JRXPOZSAYJJBMR-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCCC[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000774909519 1037202397 /nfs/dbraw/zinc/20/23/97/1037202397.db2.gz REXKHALQOKHCJD-AWEZNQCLSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCCC[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000774909519 1037202406 /nfs/dbraw/zinc/20/24/06/1037202406.db2.gz REXKHALQOKHCJD-AWEZNQCLSA-N 1 1 322.405 3.710 20 10 DHCDMO CCCC[C@H](CC)C[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774942107 1037249907 /nfs/dbraw/zinc/24/99/07/1037249907.db2.gz HJECMXAIYPDJJV-LBPRGKRZSA-N 1 1 310.394 3.615 20 10 DHCDMO CC[N@@H+](CCc1ccc(OC)cc1)Cc1ccc(N(C)C)cc1 ZINC001203935690 1037271851 /nfs/dbraw/zinc/27/18/51/1037271851.db2.gz AVFKXQWZYWDMAG-UHFFFAOYSA-N 1 1 312.457 3.826 20 10 DHCDMO CCCCCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774958398 1037274927 /nfs/dbraw/zinc/27/49/27/1037274927.db2.gz YAXPHJHKKJOZBK-LBPRGKRZSA-N 1 1 310.394 3.758 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000776014294 1037299848 /nfs/dbraw/zinc/29/98/48/1037299848.db2.gz RCGGPNFJCHKYCQ-UHFFFAOYSA-N 1 1 309.409 3.838 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1F ZINC000775134725 1037681041 /nfs/dbraw/zinc/68/10/41/1037681041.db2.gz DSIRYHLRYITJOI-LBPRGKRZSA-N 1 1 304.331 3.666 20 10 DHCDMO COc1ccc(OCC[N@@H+](C)Cc2cc(C)cc(C)c2O)cc1 ZINC000917066900 1038158193 /nfs/dbraw/zinc/15/81/93/1038158193.db2.gz XEWZWWXNDSTRFO-UHFFFAOYSA-N 1 1 315.413 3.528 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000154269086 1038185298 /nfs/dbraw/zinc/18/52/98/1038185298.db2.gz LJHZUDOTSAGKLI-UHFFFAOYSA-N 1 1 312.369 3.773 20 10 DHCDMO Cc1cc(C[N@@H+](CCO)CC(C)(C)C)ccc1N1CCCCC1 ZINC001190914910 1038407779 /nfs/dbraw/zinc/40/77/79/1038407779.db2.gz XYJJUWYEWPRCIJ-UHFFFAOYSA-N 1 1 318.505 3.826 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Cl)ccc1[O-] ZINC000775512593 1038606193 /nfs/dbraw/zinc/60/61/93/1038606193.db2.gz RMTDIIMXIVZWAM-DZKIICNBSA-N 1 1 310.869 3.959 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1ccc(F)cc1F ZINC000170779206 1038960296 /nfs/dbraw/zinc/96/02/96/1038960296.db2.gz LYXHURNAOOBCTL-SFHVURJKSA-N 1 1 321.367 3.616 20 10 DHCDMO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(N(C)C)cc1 ZINC000760896546 1039032252 /nfs/dbraw/zinc/03/22/52/1039032252.db2.gz GLGAWBABVBRCTP-MRXNPFEDSA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@@H](NCC1(C[NH+](C)C)CCCC1)c1ccc(N(C)C)cc1 ZINC000760896546 1039032269 /nfs/dbraw/zinc/03/22/69/1039032269.db2.gz GLGAWBABVBRCTP-MRXNPFEDSA-N 1 1 303.494 3.525 20 10 DHCDMO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000760905932 1039043685 /nfs/dbraw/zinc/04/36/85/1039043685.db2.gz NCXBOYCQNFKEFY-GXSJLCMTSA-N 1 1 319.323 3.560 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](Cc2ccccn2)C(C)C)c1O ZINC000761192502 1040554635 /nfs/dbraw/zinc/55/46/35/1040554635.db2.gz OYTSMQSUXHMJDL-UHFFFAOYSA-N 1 1 320.820 3.860 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000761191415 1040560740 /nfs/dbraw/zinc/56/07/40/1040560740.db2.gz TZDBIOGQZNFMCG-HNNXBMFYSA-N 1 1 318.804 3.786 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1 ZINC000093316098 193229793 /nfs/dbraw/zinc/22/97/93/193229793.db2.gz UTHDLDJVHMBEJH-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO CCC[N@@H+](CCCCCn1cccn1)Cc1ccccc1O ZINC000104682374 194026941 /nfs/dbraw/zinc/02/69/41/194026941.db2.gz UENRYOIKYZSUPI-UHFFFAOYSA-N 1 1 301.434 3.671 20 10 DHCDMO C[C@@H](C[N@@H+](C)Cc1ccc(N(C)C)c(F)c1)c1nccs1 ZINC000273191795 130096007 /nfs/dbraw/zinc/09/60/07/130096007.db2.gz PWAYZVONWIQWRW-LBPRGKRZSA-N 1 1 307.438 3.584 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c(Cl)c2[O-])CC1 ZINC000273301089 130104700 /nfs/dbraw/zinc/10/47/00/130104700.db2.gz BIQUWSPYJLGFBN-SNVBAGLBSA-N 1 1 317.260 3.834 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]C2CCN(CC3CC3)CC2)c(O)c1C ZINC000273394108 130115847 /nfs/dbraw/zinc/11/58/47/130115847.db2.gz LPKHTLRCARCQJI-HNNXBMFYSA-N 1 1 302.462 3.534 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3occc32)c1 ZINC000273437054 130122852 /nfs/dbraw/zinc/12/28/52/130122852.db2.gz XDTOITOLTNSCCF-IAQYHMDHSA-N 1 1 315.369 3.500 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1[O-] ZINC000286136927 131221323 /nfs/dbraw/zinc/22/13/23/131221323.db2.gz OUIMVYOLLVCSRO-RHSMWYFYSA-N 1 1 308.441 3.692 20 10 DHCDMO CC[C@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1ccc(F)cc1O ZINC000286232802 131225917 /nfs/dbraw/zinc/22/59/17/131225917.db2.gz SXORGHOSISTGFK-INIZCTEOSA-N 1 1 313.376 3.728 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000287035341 131260844 /nfs/dbraw/zinc/26/08/44/131260844.db2.gz MBIHSRRBJXKUTF-BZNIZROVSA-N 1 1 323.795 3.959 20 10 DHCDMO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1O ZINC000287035345 131260973 /nfs/dbraw/zinc/26/09/73/131260973.db2.gz MBIHSRRBJXKUTF-MEDUHNTESA-N 1 1 323.795 3.959 20 10 DHCDMO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)[nH]1 ZINC000277405166 334088227 /nfs/dbraw/zinc/08/82/27/334088227.db2.gz ZDZLYPVFKYSHNM-KOLCDFICSA-N 1 1 322.840 3.836 20 10 DHCDMO CCN(CC)c1ccc(CNc2cc(C)[nH+]c(C)n2)cc1F ZINC000301216623 336295363 /nfs/dbraw/zinc/29/53/63/336295363.db2.gz ZXKDCXWRNSBEKT-UHFFFAOYSA-N 1 1 302.397 3.691 20 10 DHCDMO Oc1c(F)cccc1C[NH2+]Cc1ccccc1-c1ccncc1 ZINC000368021411 336835020 /nfs/dbraw/zinc/83/50/20/336835020.db2.gz RHDJREORBVBGMR-UHFFFAOYSA-N 1 1 308.356 3.883 20 10 DHCDMO CC[C@@H](c1ccccc1O)N1CCC([NH2+]C2CCCC2)CC1 ZINC000370211909 336879791 /nfs/dbraw/zinc/87/97/91/336879791.db2.gz FOUJCXPDJIYLMN-SFHVURJKSA-N 1 1 302.462 3.840 20 10 DHCDMO CCCn1nccc1C1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000374366914 336988277 /nfs/dbraw/zinc/98/82/77/336988277.db2.gz UFYKAAROTSOMDZ-UHFFFAOYSA-N 1 1 317.408 3.517 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1 ZINC000375531015 337012946 /nfs/dbraw/zinc/01/29/46/337012946.db2.gz YQSVPCQJJPXCPG-LMMKCTJWSA-N 1 1 303.446 3.606 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000377835785 337062108 /nfs/dbraw/zinc/06/21/08/337062108.db2.gz WLVGGUYVJYCQJA-XHSDSOJGSA-N 1 1 319.445 3.600 20 10 DHCDMO Cc1ccc(C2CC[NH+](Cc3cccc(F)c3O)CC2)cn1 ZINC000378635767 337077373 /nfs/dbraw/zinc/07/73/73/337077373.db2.gz VMQKZOBKVYBPDH-UHFFFAOYSA-N 1 1 300.377 3.614 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2csc(C)n2)c1 ZINC000189939086 521144223 /nfs/dbraw/zinc/14/42/23/521144223.db2.gz PCABWHQFVFTGBI-INIZCTEOSA-N 1 1 318.442 3.893 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2csc(C)n2)c1 ZINC000189939086 521144233 /nfs/dbraw/zinc/14/42/33/521144233.db2.gz PCABWHQFVFTGBI-INIZCTEOSA-N 1 1 318.442 3.893 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@@H]1CCCc2cccnc21 ZINC000364998501 521353375 /nfs/dbraw/zinc/35/33/75/521353375.db2.gz FVRDDBDVJGXKQN-MRXNPFEDSA-N 1 1 312.413 3.695 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(N(CC)CC)c(F)c1)c1nccn1C ZINC000182918745 522876979 /nfs/dbraw/zinc/87/69/79/522876979.db2.gz QVFCWNZRAVPRCJ-MRXNPFEDSA-N 1 1 318.440 3.646 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(OC)c(C)c2)o1 ZINC000266189805 524050843 /nfs/dbraw/zinc/05/08/43/524050843.db2.gz YBQZUNGLAQXORT-INIZCTEOSA-N 1 1 303.402 3.636 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1O ZINC000180695778 524393453 /nfs/dbraw/zinc/39/34/53/524393453.db2.gz SDUUSYYHSNGAAM-CVEARBPZSA-N 1 1 317.454 3.850 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cc(Cl)c(Cl)cc1O ZINC000192956463 525691069 /nfs/dbraw/zinc/69/10/69/525691069.db2.gz RMRCAKIPCJYHDS-MXWKQRLJSA-N 1 1 318.244 3.901 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000180204330 526349780 /nfs/dbraw/zinc/34/97/80/526349780.db2.gz MZCJELAOVYPMKF-MRXNPFEDSA-N 1 1 315.388 3.570 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000180257765 526350224 /nfs/dbraw/zinc/35/02/24/526350224.db2.gz SAVNRMAIKCAMNX-ZBFHGGJFSA-N 1 1 321.417 3.681 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000266070161 526355136 /nfs/dbraw/zinc/35/51/36/526355136.db2.gz IHYDRUOUBBBMOB-UHFFFAOYSA-N 1 1 311.425 3.938 20 10 DHCDMO CC[C@@H](Nc1cc(CCOC)cc[nH+]1)c1ccc(N(C)C)cc1 ZINC000287524208 535809560 /nfs/dbraw/zinc/80/95/60/535809560.db2.gz OQOXNCAZXIALSP-GOSISDBHSA-N 1 1 313.445 3.900 20 10 DHCDMO CC(C)Oc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000294353353 1013133159 /nfs/dbraw/zinc/13/31/59/1013133159.db2.gz SRNWWGQKVWQWLJ-UHFFFAOYSA-N 1 1 324.783 3.657 20 10 DHCDMO Cc1cccc([C@H](O)C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC001167107639 1013148833 /nfs/dbraw/zinc/14/88/33/1013148833.db2.gz FPXJDDRKZQCFRH-OAQYLSRUSA-N 1 1 324.468 3.759 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000894431156 1013358446 /nfs/dbraw/zinc/35/84/46/1013358446.db2.gz NQJONHXJOVQTBP-AAEUAGOBSA-N 1 1 317.351 3.872 20 10 DHCDMO C[N@H+](Cc1cccc(F)c1)Cc1c(O)cccc1Br ZINC001140098917 1013433415 /nfs/dbraw/zinc/43/34/15/1013433415.db2.gz SLIDEDCGUNVKPS-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[N@@H+](Cc1cccc(F)c1)Cc1c(O)cccc1Br ZINC001140098917 1013433420 /nfs/dbraw/zinc/43/34/20/1013433420.db2.gz SLIDEDCGUNVKPS-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000894887584 1013625767 /nfs/dbraw/zinc/62/57/67/1013625767.db2.gz GNSYEHCUMXPHCN-AAEUAGOBSA-N 1 1 317.351 3.872 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC[C@H]1O ZINC000276041772 1014587387 /nfs/dbraw/zinc/58/73/87/1014587387.db2.gz SSTNCQRYUSFSBV-LJQANCHMSA-N 1 1 311.425 3.652 20 10 DHCDMO CC1([NH+]2CCCCC2)CCN(Cc2cc(F)cc(F)c2O)CC1 ZINC000895469824 1015173104 /nfs/dbraw/zinc/17/31/04/1015173104.db2.gz CRYXGTBFDNNSNS-UHFFFAOYSA-N 1 1 324.415 3.511 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)c(O)c1OC ZINC000891479386 1015317587 /nfs/dbraw/zinc/31/75/87/1015317587.db2.gz BGTWFZKTEHFOEB-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO Cc1cc(C[N@H+](C)C[C@@H](C)c2nccs2)ccc1N(C)C ZINC000294685082 1032115093 /nfs/dbraw/zinc/11/50/93/1032115093.db2.gz SUBDDTHZMDAEJP-CQSZACIVSA-N 1 1 303.475 3.753 20 10 DHCDMO COc1ccc(C[N@H+]2CCc3sccc3[C@H]2C)c(O)c1OC ZINC000891525545 1015353668 /nfs/dbraw/zinc/35/36/68/1015353668.db2.gz WDEXSDPCDSZIPC-LLVKDONJSA-N 1 1 319.426 3.590 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cn(C)nc2C2CC2)C2CC2)cc1 ZINC000891595590 1015434494 /nfs/dbraw/zinc/43/44/94/1015434494.db2.gz AKWHSQDOTYSUEE-UHFFFAOYSA-N 1 1 324.472 3.528 20 10 DHCDMO Oc1cccc(F)c1C[NH2+][C@H]1CCC[C@H](C2CCOCC2)C1 ZINC000896640046 1015694221 /nfs/dbraw/zinc/69/42/21/1015694221.db2.gz FYWLMQZQOAQLBO-GJZGRUSLSA-N 1 1 307.409 3.606 20 10 DHCDMO CCOc1ccc(C[NH2+]Cc2c(O)cccc2F)cc1OCC ZINC000896641832 1015695132 /nfs/dbraw/zinc/69/51/32/1015695132.db2.gz STEYDFCQULHIQW-UHFFFAOYSA-N 1 1 319.376 3.619 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087334 1016324223 /nfs/dbraw/zinc/32/42/23/1016324223.db2.gz KRVCDDOOMYTJJU-MSOLQXFVSA-N 1 1 315.505 3.669 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(N(C)C)c(C)c2)CCO1 ZINC001167549219 1016385534 /nfs/dbraw/zinc/38/55/34/1016385534.db2.gz LCDYCRQJODBMIB-OAQYLSRUSA-N 1 1 324.468 3.943 20 10 DHCDMO C[C@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000184962256 1016474414 /nfs/dbraw/zinc/47/44/14/1016474414.db2.gz BEWAGQCXLGHLTO-ZDUSSCGKSA-N 1 1 311.360 3.568 20 10 DHCDMO CSc1ccc(OCC[N@@H+](C)Cc2ccccc2O)cc1 ZINC000072629632 1016731709 /nfs/dbraw/zinc/73/17/09/1016731709.db2.gz NFSJXZGRHCTRHT-UHFFFAOYSA-N 1 1 303.427 3.625 20 10 DHCDMO COC/C(C)=C/C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000929184129 1032440195 /nfs/dbraw/zinc/44/01/95/1032440195.db2.gz BSMKDXVGKRCEDX-GZTJUZNOSA-N 1 1 302.462 3.701 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074819 1032548525 /nfs/dbraw/zinc/54/85/25/1032548525.db2.gz HZEDNPLVTICRFU-ROUUACIJSA-N 1 1 317.521 3.771 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074819 1032548529 /nfs/dbraw/zinc/54/85/29/1032548529.db2.gz HZEDNPLVTICRFU-ROUUACIJSA-N 1 1 317.521 3.771 20 10 DHCDMO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(F)cc1O ZINC000716294994 1032692201 /nfs/dbraw/zinc/69/22/01/1032692201.db2.gz GNUDYFJASZIZNJ-NVPAJSRCSA-N 1 1 315.388 3.930 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)on1 ZINC000125515607 1032709710 /nfs/dbraw/zinc/70/97/10/1032709710.db2.gz ZSFXLEFBCQMNGS-AWEZNQCLSA-N 1 1 317.408 3.963 20 10 DHCDMO C[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccc(F)cc1O ZINC000186033740 1017648992 /nfs/dbraw/zinc/64/89/92/1017648992.db2.gz VUDUEWSHCKTWRL-LLVKDONJSA-N 1 1 320.433 3.760 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCC2)cc1)[C@H](CO)CC(C)(C)C ZINC001117789897 1017764571 /nfs/dbraw/zinc/76/45/71/1017764571.db2.gz RSEOGUWZAOZRQE-SFHVURJKSA-N 1 1 304.478 3.516 20 10 DHCDMO Oc1c(Br)cccc1C[N@H+]1CCCC(F)(F)CC1 ZINC000702770683 1018238843 /nfs/dbraw/zinc/23/88/43/1018238843.db2.gz PYTJGAAEPOFNPP-UHFFFAOYSA-N 1 1 320.177 3.776 20 10 DHCDMO Oc1c(Br)cccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000702770683 1018238829 /nfs/dbraw/zinc/23/88/29/1018238829.db2.gz PYTJGAAEPOFNPP-UHFFFAOYSA-N 1 1 320.177 3.776 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CCCC(F)(F)CC1 ZINC000702825123 1018242464 /nfs/dbraw/zinc/24/24/64/1018242464.db2.gz XVIARJQPNYTUPI-UHFFFAOYSA-N 1 1 320.177 3.776 20 10 DHCDMO CC[C@H](CN[C@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868805 1018408850 /nfs/dbraw/zinc/40/88/50/1018408850.db2.gz JBQKSOCVNMNEBZ-SJLPKXTDSA-N 1 1 303.494 3.668 20 10 DHCDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000765099354 1018476361 /nfs/dbraw/zinc/47/63/61/1018476361.db2.gz PDTDAWMFSBNCHV-OLZOCXBDSA-N 1 1 315.413 3.626 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCc3c2cccc3O)cc1F ZINC000858130208 1032774625 /nfs/dbraw/zinc/77/46/25/1032774625.db2.gz BRXDKGLUAIEHQO-MRXNPFEDSA-N 1 1 318.367 3.514 20 10 DHCDMO C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000278466029 1018718175 /nfs/dbraw/zinc/71/81/75/1018718175.db2.gz NCLIOJSNQSOKOP-GFCCVEGCSA-N 1 1 308.853 3.571 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2c2ccnn2C)cc1Cl ZINC000825768512 1032797941 /nfs/dbraw/zinc/79/79/41/1032797941.db2.gz PIFUQVDTNTZRFB-MRXNPFEDSA-N 1 1 319.836 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccnn2C)cc1Cl ZINC000825768512 1032797962 /nfs/dbraw/zinc/79/79/62/1032797962.db2.gz PIFUQVDTNTZRFB-MRXNPFEDSA-N 1 1 319.836 3.815 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](c3ccccn3)C2)cc1Cl ZINC000825768615 1032799007 /nfs/dbraw/zinc/79/90/07/1032799007.db2.gz SMOPBSZSDQOOSD-CYBMUJFWSA-N 1 1 302.805 3.739 20 10 DHCDMO C[C@@H](CO)CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278657880 1019000018 /nfs/dbraw/zinc/00/00/18/1019000018.db2.gz ILPPRTBRSZVMJP-NXEZZACHSA-N 1 1 306.233 3.758 20 10 DHCDMO CCCC[N@@H+](Cc1c(C)nn(C)c1C)Cc1ccccc1O ZINC000282324050 1019327228 /nfs/dbraw/zinc/32/72/28/1019327228.db2.gz AGVQTAGLLKHRLS-UHFFFAOYSA-N 1 1 301.434 3.545 20 10 DHCDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000170789006 1019434625 /nfs/dbraw/zinc/43/46/25/1019434625.db2.gz TYOIBBYRTJRTMZ-NWDGAFQWSA-N 1 1 316.376 3.902 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000091958295 1019497333 /nfs/dbraw/zinc/49/73/33/1019497333.db2.gz VTOHHIYIOVPTIC-ZBFHGGJFSA-N 1 1 321.804 3.727 20 10 DHCDMO CCOC[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000093838892 1019583840 /nfs/dbraw/zinc/58/38/40/1019583840.db2.gz OGONAHZNVUOLLK-MRXNPFEDSA-N 1 1 311.425 3.918 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@H](C)C1 ZINC000282222727 1019697334 /nfs/dbraw/zinc/69/73/34/1019697334.db2.gz IBXQLRBZXXBETG-VQIMIIECSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2ccccc2CF)cc1 ZINC001171728985 1032847923 /nfs/dbraw/zinc/84/79/23/1032847923.db2.gz CVMXHHRGZJHNTP-UHFFFAOYSA-N 1 1 316.420 3.733 20 10 DHCDMO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc2c(cc1O)CCC2 ZINC000727429367 1019711635 /nfs/dbraw/zinc/71/16/35/1019711635.db2.gz JRSRSKVXTWJAGM-QVKFZJNVSA-N 1 1 323.436 3.843 20 10 DHCDMO C[C@@H]1CCCC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715814267 1020172481 /nfs/dbraw/zinc/17/24/81/1020172481.db2.gz JZCLJWCLAIGMKJ-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO C[C@@H]1CCCC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715814267 1020172490 /nfs/dbraw/zinc/17/24/90/1020172490.db2.gz JZCLJWCLAIGMKJ-SNVBAGLBSA-N 1 1 316.214 3.916 20 10 DHCDMO CC[C@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccc(F)cc1O ZINC000903323803 1020372002 /nfs/dbraw/zinc/37/20/02/1020372002.db2.gz LISATYHRSUSMGF-DBQDNQAGSA-N 1 1 307.409 3.920 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1nnc(C2CC2)o1)C1CCCC1 ZINC000733613293 1020419204 /nfs/dbraw/zinc/41/92/04/1020419204.db2.gz JXKIHZGMAMPSFU-UHFFFAOYSA-N 1 1 313.401 3.597 20 10 DHCDMO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(F)cc2O)nc1 ZINC000858487599 1032916154 /nfs/dbraw/zinc/91/61/54/1032916154.db2.gz CUYFQCBOIPQYKZ-ZDUSSCGKSA-N 1 1 302.393 3.863 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490703 1032917288 /nfs/dbraw/zinc/91/72/88/1032917288.db2.gz MHSJNFYLBHJNGX-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490703 1032917296 /nfs/dbraw/zinc/91/72/96/1032917296.db2.gz MHSJNFYLBHJNGX-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490605 1032918361 /nfs/dbraw/zinc/91/83/61/1032918361.db2.gz KKZOLLXJKGXPPS-JKSUJKDBSA-N 1 1 316.489 3.654 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490602 1032919255 /nfs/dbraw/zinc/91/92/55/1032919255.db2.gz KKZOLLXJKGXPPS-CVEARBPZSA-N 1 1 316.489 3.654 20 10 DHCDMO Cc1ccc(CC[N@H+](C)Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000738298103 1020871322 /nfs/dbraw/zinc/87/13/22/1020871322.db2.gz BVJCUQWDPJOMIL-UHFFFAOYSA-N 1 1 324.468 3.506 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CCC3CCCC3)CC2)cc1 ZINC000741781336 1021050360 /nfs/dbraw/zinc/05/03/60/1021050360.db2.gz ITJMTLLIHXHYFB-UHFFFAOYSA-N 1 1 302.462 3.788 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)cc1 ZINC000163830868 1021203735 /nfs/dbraw/zinc/20/37/35/1021203735.db2.gz WACZTXMGPLUZRG-UHFFFAOYSA-N 1 1 307.397 3.697 20 10 DHCDMO CC[NH+](CC)C[C@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743388936 1021277378 /nfs/dbraw/zinc/27/73/78/1021277378.db2.gz WRHIWYHNEGUZKT-QGZVFWFLSA-N 1 1 318.505 3.988 20 10 DHCDMO CC(C)[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCS1 ZINC000743394845 1021280990 /nfs/dbraw/zinc/28/09/90/1021280990.db2.gz CTQYHQBSWVUXPH-MRXNPFEDSA-N 1 1 323.502 3.969 20 10 DHCDMO CCN(CC)[C@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743396324 1021281585 /nfs/dbraw/zinc/28/15/85/1021281585.db2.gz ZCPCIWOUHOEPEI-KRWDZBQOSA-N 1 1 318.505 3.914 20 10 DHCDMO CCN(CC)[C@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743396324 1021281597 /nfs/dbraw/zinc/28/15/97/1021281597.db2.gz ZCPCIWOUHOEPEI-KRWDZBQOSA-N 1 1 318.505 3.914 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000174854014 1021426795 /nfs/dbraw/zinc/42/67/95/1021426795.db2.gz FXYFJWYRHJUCQL-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O)C(F)F ZINC000850312678 1021472869 /nfs/dbraw/zinc/47/28/69/1021472869.db2.gz WZLZLMLGHJMKDD-ZDUSSCGKSA-N 1 1 301.377 3.832 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](Cc2ccco2)Cc2ccccc2O)n1 ZINC000154721254 1021515386 /nfs/dbraw/zinc/51/53/86/1021515386.db2.gz RCFPOEHPUPTKSD-UHFFFAOYSA-N 1 1 324.380 3.597 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2nccn2C)c(C)n1-c1cccc(C)c1 ZINC000850409929 1021517420 /nfs/dbraw/zinc/51/74/20/1021517420.db2.gz CWYSEUFFFXUSPA-INIZCTEOSA-N 1 1 322.456 3.987 20 10 DHCDMO COC1CC(CC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850481913 1021557772 /nfs/dbraw/zinc/55/77/72/1021557772.db2.gz KZIXMJPMCYKOHT-UNXYVOJBSA-N 1 1 317.351 3.877 20 10 DHCDMO Cc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539326 1021591903 /nfs/dbraw/zinc/59/19/03/1021591903.db2.gz RXNCXVVEDRFPLQ-HZPDHXFCSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c(O)c1 ZINC000850539326 1021591910 /nfs/dbraw/zinc/59/19/10/1021591910.db2.gz RXNCXVVEDRFPLQ-HZPDHXFCSA-N 1 1 302.462 3.758 20 10 DHCDMO COC[C@H]1CCCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078114 1021627529 /nfs/dbraw/zinc/62/75/29/1021627529.db2.gz OFZFRCAMFOPQQW-SNVBAGLBSA-N 1 1 304.217 3.700 20 10 DHCDMO COC[C@H]1CCCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001237078114 1021627535 /nfs/dbraw/zinc/62/75/35/1021627535.db2.gz OFZFRCAMFOPQQW-SNVBAGLBSA-N 1 1 304.217 3.700 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000182430077 1021645286 /nfs/dbraw/zinc/64/52/86/1021645286.db2.gz KCJMVPNOOMIHEO-ZDUSSCGKSA-N 1 1 324.380 3.907 20 10 DHCDMO CO[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001237087325 1021672503 /nfs/dbraw/zinc/67/25/03/1021672503.db2.gz VCYDDNRFBHROLJ-ZJUUUORDSA-N 1 1 304.217 3.698 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001237087325 1021672512 /nfs/dbraw/zinc/67/25/12/1021672512.db2.gz VCYDDNRFBHROLJ-ZJUUUORDSA-N 1 1 304.217 3.698 20 10 DHCDMO Cc1noc(C)c1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975145 1022008606 /nfs/dbraw/zinc/00/86/06/1022008606.db2.gz QDMYAGBUNRUTBT-UHFFFAOYSA-N 1 1 312.369 3.792 20 10 DHCDMO Cc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975145 1022008638 /nfs/dbraw/zinc/00/86/38/1022008638.db2.gz QDMYAGBUNRUTBT-UHFFFAOYSA-N 1 1 312.369 3.792 20 10 DHCDMO CCn1c2ccccc2nc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000155177504 1022032045 /nfs/dbraw/zinc/03/20/45/1022032045.db2.gz KLNAWFGPADMFEP-UHFFFAOYSA-N 1 1 322.456 3.754 20 10 DHCDMO CCn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000155177504 1022032054 /nfs/dbraw/zinc/03/20/54/1022032054.db2.gz KLNAWFGPADMFEP-UHFFFAOYSA-N 1 1 322.456 3.754 20 10 DHCDMO CC(C)[NH+](CCCN[C@@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000766384466 1022084233 /nfs/dbraw/zinc/08/42/33/1022084233.db2.gz NHDNSFSYAOPTJS-KRWDZBQOSA-N 1 1 305.510 3.912 20 10 DHCDMO Cc1cc(C[N@@H+](C)CC2=CCCOC2)ccc1N1CCCCC1 ZINC000852515638 1022132207 /nfs/dbraw/zinc/13/22/07/1022132207.db2.gz BNMBIFBNGWTYPY-UHFFFAOYSA-N 1 1 314.473 3.764 20 10 DHCDMO COc1cc(Br)cc(C[N@@H+](C(C)C)C2CC2)c1O ZINC000121325486 1022156850 /nfs/dbraw/zinc/15/68/50/1022156850.db2.gz UOLRSFIPQPNZHR-UHFFFAOYSA-N 1 1 314.223 3.536 20 10 DHCDMO C[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241435 1022242572 /nfs/dbraw/zinc/24/25/72/1022242572.db2.gz VFFXRVDYUWOLLD-AEFFLSMTSA-N 1 1 315.505 3.525 20 10 DHCDMO C[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241435 1022242576 /nfs/dbraw/zinc/24/25/76/1022242576.db2.gz VFFXRVDYUWOLLD-AEFFLSMTSA-N 1 1 315.505 3.525 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822147 1033473814 /nfs/dbraw/zinc/47/38/14/1033473814.db2.gz PCFIHBJBCMOWMW-ZDUSSCGKSA-N 1 1 323.742 3.507 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822147 1033473816 /nfs/dbraw/zinc/47/38/16/1033473816.db2.gz PCFIHBJBCMOWMW-ZDUSSCGKSA-N 1 1 323.742 3.507 20 10 DHCDMO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc(F)ccc1O ZINC000363863306 1022350132 /nfs/dbraw/zinc/35/01/32/1022350132.db2.gz BAOIXSAVDMCEAM-SDBXPKJASA-N 1 1 309.287 3.594 20 10 DHCDMO C[C@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1ccc(F)cc1O ZINC000756435289 1022365773 /nfs/dbraw/zinc/36/57/73/1022365773.db2.gz YUKKNCOWALYBBX-SUMWQHHRSA-N 1 1 308.441 3.692 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000854225732 1022434643 /nfs/dbraw/zinc/43/46/43/1022434643.db2.gz GCOCCWAAYUCARQ-IRXDYDNUSA-N 1 1 300.377 3.842 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(F)cc1O ZINC000854225733 1022435876 /nfs/dbraw/zinc/43/58/76/1022435876.db2.gz GCOCCWAAYUCARQ-SJORKVTESA-N 1 1 300.377 3.842 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2ccnc(F)c2)cc1 ZINC000859059682 1033057174 /nfs/dbraw/zinc/05/71/74/1033057174.db2.gz IMYSLOUDNDEEEI-UHFFFAOYSA-N 1 1 301.409 3.699 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](Cc2ccccc2F)C2CC2)c1 ZINC000179608794 1022489221 /nfs/dbraw/zinc/48/92/21/1022489221.db2.gz ZPPSYTZDABZFAV-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO COc1ccc(O)c([C@H](C)NCCC[NH+](C(C)C)C(C)C)c1 ZINC000185626845 1022508870 /nfs/dbraw/zinc/50/88/70/1022508870.db2.gz XTHLBFXMZJTLBV-HNNXBMFYSA-N 1 1 308.466 3.560 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC001169753953 1022530242 /nfs/dbraw/zinc/53/02/42/1022530242.db2.gz DZEPVAMZFZZSPS-VDZJLULYSA-N 1 1 303.446 3.952 20 10 DHCDMO CCOc1cccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1O ZINC000179848827 1022556749 /nfs/dbraw/zinc/55/67/49/1022556749.db2.gz BBHZWRSFUNCIHH-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)c1O ZINC000179848827 1022556758 /nfs/dbraw/zinc/55/67/58/1022556758.db2.gz BBHZWRSFUNCIHH-UHFFFAOYSA-N 1 1 322.408 3.831 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C[C@H](C)O1 ZINC000776766737 1022559042 /nfs/dbraw/zinc/55/90/42/1022559042.db2.gz NHZAYAKIEUWCNL-BETUJISGSA-N 1 1 315.413 3.626 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1O ZINC000179884414 1022573448 /nfs/dbraw/zinc/57/34/48/1022573448.db2.gz LEBWWXJRHRPJCH-GOSISDBHSA-N 1 1 316.489 3.645 20 10 DHCDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000180068141 1022628920 /nfs/dbraw/zinc/62/89/20/1022628920.db2.gz PSAXJXIZGMFHEE-QWHCGFSZSA-N 1 1 307.434 3.808 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000180208133 1022669252 /nfs/dbraw/zinc/66/92/52/1022669252.db2.gz FWYQDZGPOVROMF-QGZVFWFLSA-N 1 1 300.377 3.608 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)Cc2ccc(Br)o2)cc1C ZINC000072040605 1022819039 /nfs/dbraw/zinc/81/90/39/1022819039.db2.gz OYAQJNYSPFLNAZ-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO COc1ccccc1C[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000768162392 1022908263 /nfs/dbraw/zinc/90/82/63/1022908263.db2.gz FAJYIVOMYMRVNG-UHFFFAOYSA-N 1 1 302.393 3.532 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cc(OCC)ccc2O)cc1 ZINC000768162318 1022908392 /nfs/dbraw/zinc/90/83/92/1022908392.db2.gz AMAJJVJBCZJEJE-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO COc1ccc(Cl)cc1C[N@H+](C)Cc1c(O)cccc1OC ZINC000768207029 1022917098 /nfs/dbraw/zinc/91/70/98/1022917098.db2.gz OCPHKUZRSJSNTB-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1c(O)cccc1OC ZINC000768207029 1022917110 /nfs/dbraw/zinc/91/71/10/1022917110.db2.gz OCPHKUZRSJSNTB-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000768245409 1022938739 /nfs/dbraw/zinc/93/87/39/1022938739.db2.gz RVCJYWNIKKOFRE-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC000768245409 1022938742 /nfs/dbraw/zinc/93/87/42/1022938742.db2.gz RVCJYWNIKKOFRE-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000768245409 1022938743 /nfs/dbraw/zinc/93/87/43/1022938743.db2.gz RVCJYWNIKKOFRE-FQEVSTJZSA-N 1 1 324.468 3.715 20 10 DHCDMO CCC[N@H+](Cc1cc2c(cc1O)OC[C@H]2O)CC1CCCCC1 ZINC000768442158 1022966962 /nfs/dbraw/zinc/96/69/62/1022966962.db2.gz JRYFEFUMWFKOJZ-GOSISDBHSA-N 1 1 319.445 3.610 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2C2CCCCC2)cc1OC ZINC000768440941 1022967825 /nfs/dbraw/zinc/96/78/25/1022967825.db2.gz BDTCXEYUKKRFMA-INIZCTEOSA-N 1 1 319.445 3.954 20 10 DHCDMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768464742 1022972015 /nfs/dbraw/zinc/97/20/15/1022972015.db2.gz TVBUPNFPPVOXCN-YJBOKZPZSA-N 1 1 319.445 3.609 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1CCOC[C@@H]1c1ccccc1)CCCC2 ZINC000768465756 1022972293 /nfs/dbraw/zinc/97/22/93/1022972293.db2.gz KOBOSSCYZOAOCB-HXUWFJFHSA-N 1 1 323.436 3.845 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCOC[C@@H]1c1ccccc1)CCCC2 ZINC000768465756 1022972303 /nfs/dbraw/zinc/97/23/03/1022972303.db2.gz KOBOSSCYZOAOCB-HXUWFJFHSA-N 1 1 323.436 3.845 20 10 DHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000768542814 1022985050 /nfs/dbraw/zinc/98/50/50/1022985050.db2.gz ZUWJCGBPIOGCTL-HNNXBMFYSA-N 1 1 308.441 3.530 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310081247 1022990550 /nfs/dbraw/zinc/99/05/50/1022990550.db2.gz JLBRBZKNMDZVKV-UTKZUKDTSA-N 1 1 324.468 3.955 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccccc1OC(F)(F)F ZINC000768872815 1023044716 /nfs/dbraw/zinc/04/47/16/1023044716.db2.gz IYZPGBGBOAFUGZ-UHFFFAOYSA-N 1 1 311.303 3.923 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCOc3ccccc3[C@H]2C)c1 ZINC000768930133 1023059644 /nfs/dbraw/zinc/05/96/44/1023059644.db2.gz LKIYNRXJBQINSN-CQSZACIVSA-N 1 1 313.397 3.747 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC(C)(C)O1 ZINC000769100717 1023080741 /nfs/dbraw/zinc/08/07/41/1023080741.db2.gz OWKMUBPMBFWDNT-INIZCTEOSA-N 1 1 302.462 3.676 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCC[C@H]2CO)cc1 ZINC000769074495 1023082778 /nfs/dbraw/zinc/08/27/78/1023082778.db2.gz MIAJASNEZNMHCG-NRFANRHFSA-N 1 1 324.468 3.670 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](SC)C2)c1 ZINC000756589264 1023088520 /nfs/dbraw/zinc/08/85/20/1023088520.db2.gz LDPKMTXIPYDSKC-YUTCNCBUSA-N 1 1 323.458 3.504 20 10 DHCDMO C[N@H+](Cc1cc(Br)ccc1O)C(C1CC1)C1CC1 ZINC000769192087 1023090651 /nfs/dbraw/zinc/09/06/51/1023090651.db2.gz CREXWIGFKSVUHV-UHFFFAOYSA-N 1 1 310.235 3.775 20 10 DHCDMO C[N@@H+](Cc1cc(Br)ccc1O)C(C1CC1)C1CC1 ZINC000769192087 1023090660 /nfs/dbraw/zinc/09/06/60/1023090660.db2.gz CREXWIGFKSVUHV-UHFFFAOYSA-N 1 1 310.235 3.775 20 10 DHCDMO CN(C)[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769301830 1023115763 /nfs/dbraw/zinc/11/57/63/1023115763.db2.gz GKIHPVLBROELPI-LJQANCHMSA-N 1 1 310.441 3.585 20 10 DHCDMO C[NH+](C)[C@@H]1CCCN(Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769301830 1023115770 /nfs/dbraw/zinc/11/57/70/1023115770.db2.gz GKIHPVLBROELPI-LJQANCHMSA-N 1 1 310.441 3.585 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1 ZINC000769316595 1023120669 /nfs/dbraw/zinc/12/06/69/1023120669.db2.gz JSYBCYZMKVEXAL-SFHVURJKSA-N 1 1 324.424 3.818 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2C)c1O ZINC000769317968 1023121232 /nfs/dbraw/zinc/12/12/32/1023121232.db2.gz CXTQEIGFBOLCPL-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769426687 1023146628 /nfs/dbraw/zinc/14/66/28/1023146628.db2.gz VPYAXSHZGCCXFF-SFHVURJKSA-N 1 1 320.452 3.673 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000769425057 1023146903 /nfs/dbraw/zinc/14/69/03/1023146903.db2.gz OEFNSPQUYRZTDO-GFCCVEGCSA-N 1 1 301.361 3.659 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)cc1 ZINC000769427338 1023147130 /nfs/dbraw/zinc/14/71/30/1023147130.db2.gz VVPAIQZFEZJRRS-NRFANRHFSA-N 1 1 324.468 3.625 20 10 DHCDMO CC[C@H]1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000769463926 1023159329 /nfs/dbraw/zinc/15/93/29/1023159329.db2.gz SZSDEERWJCPMTI-KRWDZBQOSA-N 1 1 302.462 3.535 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(O)c1 ZINC000769499963 1023166555 /nfs/dbraw/zinc/16/65/55/1023166555.db2.gz YAADKMRHWLUSCP-RDJZCZTQSA-N 1 1 307.459 3.651 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000769531783 1023173813 /nfs/dbraw/zinc/17/38/13/1023173813.db2.gz XFXUHHINPPQDIH-UHFFFAOYSA-N 1 1 309.768 3.825 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)cc1 ZINC000769533213 1023174395 /nfs/dbraw/zinc/17/43/95/1023174395.db2.gz PLKKOIUDDFWSNU-FQEVSTJZSA-N 1 1 316.489 3.925 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000769557907 1023179185 /nfs/dbraw/zinc/17/91/85/1023179185.db2.gz DGCLDQKCUUQDJM-GFCCVEGCSA-N 1 1 319.351 3.669 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000769557910 1023179533 /nfs/dbraw/zinc/17/95/33/1023179533.db2.gz DGCLDQKCUUQDJM-LBPRGKRZSA-N 1 1 319.351 3.669 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)cc1F ZINC000770287030 1023291245 /nfs/dbraw/zinc/29/12/45/1023291245.db2.gz UNFSLUYLDZQNQI-WMZOPIPTSA-N 1 1 320.452 3.673 20 10 DHCDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000770510034 1023316387 /nfs/dbraw/zinc/31/63/87/1023316387.db2.gz VURWMPZSMLUGSI-APWZRJJASA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1c(C)cccc1O)CCC2 ZINC000876730973 1033129798 /nfs/dbraw/zinc/12/97/98/1033129798.db2.gz CMGKVQWECTXZOO-HNNXBMFYSA-N 1 1 302.443 3.975 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC000771934894 1023489930 /nfs/dbraw/zinc/48/99/30/1023489930.db2.gz GHOMIQDTPDOAPN-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO OCC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C1CCCCC1 ZINC000771934041 1023489983 /nfs/dbraw/zinc/48/99/83/1023489983.db2.gz SNNWLMCJYSDLHU-UHFFFAOYSA-N 1 1 316.489 3.804 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c(O)c1 ZINC000876771040 1033140262 /nfs/dbraw/zinc/14/02/62/1033140262.db2.gz UBBHYIPDRKTUBN-SFHVURJKSA-N 1 1 311.425 3.739 20 10 DHCDMO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)cc1 ZINC001170061603 1023714305 /nfs/dbraw/zinc/71/43/05/1023714305.db2.gz WMHLDUWNJZUAIY-GOSISDBHSA-N 1 1 317.521 3.743 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1ccc(F)cc1C ZINC000746667148 1023781584 /nfs/dbraw/zinc/78/15/84/1023781584.db2.gz VYLFOESSODUTEQ-IBGZPJMESA-N 1 1 317.404 3.785 20 10 DHCDMO Cc1ccccc1C[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000746712634 1023830517 /nfs/dbraw/zinc/83/05/17/1023830517.db2.gz OVKBHIANLFUNJZ-UHFFFAOYSA-N 1 1 311.381 3.594 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1ccc(F)cc1O ZINC000796703408 1023855536 /nfs/dbraw/zinc/85/55/36/1023855536.db2.gz UMAALJQJOMPTIG-WMZOPIPTSA-N 1 1 303.377 3.614 20 10 DHCDMO C[N@@H+](CCC[C@@H]1CCOC1)Cc1ccc(N2CCCCC2)cc1 ZINC000788442320 1023893230 /nfs/dbraw/zinc/89/32/30/1023893230.db2.gz DJIYXMNGSFQZTD-LJQANCHMSA-N 1 1 316.489 3.925 20 10 DHCDMO CCN(CC)C[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788587273 1023910610 /nfs/dbraw/zinc/91/06/10/1023910610.db2.gz HPJQLDRWCYEQIX-RYUDHWBXSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@H]([NH2+]CCN1CCC[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000788612435 1023913662 /nfs/dbraw/zinc/91/36/62/1023913662.db2.gz MGHRXHMVLNFFEW-NEPJUHHUSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCS1)c1cccc(C(F)(F)F)c1O ZINC000788629561 1023916410 /nfs/dbraw/zinc/91/64/10/1023916410.db2.gz WJGFPFLRTDHVTE-NXEZZACHSA-N 1 1 305.365 3.957 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)CCCOC3)cc1C(C)C ZINC000789544556 1024111887 /nfs/dbraw/zinc/11/18/87/1024111887.db2.gz HGHUOFXFSFYHFQ-LJQANCHMSA-N 1 1 303.446 3.827 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1 ZINC000268997153 1024215115 /nfs/dbraw/zinc/21/51/15/1024215115.db2.gz KUOFHIBZNNKBIP-INIZCTEOSA-N 1 1 315.505 3.810 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000883168138 1024266368 /nfs/dbraw/zinc/26/63/68/1024266368.db2.gz QPEDJDHGFVVPKP-UHFFFAOYSA-N 1 1 323.314 3.641 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]C2(c3ncccn3)CCC2)c2c1c(F)ccc2O ZINC000883311628 1024363530 /nfs/dbraw/zinc/36/35/30/1024363530.db2.gz HENKAAOEXAOKJZ-WCQYABFASA-N 1 1 313.376 3.539 20 10 DHCDMO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1cc2c(cc1O)CCCC2 ZINC000883311555 1024364252 /nfs/dbraw/zinc/36/42/52/1024364252.db2.gz DTOJQXKGRLGRAW-AWEZNQCLSA-N 1 1 323.440 3.791 20 10 DHCDMO C[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)N1CCCC[C@@H]1C ZINC000790948853 1024402553 /nfs/dbraw/zinc/40/25/53/1024402553.db2.gz ISLXJMGWCUOIHU-RYUDHWBXSA-N 1 1 314.832 3.537 20 10 DHCDMO CCO[C@@H](CC[NH2+]Cc1c(O)ccc(Cl)c1F)C(C)C ZINC000790971695 1024410199 /nfs/dbraw/zinc/41/01/99/1024410199.db2.gz UNFPZSOSTFREAW-AWEZNQCLSA-N 1 1 303.805 3.726 20 10 DHCDMO C[C@@](O)(CC[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000790988299 1024412199 /nfs/dbraw/zinc/41/21/99/1024412199.db2.gz MKLNQCBLKRGFKW-QGZVFWFLSA-N 1 1 323.795 3.572 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000790990989 1024413524 /nfs/dbraw/zinc/41/35/24/1024413524.db2.gz JQXJVYFMHHCAQR-UHFFFAOYSA-N 1 1 304.752 3.956 20 10 DHCDMO COc1cccc(O)c1C[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC000883383016 1024415159 /nfs/dbraw/zinc/41/51/59/1024415159.db2.gz RMQZTNYTIFLYFJ-QAPCUYQASA-N 1 1 301.361 3.516 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCSCC(F)(F)F ZINC000790981986 1024425945 /nfs/dbraw/zinc/42/59/45/1024425945.db2.gz ODLPHWVCSYZRIL-UHFFFAOYSA-N 1 1 317.735 3.570 20 10 DHCDMO Cc1ncsc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000271041939 1024448190 /nfs/dbraw/zinc/44/81/90/1024448190.db2.gz JKWUNCPVTGBXPM-UHFFFAOYSA-N 1 1 301.459 3.682 20 10 DHCDMO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1ccccc1O ZINC000271134850 1024459510 /nfs/dbraw/zinc/45/95/10/1024459510.db2.gz RBCMGHWYHKMRDB-UHFFFAOYSA-N 1 1 301.434 3.593 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000271255089 1024478606 /nfs/dbraw/zinc/47/86/06/1024478606.db2.gz JKYFJPBRSGPZLY-BLLLJJGKSA-N 1 1 321.804 3.727 20 10 DHCDMO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccccc1O ZINC000271444496 1024507971 /nfs/dbraw/zinc/50/79/71/1024507971.db2.gz SOQUMUBQGXZZIW-QGZVFWFLSA-N 1 1 307.397 3.616 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000791577743 1024519625 /nfs/dbraw/zinc/51/96/25/1024519625.db2.gz DKBKYDIQWQBPSD-AMIZOPFISA-N 1 1 319.298 3.507 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000791577743 1024519631 /nfs/dbraw/zinc/51/96/31/1024519631.db2.gz DKBKYDIQWQBPSD-AMIZOPFISA-N 1 1 319.298 3.507 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC001202560868 1024559010 /nfs/dbraw/zinc/55/90/10/1024559010.db2.gz NPOADKHLTWOCHI-UHFFFAOYSA-N 1 1 307.315 3.977 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792167407 1024640931 /nfs/dbraw/zinc/64/09/31/1024640931.db2.gz HZTRLUGSJSYCDO-LLVKDONJSA-N 1 1 323.795 3.953 20 10 DHCDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000792167407 1024640938 /nfs/dbraw/zinc/64/09/38/1024640938.db2.gz HZTRLUGSJSYCDO-LLVKDONJSA-N 1 1 323.795 3.953 20 10 DHCDMO Cc1cc(C(=O)Cn2cc[nH+]c2C)c(C)n1-c1cccc(C)c1 ZINC000760179434 1024700192 /nfs/dbraw/zinc/70/01/92/1024700192.db2.gz QCNNJRYNXYPZNC-UHFFFAOYSA-N 1 1 307.397 3.790 20 10 DHCDMO CCOCC[N@@H+](CC)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792796032 1024794548 /nfs/dbraw/zinc/79/45/48/1024794548.db2.gz OEUSODSKKFJVGJ-UHFFFAOYSA-N 1 1 318.383 3.630 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H](C2CC2)O1 ZINC000793221218 1024936422 /nfs/dbraw/zinc/93/64/22/1024936422.db2.gz YAPNJOBTGWILSE-OXQOHEQNSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000121300271 1025084784 /nfs/dbraw/zinc/08/47/84/1025084784.db2.gz UQUNWFKMDFAFKD-UHFFFAOYSA-N 1 1 316.470 3.525 20 10 DHCDMO CC(C)OC(=O)c1ccc(C[N@@H+](C)Cc2ccccc2O)cc1 ZINC000135187101 1025192421 /nfs/dbraw/zinc/19/24/21/1025192421.db2.gz KHQLXSUTVSKQFL-UHFFFAOYSA-N 1 1 313.397 3.589 20 10 DHCDMO Cc1c2ccccc2n(C)c1CNC1CC[NH+](C(C)(C)C)CC1 ZINC000391414961 1025335691 /nfs/dbraw/zinc/33/56/91/1025335691.db2.gz ODUWIEMLVNCABR-UHFFFAOYSA-N 1 1 313.489 3.839 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1Cl ZINC000825955175 1033283053 /nfs/dbraw/zinc/28/30/53/1033283053.db2.gz HNGMHTKYQBWRSF-KGLIPLIRSA-N 1 1 301.764 3.831 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)[C@@H](C)C[S@](C)=O)cc1 ZINC000187831317 1025472124 /nfs/dbraw/zinc/47/21/24/1025472124.db2.gz PRWGOIHYRDLQNF-AOMKIAJQSA-N 1 1 324.534 3.512 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cc(C3CC3)no2)cc1C ZINC000886269040 1025573790 /nfs/dbraw/zinc/57/37/90/1025573790.db2.gz JPPLIDRGXGESHB-UHFFFAOYSA-N 1 1 300.402 3.939 20 10 DHCDMO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886491365 1025650384 /nfs/dbraw/zinc/65/03/84/1025650384.db2.gz ASLQXJUNNAGDOS-RYUDHWBXSA-N 1 1 319.376 3.960 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1c(O)cccc1F ZINC000886501792 1025658557 /nfs/dbraw/zinc/65/85/57/1025658557.db2.gz ZJFKQIAPKOMWOK-GJZGRUSLSA-N 1 1 314.404 3.708 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cn1 ZINC000886508911 1025662285 /nfs/dbraw/zinc/66/22/85/1025662285.db2.gz SCTKMRZTFNJACV-ZDUSSCGKSA-N 1 1 317.408 3.623 20 10 DHCDMO CCC(=O)Nc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886506304 1025662464 /nfs/dbraw/zinc/66/24/64/1025662464.db2.gz LBYWJIWIQQAHTP-GFCCVEGCSA-N 1 1 316.376 3.731 20 10 DHCDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1c(O)cccc1F ZINC000886512857 1025668773 /nfs/dbraw/zinc/66/87/73/1025668773.db2.gz OMCBKDBXCDRVCF-LBPRGKRZSA-N 1 1 304.365 3.566 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1c(O)cccc1F ZINC000886512347 1025668859 /nfs/dbraw/zinc/66/88/59/1025668859.db2.gz CQBSFXVUUGCPED-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1Cl)c1c(O)cccc1F ZINC000886549476 1025693524 /nfs/dbraw/zinc/69/35/24/1025693524.db2.gz IRWZAJJSDQFOGU-MEBBXXQBSA-N 1 1 309.768 3.569 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc2c1OCCCO2)c1c(O)cccc1F ZINC000886553705 1025700642 /nfs/dbraw/zinc/70/06/42/1025700642.db2.gz UAXBJQOFPOGRSX-GFCCVEGCSA-N 1 1 317.360 3.543 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c([O-])cccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000886588726 1025726851 /nfs/dbraw/zinc/72/68/51/1025726851.db2.gz XXONVWGFNGYVCD-ILXRZTDVSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610908 1025735581 /nfs/dbraw/zinc/73/55/81/1025735581.db2.gz MXLKBJCPZGVJEJ-YPMHNXCESA-N 1 1 323.795 3.611 20 10 DHCDMO C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1c(O)cccc1F ZINC000886617791 1025743971 /nfs/dbraw/zinc/74/39/71/1025743971.db2.gz YRHNHLXYHXNLAB-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886623919 1025746114 /nfs/dbraw/zinc/74/61/14/1025746114.db2.gz SRPPVBFFDDTXGA-ZIAGYGMSSA-N 1 1 302.393 3.988 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccccc1)c1ccc(F)cc1O ZINC000808722097 1026369801 /nfs/dbraw/zinc/36/98/01/1026369801.db2.gz YVYUTAWGRZSKFZ-PZPSRYQVSA-N 1 1 303.377 3.694 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(F)cc1O ZINC000808729099 1026382968 /nfs/dbraw/zinc/38/29/68/1026382968.db2.gz ZHPPVFIBPNHEMZ-WBMJQRKESA-N 1 1 301.361 3.748 20 10 DHCDMO CCOc1ccccc1C[N@@H+](C)Cc1cc(C)cc(OC)c1O ZINC000178862548 1026425590 /nfs/dbraw/zinc/42/55/90/1026425590.db2.gz IYXJBYQBOOARLS-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO CC[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(C)cc1O ZINC000280034735 1026574872 /nfs/dbraw/zinc/57/48/72/1026574872.db2.gz IJGIGDSOVGARTH-SFHVURJKSA-N 1 1 302.462 3.616 20 10 DHCDMO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700204 1026586570 /nfs/dbraw/zinc/58/65/70/1026586570.db2.gz ACNVTONEKXUGKH-VXGBXAGGSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700204 1026586572 /nfs/dbraw/zinc/58/65/72/1026586572.db2.gz ACNVTONEKXUGKH-VXGBXAGGSA-N 1 1 315.816 3.700 20 10 DHCDMO COC[C@H](C)C[N@@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC000809731018 1026597560 /nfs/dbraw/zinc/59/75/60/1026597560.db2.gz AFUMDBWBMQCMDZ-MRXNPFEDSA-N 1 1 316.445 3.630 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCN(c3ccccc3F)CC2)c1 ZINC000809712066 1026601059 /nfs/dbraw/zinc/60/10/59/1026601059.db2.gz AFUASVSTVMJTGV-UHFFFAOYSA-N 1 1 314.404 3.552 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000809758176 1026617475 /nfs/dbraw/zinc/61/74/75/1026617475.db2.gz FQUFZDJKFJHNDP-KGLIPLIRSA-N 1 1 309.837 3.684 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2O)Cc2ccccc2O1 ZINC000809789997 1026627560 /nfs/dbraw/zinc/62/75/60/1026627560.db2.gz RQEOMIZPVSRXCN-UHFFFAOYSA-N 1 1 301.361 3.705 20 10 DHCDMO Oc1ccc(Br)cc1C[N@@H+]1CCCc2occc2C1 ZINC000809792540 1026629240 /nfs/dbraw/zinc/62/92/40/1026629240.db2.gz ADBHNSUMBMWCRI-UHFFFAOYSA-N 1 1 322.202 3.696 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCCc2occc2C1 ZINC000809792540 1026629243 /nfs/dbraw/zinc/62/92/43/1026629243.db2.gz ADBHNSUMBMWCRI-UHFFFAOYSA-N 1 1 322.202 3.696 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000809971606 1026646724 /nfs/dbraw/zinc/64/67/24/1026646724.db2.gz IFRUVHFAPUDWOP-NSHDSACASA-N 1 1 304.390 3.537 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000811781551 1027083086 /nfs/dbraw/zinc/08/30/86/1027083086.db2.gz DRCFJARNXDTLMY-OAQYLSRUSA-N 1 1 323.436 3.979 20 10 DHCDMO CC[N@H+](Cc1cc(OC)cc(C(C)(C)C)c1O)C[C@@H](C)OC ZINC000812303628 1027239233 /nfs/dbraw/zinc/23/92/33/1027239233.db2.gz QSNANJDTQDVIBZ-CYBMUJFWSA-N 1 1 309.450 3.555 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(O)c(F)c1 ZINC000813334607 1027611965 /nfs/dbraw/zinc/61/19/65/1027611965.db2.gz RKNQTZQHRKHBHZ-UHFFFAOYSA-N 1 1 302.393 3.619 20 10 DHCDMO OCc1ccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)cc1 ZINC000778944972 1027631258 /nfs/dbraw/zinc/63/12/58/1027631258.db2.gz ZRXLUJDYXYVJIM-UHFFFAOYSA-N 1 1 311.425 3.829 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)C3CCCC3)cc2)CC1 ZINC000296474682 1027648582 /nfs/dbraw/zinc/64/85/82/1027648582.db2.gz KCZZGLKGHRTEJR-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000778994227 1027730420 /nfs/dbraw/zinc/73/04/20/1027730420.db2.gz IMAJVOAZEVLTNO-UHFFFAOYSA-N 1 1 301.336 3.960 20 10 DHCDMO C[N@H+](Cc1ccccc1O)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000779001451 1027749230 /nfs/dbraw/zinc/74/92/30/1027749230.db2.gz DZVRXESVPUHIBI-QUCCMNQESA-N 1 1 311.425 3.992 20 10 DHCDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000779018904 1027850505 /nfs/dbraw/zinc/85/05/05/1027850505.db2.gz IZARIUYGGXOAFC-SFHVURJKSA-N 1 1 317.404 3.550 20 10 DHCDMO CCc1nc([C@H]2CCC[N@H+]([C@H](CC)c3ccccc3O)C2)no1 ZINC000364624507 1027860107 /nfs/dbraw/zinc/86/01/07/1027860107.db2.gz SYFKONWGEGQECP-DZGCQCFKSA-N 1 1 315.417 3.668 20 10 DHCDMO CC[C@H]1CC[N@H+]1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 ZINC000814179007 1027913669 /nfs/dbraw/zinc/91/36/69/1027913669.db2.gz MRRUWAJXIRDLOE-HNNXBMFYSA-N 1 1 303.406 3.569 20 10 DHCDMO CCOc1ccc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)c(O)c1 ZINC000814177757 1027915546 /nfs/dbraw/zinc/91/55/46/1027915546.db2.gz NXKZMPSQZZEPSR-CQSZACIVSA-N 1 1 313.397 3.574 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000365509494 1027957826 /nfs/dbraw/zinc/95/78/26/1027957826.db2.gz QJKRWEJDFVNQER-KFKAGJAMSA-N 1 1 311.425 3.791 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000527928223 1027965700 /nfs/dbraw/zinc/96/57/00/1027965700.db2.gz NTXQTMFLIVABGF-VXGBXAGGSA-N 1 1 317.351 3.878 20 10 DHCDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000780793966 1028183436 /nfs/dbraw/zinc/18/34/36/1028183436.db2.gz ZWXZOGOGVQBXGR-JSGCOSHPSA-N 1 1 300.368 3.915 20 10 DHCDMO CC[C@H]([NH2+]C[C@]1(C)CCO[C@H]1C1CC1)c1ccc(F)cc1O ZINC000367584972 1028207728 /nfs/dbraw/zinc/20/77/28/1028207728.db2.gz CAJUSTPDFDWLBS-SZMVWBNQSA-N 1 1 307.409 3.777 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000048795145 1028251686 /nfs/dbraw/zinc/25/16/86/1028251686.db2.gz SUWNZLFFRCARRV-OAHLLOKOSA-N 1 1 318.214 3.932 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCCN(c2nccs2)CC1 ZINC000368028633 1028284740 /nfs/dbraw/zinc/28/47/40/1028284740.db2.gz FEDOFBLEAYHTFX-HNNXBMFYSA-N 1 1 317.458 3.512 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137220 1028310439 /nfs/dbraw/zinc/31/04/39/1028310439.db2.gz YGDHAAGYDYYVEV-FUHWJXTLSA-N 1 1 302.462 3.507 20 10 DHCDMO CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137220 1028310454 /nfs/dbraw/zinc/31/04/54/1028310454.db2.gz YGDHAAGYDYYVEV-FUHWJXTLSA-N 1 1 302.462 3.507 20 10 DHCDMO Cc1cc(CN2CCC[C@H]([NH+]3CCCC3)CC2)ccc1N(C)C ZINC000815052157 1028337529 /nfs/dbraw/zinc/33/75/29/1028337529.db2.gz DZAHQIXMZGUWLO-IBGZPJMESA-N 1 1 315.505 3.511 20 10 DHCDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC000815078640 1028353008 /nfs/dbraw/zinc/35/30/08/1028353008.db2.gz DUYHEHCWXIQLIA-GOSISDBHSA-N 1 1 312.461 3.738 20 10 DHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc1N(C)C ZINC000815118968 1028367583 /nfs/dbraw/zinc/36/75/83/1028367583.db2.gz NWROIWXOJDAMLI-OALUTQOASA-N 1 1 314.473 3.595 20 10 DHCDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc(F)cc1O ZINC000368586509 1028379529 /nfs/dbraw/zinc/37/95/29/1028379529.db2.gz YUKTZULHPCMAJE-GBNMTWHSSA-N 1 1 305.324 3.843 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCCC[C@@H]1O ZINC000779154448 1028457373 /nfs/dbraw/zinc/45/73/73/1028457373.db2.gz SQIYBTPOSNMPKJ-QUCCMNQESA-N 1 1 316.489 3.660 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(F)n1)c1cccc(C(F)(F)F)c1O ZINC000815598620 1028565142 /nfs/dbraw/zinc/56/51/42/1028565142.db2.gz YVSPGHXMJDJWBQ-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000815651716 1028593895 /nfs/dbraw/zinc/59/38/95/1028593895.db2.gz BABLIEJTRCLZSZ-SKDRFNHKSA-N 1 1 305.340 3.611 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1O ZINC000779188668 1028666398 /nfs/dbraw/zinc/66/63/98/1028666398.db2.gz WQYBXFAFCINOMA-INIZCTEOSA-N 1 1 309.837 3.745 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2nc(C)cs2)C1 ZINC000372597051 1028873464 /nfs/dbraw/zinc/87/34/64/1028873464.db2.gz WOBCUEVFFHHXHI-GDBMZVCRSA-N 1 1 318.442 3.682 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@H](n2nc(C)cc2C)C1 ZINC000372597182 1028875417 /nfs/dbraw/zinc/87/54/17/1028875417.db2.gz XUJIVPPEFIDESN-FUHWJXTLSA-N 1 1 313.445 3.994 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@H](c2nc(C)cs2)C1 ZINC000372597053 1028875613 /nfs/dbraw/zinc/87/56/13/1028875613.db2.gz WOBCUEVFFHHXHI-HOCLYGCPSA-N 1 1 318.442 3.682 20 10 DHCDMO COCC[C@@H]1CCCC[N@H+]([C@H](C)c2cc(OC)ccc2O)C1 ZINC000372718251 1028887848 /nfs/dbraw/zinc/88/78/48/1028887848.db2.gz PQAQSQAHBVPDIE-CABCVRRESA-N 1 1 307.434 3.600 20 10 DHCDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)n1 ZINC000816491529 1028898912 /nfs/dbraw/zinc/89/89/12/1028898912.db2.gz PDGZPJFROQWRBB-MRXNPFEDSA-N 1 1 323.396 3.616 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@H](C3CCOCC3)C2)ccc2ccccc21 ZINC000816516531 1028918791 /nfs/dbraw/zinc/91/87/91/1028918791.db2.gz IQFPDLXOTFKEDW-KRWDZBQOSA-N 1 1 311.425 3.794 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000816536316 1028921707 /nfs/dbraw/zinc/92/17/07/1028921707.db2.gz RMLPLULDNQFPNP-UHFFFAOYSA-N 1 1 324.783 3.658 20 10 DHCDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816593183 1028938782 /nfs/dbraw/zinc/93/87/82/1028938782.db2.gz HWEFEYGYTJKTLT-KRWDZBQOSA-N 1 1 321.424 3.659 20 10 DHCDMO COC[C@H](Cc1ccccc1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816555427 1028942814 /nfs/dbraw/zinc/94/28/14/1028942814.db2.gz DIOGQXFNMLVZLG-AWEZNQCLSA-N 1 1 323.795 3.532 20 10 DHCDMO OCC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)C1CCCCC1 ZINC000816559351 1028945352 /nfs/dbraw/zinc/94/53/52/1028945352.db2.gz GVVUREKZOHOBMN-HNNXBMFYSA-N 1 1 315.816 3.606 20 10 DHCDMO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816574150 1028952839 /nfs/dbraw/zinc/95/28/39/1028952839.db2.gz YORPMDPGPMNIPZ-HOCLYGCPSA-N 1 1 315.816 3.868 20 10 DHCDMO C[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1Cc1ccc2ccccc2c1O ZINC000816608976 1028959633 /nfs/dbraw/zinc/95/96/33/1028959633.db2.gz OWBKSGCEXYNDHD-CRAIPNDOSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1Cc1ccc2ccccc2c1O ZINC000816608976 1028959640 /nfs/dbraw/zinc/95/96/40/1028959640.db2.gz OWBKSGCEXYNDHD-CRAIPNDOSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1C[C@@H](N2CCCC2)C[N@H+]1Cc1ccc2ccccc2c1O ZINC000816608977 1028961598 /nfs/dbraw/zinc/96/15/98/1028961598.db2.gz OWBKSGCEXYNDHD-MAUKXSAKSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1Cc1ccc2ccccc2c1O ZINC000816608977 1028961610 /nfs/dbraw/zinc/96/16/10/1028961610.db2.gz OWBKSGCEXYNDHD-MAUKXSAKSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(F)cc1O ZINC000373254632 1028989862 /nfs/dbraw/zinc/98/98/62/1028989862.db2.gz FVNDDAKOILGUJS-RFUYNDQBSA-N 1 1 315.388 3.960 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000817413574 1029152877 /nfs/dbraw/zinc/15/28/77/1029152877.db2.gz ZLMBCBZBKWFXEV-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO OCC[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000817418700 1029154666 /nfs/dbraw/zinc/15/46/66/1029154666.db2.gz CHBAJONWVSMAGO-SFHVURJKSA-N 1 1 316.489 3.661 20 10 DHCDMO CCc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938942 1029282682 /nfs/dbraw/zinc/28/26/82/1029282682.db2.gz WAVHMPKXKBICCD-QRWLVFNGSA-N 1 1 311.473 3.666 20 10 DHCDMO CCc1ccc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938619 1029284272 /nfs/dbraw/zinc/28/42/72/1029284272.db2.gz OMGHHVTXLJIEOJ-DYVFJYSZSA-N 1 1 317.502 3.727 20 10 DHCDMO Cc1cc(C)cc([C@@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938503 1029284416 /nfs/dbraw/zinc/28/44/16/1029284416.db2.gz LTSSXHXXEBSJJO-OXQOHEQNSA-N 1 1 311.473 3.720 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1F ZINC000817942949 1029288679 /nfs/dbraw/zinc/28/86/79/1029288679.db2.gz SABKXNXJRUVSRP-RBUKOAKNSA-N 1 1 315.436 3.632 20 10 DHCDMO CCCC[C@H](C[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817962057 1029302563 /nfs/dbraw/zinc/30/25/63/1029302563.db2.gz HIZZKBWPERLZPA-WDEREUQCSA-N 1 1 304.356 3.579 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cc(Cl)ccc1[O-] ZINC000817976297 1029314358 /nfs/dbraw/zinc/31/43/58/1029314358.db2.gz XAXULWSYNUHRKM-XEZPLFJOSA-N 1 1 310.869 3.851 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817980386 1029316678 /nfs/dbraw/zinc/31/66/78/1029316678.db2.gz ALWSEEDHXFKREE-JKOKRWQUSA-N 1 1 316.367 3.579 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977995 1029316882 /nfs/dbraw/zinc/31/68/82/1029316882.db2.gz SSQOTFQGCUYDHL-GWCFXTLKSA-N 1 1 304.356 3.579 20 10 DHCDMO C[C@@H](NCCC[NH2+]C1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817983900 1029320857 /nfs/dbraw/zinc/32/08/57/1029320857.db2.gz LAVOOVUGJYKHEQ-OAHLLOKOSA-N 1 1 319.468 3.609 20 10 DHCDMO C[C@H]([NH2+][C@H](C[NH3+])C1CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817983007 1029321124 /nfs/dbraw/zinc/32/11/24/1029321124.db2.gz XMWVYAHBHCRTFI-TVQRCGJNSA-N 1 1 317.260 3.867 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1C ZINC000819904269 1029622262 /nfs/dbraw/zinc/62/22/62/1029622262.db2.gz QTWHZMLOCGFDGW-LJQANCHMSA-N 1 1 315.457 3.790 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1O ZINC000822525613 1030044042 /nfs/dbraw/zinc/04/40/42/1030044042.db2.gz JXEMOYOJCFRCSV-IAGOWNOFSA-N 1 1 317.816 3.662 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1nc(C(F)F)no1)C1CCCC1 ZINC000822622128 1030071612 /nfs/dbraw/zinc/07/16/12/1030071612.db2.gz TUAXSEAOIVYKPT-UHFFFAOYSA-N 1 1 323.343 3.658 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1nc(C(F)F)no1)C1CCCC1 ZINC000822622128 1030071630 /nfs/dbraw/zinc/07/16/30/1030071630.db2.gz TUAXSEAOIVYKPT-UHFFFAOYSA-N 1 1 323.343 3.658 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C)[C@H](CC)c2ccncc2)c1 ZINC000290617028 1030129896 /nfs/dbraw/zinc/12/98/96/1030129896.db2.gz XAIJJCLLLBRNBQ-QGZVFWFLSA-N 1 1 300.402 3.769 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(Cl)cc1O ZINC000841759361 1030229585 /nfs/dbraw/zinc/22/95/85/1030229585.db2.gz YYISMYMESBFERS-RYUDHWBXSA-N 1 1 303.789 3.872 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccnc(Cl)c1F ZINC000823423425 1030298540 /nfs/dbraw/zinc/29/85/40/1030298540.db2.gz IUIKHRKBMSWOPV-UHFFFAOYSA-N 1 1 308.784 3.992 20 10 DHCDMO C[C@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccc(F)cc1O ZINC000866480916 1030319008 /nfs/dbraw/zinc/31/90/08/1030319008.db2.gz KATIPAINQQEOHJ-SUMWQHHRSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCOC1)c1ccc(Cl)cc1O ZINC000866511962 1030338033 /nfs/dbraw/zinc/33/80/33/1030338033.db2.gz GUFJYPJVTLEAAH-BNLOLNQZSA-N 1 1 309.837 3.901 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccc(F)cc1O ZINC000866529464 1030346536 /nfs/dbraw/zinc/34/65/36/1030346536.db2.gz GMJDJXSZNPRPKX-BBRMVZONSA-N 1 1 307.409 3.779 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1O ZINC000866614736 1030404600 /nfs/dbraw/zinc/40/46/00/1030404600.db2.gz OPTUVMPMGRBKIY-ZJUUUORDSA-N 1 1 313.323 3.556 20 10 DHCDMO C[N@@H+](CCC1CCOCC1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000121227041 1030439045 /nfs/dbraw/zinc/43/90/45/1030439045.db2.gz PYBVHTOMEXESIQ-UHFFFAOYSA-N 1 1 321.461 3.644 20 10 DHCDMO Oc1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000824474302 1030561232 /nfs/dbraw/zinc/56/12/32/1030561232.db2.gz MPGSXEOXAOMIFS-CQSZACIVSA-N 1 1 321.218 3.820 20 10 DHCDMO Oc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000824474302 1030561237 /nfs/dbraw/zinc/56/12/37/1030561237.db2.gz MPGSXEOXAOMIFS-CQSZACIVSA-N 1 1 321.218 3.820 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCCC(C)(F)F)c1 ZINC000824477759 1030561277 /nfs/dbraw/zinc/56/12/77/1030561277.db2.gz WWDPGSGCQOYYHL-UHFFFAOYSA-N 1 1 322.193 3.988 20 10 DHCDMO Cc1cc([O-])c(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1Cl ZINC000824606263 1030595456 /nfs/dbraw/zinc/59/54/56/1030595456.db2.gz QDBFGNCNNDOKHE-UHFFFAOYSA-N 1 1 310.869 3.518 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H](CO)c1ccccc1 ZINC000824696441 1030614543 /nfs/dbraw/zinc/61/45/43/1030614543.db2.gz MYOOKFNMXVFZDI-NRFANRHFSA-N 1 1 324.468 3.842 20 10 DHCDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000824715532 1030618540 /nfs/dbraw/zinc/61/85/40/1030618540.db2.gz LFZPAEJHACPSKR-JSGCOSHPSA-N 1 1 300.368 3.915 20 10 DHCDMO Cc1cc(O)c(C[N@H+](C)[C@H]2CCCc3c2cnn3C)cc1Cl ZINC000824905908 1030664307 /nfs/dbraw/zinc/66/43/07/1030664307.db2.gz IKBOHXPNTIOSNZ-HNNXBMFYSA-N 1 1 319.836 3.597 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000825247518 1030759673 /nfs/dbraw/zinc/75/96/73/1030759673.db2.gz TUJWJJGJRRTKJI-CQSZACIVSA-N 1 1 310.869 3.564 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1Cl ZINC000825247518 1030759687 /nfs/dbraw/zinc/75/96/87/1030759687.db2.gz TUJWJJGJRRTKJI-CQSZACIVSA-N 1 1 310.869 3.564 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000825247518 1030759702 /nfs/dbraw/zinc/75/97/02/1030759702.db2.gz TUJWJJGJRRTKJI-CQSZACIVSA-N 1 1 310.869 3.564 20 10 DHCDMO COc1cc(C[N@@H+]2CCC[C@H](OC)CC2)c(O)c(C(C)(C)C)c1 ZINC000825490292 1030824938 /nfs/dbraw/zinc/82/49/38/1030824938.db2.gz WEQRMXBBMSBNEK-HNNXBMFYSA-N 1 1 321.461 3.699 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1)c1ccc(F)cc1O ZINC000926915209 1030985584 /nfs/dbraw/zinc/98/55/84/1030985584.db2.gz KGWYDGSZBDONMW-DRCTWCGVSA-N 1 1 321.314 3.682 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1cc(F)cc(F)c1O ZINC000927102295 1031087373 /nfs/dbraw/zinc/08/73/73/1031087373.db2.gz RZXDPYQEQOJBDW-GHMZBOCLSA-N 1 1 313.388 3.915 20 10 DHCDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c(C)c1OC ZINC000927123910 1031105955 /nfs/dbraw/zinc/10/59/55/1031105955.db2.gz DSMWDZXICDIXSS-LBPRGKRZSA-N 1 1 319.376 3.708 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1C[C@H]3[C@@H](C1)C3(F)F)oc1ccccc12 ZINC000844753343 1031312170 /nfs/dbraw/zinc/31/21/70/1031312170.db2.gz VOTBODIYTQEUSZ-OKILXGFUSA-N 1 1 315.319 3.989 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872018536 1031401471 /nfs/dbraw/zinc/40/14/71/1031401471.db2.gz NTIPDORWAINMPN-LBPRGKRZSA-N 1 1 317.364 3.651 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001144298573 1031437247 /nfs/dbraw/zinc/43/72/47/1031437247.db2.gz GVBOGILYMKCBSH-UWVGGRQHSA-N 1 1 314.198 3.526 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ncc(Cl)s2)c2c1c(F)ccc2O ZINC000872114840 1031505235 /nfs/dbraw/zinc/50/52/35/1031505235.db2.gz COPGUYXVUVNQFA-IONNQARKSA-N 1 1 312.797 3.979 20 10 DHCDMO CCC1([NH+](C)C)CC[NH+](Cc2c([O-])ccc3ccccc32)CC1 ZINC000872668318 1031640654 /nfs/dbraw/zinc/64/06/54/1031640654.db2.gz BXDNEYQJZCTNML-UHFFFAOYSA-N 1 1 312.457 3.852 20 10 DHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc(C)cc(C)c3O)C2)n1 ZINC000872807450 1031664949 /nfs/dbraw/zinc/66/49/49/1031664949.db2.gz RFRBTYSRJZQYHO-CQSZACIVSA-N 1 1 302.443 3.763 20 10 DHCDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc(C)cc(C)c3O)C2)n1 ZINC000872807449 1031665108 /nfs/dbraw/zinc/66/51/08/1031665108.db2.gz RFRBTYSRJZQYHO-AWEZNQCLSA-N 1 1 302.443 3.763 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2csc(N(C)C)n2)cc1C ZINC000873068213 1031701146 /nfs/dbraw/zinc/70/11/46/1031701146.db2.gz JIEPPICHCIDXJM-UHFFFAOYSA-N 1 1 319.474 3.596 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@H](CCO)c2ccco2)cc1C ZINC000873105959 1031711899 /nfs/dbraw/zinc/71/18/99/1031711899.db2.gz DWIAQNUOZVMLLN-MRXNPFEDSA-N 1 1 303.402 3.590 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc2ccccc2c1[O-] ZINC000873245632 1031772241 /nfs/dbraw/zinc/77/22/41/1031772241.db2.gz SKNQIWARLSMGDJ-ZBFHGGJFSA-N 1 1 312.457 3.974 20 10 DHCDMO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@](C)(O)c1ccccc1 ZINC000846045925 1031837573 /nfs/dbraw/zinc/83/75/73/1031837573.db2.gz XFYMAOVOKKPXMH-GTNSWQLSSA-N 1 1 323.795 3.571 20 10 DHCDMO COc1cccc([C@H](C)NCCC[N@H+](C)C2CCCCC2)c1O ZINC000846135521 1031900968 /nfs/dbraw/zinc/90/09/68/1031900968.db2.gz DPMMAVPRAUFLGW-HNNXBMFYSA-N 1 1 320.477 3.706 20 10 DHCDMO COc1cccc([C@H](C)NCCC[N@@H+](C)C2CCCCC2)c1O ZINC000846135521 1031900976 /nfs/dbraw/zinc/90/09/76/1031900976.db2.gz DPMMAVPRAUFLGW-HNNXBMFYSA-N 1 1 320.477 3.706 20 10 DHCDMO COc1cc(C[N@@H+]2Cc3cccc(O)c3C2)ccc1SC ZINC000877703577 1033418300 /nfs/dbraw/zinc/41/83/00/1033418300.db2.gz PJFBEGJADMXMDS-UHFFFAOYSA-N 1 1 301.411 3.639 20 10 DHCDMO COc1cc(C[N@H+]2Cc3cccc(O)c3C2)ccc1SC ZINC000877703577 1033418308 /nfs/dbraw/zinc/41/83/08/1033418308.db2.gz PJFBEGJADMXMDS-UHFFFAOYSA-N 1 1 301.411 3.639 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000877755966 1033435674 /nfs/dbraw/zinc/43/56/74/1033435674.db2.gz UZWNTZWZAQVWAO-ZHALLVOQSA-N 1 1 324.468 3.953 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)c1 ZINC000877814193 1033467570 /nfs/dbraw/zinc/46/75/70/1033467570.db2.gz VSQULXCNRURIEA-ZDUSSCGKSA-N 1 1 318.442 3.545 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CC[C@H](C(F)(F)F)O1 ZINC000877823519 1033473916 /nfs/dbraw/zinc/47/39/16/1033473916.db2.gz MCKZFXXIVOMUBJ-NOZJJQNGSA-N 1 1 323.742 3.587 20 10 DHCDMO CC[C@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nccs1 ZINC000152647740 1033536051 /nfs/dbraw/zinc/53/60/51/1033536051.db2.gz VJVFSHWXDYHTSJ-INIZCTEOSA-N 1 1 307.438 3.763 20 10 DHCDMO C[C@@H]1C[N@H+](Cc2cc(F)c(N(C)C)cc2F)CCC1(F)F ZINC000862370421 1033834658 /nfs/dbraw/zinc/83/46/58/1033834658.db2.gz LLHWKHATNYONIX-SNVBAGLBSA-N 1 1 304.331 3.508 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CCC1(F)F ZINC000862370421 1033834669 /nfs/dbraw/zinc/83/46/69/1033834669.db2.gz LLHWKHATNYONIX-SNVBAGLBSA-N 1 1 304.331 3.508 20 10 DHCDMO COc1ccc(O)c(C[NH2+][C@@H](CCc2ccccc2)C(F)F)c1 ZINC000862482467 1033867441 /nfs/dbraw/zinc/86/74/41/1033867441.db2.gz ISGANICBOPOMNM-INIZCTEOSA-N 1 1 321.367 3.757 20 10 DHCDMO CCn1nc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)c1C ZINC000879118620 1033928485 /nfs/dbraw/zinc/92/84/85/1033928485.db2.gz HXMPYNCBVMHOAU-UHFFFAOYSA-N 1 1 314.477 3.526 20 10 DHCDMO Cc1n[nH]cc1C[N@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC000879188928 1033946920 /nfs/dbraw/zinc/94/69/20/1033946920.db2.gz SYJIFOKIXGYPON-UHFFFAOYSA-N 1 1 312.461 3.649 20 10 DHCDMO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)CC1(C)COC1 ZINC000863299742 1034060061 /nfs/dbraw/zinc/06/00/61/1034060061.db2.gz SSIKOTFUHQQDQY-UHFFFAOYSA-N 1 1 311.381 3.760 20 10 DHCDMO C[N@@H+](Cc1cc2oc3ccccc3c2cc1O)CC1(C)COC1 ZINC000863299742 1034060078 /nfs/dbraw/zinc/06/00/78/1034060078.db2.gz SSIKOTFUHQQDQY-UHFFFAOYSA-N 1 1 311.381 3.760 20 10 DHCDMO Cc1cc(-c2nnc(C[NH2+][C@@H](C)c3ccccc3O)o2)c(C)o1 ZINC000879652339 1034074781 /nfs/dbraw/zinc/07/47/81/1034074781.db2.gz YDOMAWSYQOYDJA-NSHDSACASA-N 1 1 313.357 3.503 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@H](C)[C@H]3C)cc2)CC1 ZINC000842163107 1034221036 /nfs/dbraw/zinc/22/10/36/1034221036.db2.gz JZXSWYSVEPEGLB-YESZJQIVSA-N 1 1 316.489 3.778 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2)cc1OC ZINC000179433680 1034309285 /nfs/dbraw/zinc/30/92/85/1034309285.db2.gz SINLIJZXPYDZMX-ZDUSSCGKSA-N 1 1 301.386 3.602 20 10 DHCDMO CC(C)[C@H](CO)[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)C(C)C ZINC001202513128 1034317917 /nfs/dbraw/zinc/31/79/17/1034317917.db2.gz JPRPPTMMKRRKFQ-LRDDRELGSA-N 1 1 317.832 3.563 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@](C)(O)CC2)c(O)c(C(C)(C)C)c1 ZINC000794671382 1034323370 /nfs/dbraw/zinc/32/33/70/1034323370.db2.gz GFDDCZPADPBUIC-IBGZPJMESA-N 1 1 305.462 3.735 20 10 DHCDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000179664522 1034325385 /nfs/dbraw/zinc/32/53/85/1034325385.db2.gz PUWWYCZSRGCOEE-ZDUSSCGKSA-N 1 1 301.386 3.602 20 10 DHCDMO Cc1csc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC001137157222 1034377915 /nfs/dbraw/zinc/37/79/15/1034377915.db2.gz PRXPKUJNWIDPFA-UHFFFAOYSA-N 1 1 316.470 3.525 20 10 DHCDMO CC[N@@H+](Cc1cccc(OC)c1O)[C@H](C)c1cccc(OC)c1 ZINC000120158821 1034399356 /nfs/dbraw/zinc/39/93/56/1034399356.db2.gz QPFBKZAMUSEUPX-CQSZACIVSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)ccc1[O-] ZINC000184936614 1034513303 /nfs/dbraw/zinc/51/33/03/1034513303.db2.gz ZSESGQIBEYHDAQ-ZDUSSCGKSA-N 1 1 318.848 3.958 20 10 DHCDMO CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2[O-])C1 ZINC000185059981 1034525382 /nfs/dbraw/zinc/52/53/82/1034525382.db2.gz FUKVYYGBNQWMTE-WDEREUQCSA-N 1 1 317.260 3.691 20 10 DHCDMO Cc1csc(CCCC[NH2+][C@H](C)c2ccc(F)cc2O)n1 ZINC000185318817 1034541085 /nfs/dbraw/zinc/54/10/85/1034541085.db2.gz QDXFHBZBNUIQHW-GFCCVEGCSA-N 1 1 308.422 3.970 20 10 DHCDMO CCOc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2O)ccc1OC ZINC000185452675 1034548997 /nfs/dbraw/zinc/54/89/97/1034548997.db2.gz NJVZPINIOYLVFU-LBPRGKRZSA-N 1 1 319.376 3.789 20 10 DHCDMO CCN(C)c1ccc(CN2CC[N@@H+](C3CCCC3)[C@H](C)C2)cc1 ZINC001176154548 1035219864 /nfs/dbraw/zinc/21/98/64/1035219864.db2.gz PQFFMVGXNXKAMO-QGZVFWFLSA-N 1 1 315.505 3.591 20 10 DHCDMO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001176916109 1035339161 /nfs/dbraw/zinc/33/91/61/1035339161.db2.gz SYRWGEOIHSGVPI-RBUKOAKNSA-N 1 1 302.462 3.595 20 10 DHCDMO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001176916110 1035339249 /nfs/dbraw/zinc/33/92/49/1035339249.db2.gz SYRWGEOIHSGVPI-RTBURBONSA-N 1 1 302.462 3.595 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](c3ccnc(C)n3)C2)cc1 ZINC000773746590 1035432190 /nfs/dbraw/zinc/43/21/90/1035432190.db2.gz MBKXBOGYLLCMHX-GOSISDBHSA-N 1 1 324.472 3.621 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)cc1 ZINC000773755875 1035438930 /nfs/dbraw/zinc/43/89/30/1035438930.db2.gz RSYMOSRYRMUGBA-LJQANCHMSA-N 1 1 302.462 3.535 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)CCc2ncc(C)s2)cc1 ZINC000773790407 1035462910 /nfs/dbraw/zinc/46/29/10/1035462910.db2.gz JEVVGZGOUGBXFK-UHFFFAOYSA-N 1 1 303.475 3.582 20 10 DHCDMO COc1ccc(CN[C@H]2CC[N@H+](C3CCCCC3)C2)cc1C ZINC001179193962 1035470361 /nfs/dbraw/zinc/47/03/61/1035470361.db2.gz OQEBSBPIYUUPQH-KRWDZBQOSA-N 1 1 302.462 3.500 20 10 DHCDMO COc1ccc(C[NH2+][C@H]2CCN(C3CCCCC3)C2)cc1C ZINC001179193962 1035470365 /nfs/dbraw/zinc/47/03/65/1035470365.db2.gz OQEBSBPIYUUPQH-KRWDZBQOSA-N 1 1 302.462 3.500 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCOC12CCCCC2 ZINC001179715906 1035494678 /nfs/dbraw/zinc/49/46/78/1035494678.db2.gz CRRPOZUUGFLUKS-CQSZACIVSA-N 1 1 313.800 3.766 20 10 DHCDMO CCC[C@H](C)[N@@H+](C)Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC001180275085 1035626797 /nfs/dbraw/zinc/62/67/97/1035626797.db2.gz GDBSHRAVJKEFLQ-LBPRGKRZSA-N 1 1 320.408 3.724 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](N3CCCC3)C2)c1 ZINC001180249302 1035630628 /nfs/dbraw/zinc/63/06/28/1035630628.db2.gz HSXLLITXFNBGAW-GOSISDBHSA-N 1 1 302.462 3.576 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@H](N3CCCC3)C2)c1 ZINC001180249302 1035630635 /nfs/dbraw/zinc/63/06/35/1035630635.db2.gz HSXLLITXFNBGAW-GOSISDBHSA-N 1 1 302.462 3.576 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccnn2C)cc1C(C)C ZINC000905739813 1035636503 /nfs/dbraw/zinc/63/65/03/1035636503.db2.gz JBFNPXLEXKFGRF-SFHVURJKSA-N 1 1 313.445 3.895 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c(O)c1 ZINC001180524520 1035697602 /nfs/dbraw/zinc/69/76/02/1035697602.db2.gz YHFRYIXDJCMTEP-QGZVFWFLSA-N 1 1 311.425 3.916 20 10 DHCDMO CCC1CCC([N@@H+](CCO)Cc2ccc(N(C)C)cc2)CC1 ZINC001194066398 1035822676 /nfs/dbraw/zinc/82/26/76/1035822676.db2.gz JNBOCEGOVLZIPD-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO CC(C)[C@@H](CCO)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774210898 1036227844 /nfs/dbraw/zinc/22/78/44/1036227844.db2.gz HRZSLRCFDBPGRF-NOZJJQNGSA-N 1 1 306.233 3.757 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207491 1036230227 /nfs/dbraw/zinc/23/02/27/1036230227.db2.gz VUYBQELILONETQ-VWYCJHECSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)c(Cl)cc1[O-] ZINC000774207491 1036230237 /nfs/dbraw/zinc/23/02/37/1036230237.db2.gz VUYBQELILONETQ-VWYCJHECSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@@H]([NH2+]CCN1CC[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774212093 1036231440 /nfs/dbraw/zinc/23/14/40/1036231440.db2.gz YGVOZKBSYWWALZ-WDEREUQCSA-N 1 1 317.260 3.691 20 10 DHCDMO C[C@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000774211543 1036231775 /nfs/dbraw/zinc/23/17/75/1036231775.db2.gz UELDVFKILQVOSA-QWRGUYRKSA-N 1 1 317.260 3.834 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@H]2CCCN(Cc3ccccc3)C2)c1O ZINC000775655840 1036253663 /nfs/dbraw/zinc/25/36/63/1036253663.db2.gz LPPGPORYTZXISE-FQEVSTJZSA-N 1 1 324.468 3.797 20 10 DHCDMO C[C@H](CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[S@@](C)=O ZINC000774259039 1036264420 /nfs/dbraw/zinc/26/44/20/1036264420.db2.gz WGPDWBMSDVBHTI-BLBZPCKPSA-N 1 1 324.273 3.507 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658754 1036268249 /nfs/dbraw/zinc/26/82/49/1036268249.db2.gz PZXLBKVNTOTDCG-IJEWVQPXSA-N 1 1 322.880 3.883 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658754 1036268260 /nfs/dbraw/zinc/26/82/60/1036268260.db2.gz PZXLBKVNTOTDCG-IJEWVQPXSA-N 1 1 322.880 3.883 20 10 DHCDMO COc1ccc(N(C)CC[N@@H+](C)Cc2csc(C)c2)cc1 ZINC001195790680 1036348115 /nfs/dbraw/zinc/34/81/15/1036348115.db2.gz VIJUWOQHKWQCRO-UHFFFAOYSA-N 1 1 304.459 3.633 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2C2CCC2)c1O ZINC001195825263 1036362379 /nfs/dbraw/zinc/36/23/79/1036362379.db2.gz FERBSCJUMGNIAD-QGZVFWFLSA-N 1 1 305.393 3.889 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2C2CCC2)c1O ZINC001195825263 1036362399 /nfs/dbraw/zinc/36/23/99/1036362399.db2.gz FERBSCJUMGNIAD-QGZVFWFLSA-N 1 1 305.393 3.889 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c1 ZINC000775681871 1036413237 /nfs/dbraw/zinc/41/32/37/1036413237.db2.gz ULHUJGDGRPTZJZ-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CC3(CC=CC3)[C@H]2C(C)C)c1O ZINC001182694670 1036428327 /nfs/dbraw/zinc/42/83/27/1036428327.db2.gz XHOBTTTYTVOQLT-GOSISDBHSA-N 1 1 301.430 3.886 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182968714 1036491054 /nfs/dbraw/zinc/49/10/54/1036491054.db2.gz DWPXPQLQMHVDQX-YVEFUNNKSA-N 1 1 313.388 3.760 20 10 DHCDMO Cc1cccc2c1C[N@@H+](Cc1c(O)ccc3ccncc31)CC2 ZINC000762086934 1036516713 /nfs/dbraw/zinc/51/67/13/1036516713.db2.gz KILWGJHXUYMKAL-UHFFFAOYSA-N 1 1 304.393 3.807 20 10 DHCDMO CCc1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)CN(C)C)c1O ZINC001183065919 1036517282 /nfs/dbraw/zinc/51/72/82/1036517282.db2.gz ROOGWVNLMYNYPT-MAUKXSAKSA-N 1 1 304.478 3.507 20 10 DHCDMO CCc1cccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)CN(C)C)c1O ZINC001183065919 1036517293 /nfs/dbraw/zinc/51/72/93/1036517293.db2.gz ROOGWVNLMYNYPT-MAUKXSAKSA-N 1 1 304.478 3.507 20 10 DHCDMO CCN1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715930 1036534247 /nfs/dbraw/zinc/53/42/47/1036534247.db2.gz MIHRYYSLKIBPLM-CZUORRHYSA-N 1 1 310.869 3.659 20 10 DHCDMO CCN1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715930 1036534255 /nfs/dbraw/zinc/53/42/55/1036534255.db2.gz MIHRYYSLKIBPLM-CZUORRHYSA-N 1 1 310.869 3.659 20 10 DHCDMO COc1cccc([C@H]2CSCC[N@H+]2Cc2ccccc2O)c1 ZINC001203561123 1036550681 /nfs/dbraw/zinc/55/06/81/1036550681.db2.gz LSRJESSQWUQXAB-QGZVFWFLSA-N 1 1 315.438 3.691 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+](C)Cc2cc(Cl)cn2C)c1O ZINC000775736958 1036585986 /nfs/dbraw/zinc/58/59/86/1036585986.db2.gz IDNYHZQCRZGXOS-UHFFFAOYSA-N 1 1 313.228 3.978 20 10 DHCDMO CCC[N@@H+](CCOC1CCSCC1)Cc1ccccc1O ZINC000929752401 1036637748 /nfs/dbraw/zinc/63/77/48/1036637748.db2.gz ACUVLXPUCZLPDK-UHFFFAOYSA-N 1 1 309.475 3.516 20 10 DHCDMO CSc1ccccc1C[C@H](C)[NH2+]Cc1c(O)cccc1F ZINC001183919990 1036711003 /nfs/dbraw/zinc/71/10/03/1036711003.db2.gz RYELMRFUZJQRIY-LBPRGKRZSA-N 1 1 305.418 3.974 20 10 DHCDMO COc1c(O)c(C[N@@H+]2CCC[C@@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000774904878 1037194879 /nfs/dbraw/zinc/19/48/79/1037194879.db2.gz WVLWNEMOJRRSFL-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1c(O)c(C[N@H+]2CCC[C@@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000774904878 1037194887 /nfs/dbraw/zinc/19/48/87/1037194887.db2.gz WVLWNEMOJRRSFL-ZDUSSCGKSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)Cc2cccc(Cl)c2)c1O ZINC000915825721 1037239725 /nfs/dbraw/zinc/23/97/25/1037239725.db2.gz IUEULUCSEUCDJY-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1c(O)c(C[NH2+]C(C)(C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000774960580 1037283896 /nfs/dbraw/zinc/28/38/96/1037283896.db2.gz CAKOTHNQIRKDMU-UHFFFAOYSA-N 1 1 310.394 3.613 20 10 DHCDMO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000775991789 1037286346 /nfs/dbraw/zinc/28/63/46/1037286346.db2.gz KIQUVEMQPPUTCD-CQSZACIVSA-N 1 1 304.415 3.503 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000775991789 1037286360 /nfs/dbraw/zinc/28/63/60/1037286360.db2.gz KIQUVEMQPPUTCD-CQSZACIVSA-N 1 1 304.415 3.503 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000776015666 1037310254 /nfs/dbraw/zinc/31/02/54/1037310254.db2.gz XBHMRFYVJSAFRX-PWSUYJOCSA-N 1 1 303.324 3.564 20 10 DHCDMO CCC1(CC)CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000775081906 1037560859 /nfs/dbraw/zinc/56/08/59/1037560859.db2.gz PCAVSHPZDLRZEV-UHFFFAOYSA-N 1 1 322.405 3.711 20 10 DHCDMO COc1cccc(CC[N@@H+](C)Cc2cc(Cl)ccc2O)c1 ZINC001203664171 1037646388 /nfs/dbraw/zinc/64/63/88/1037646388.db2.gz PQCIALQFHPYXAT-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)Cc2cc(C)ccc2F)c1O ZINC000775168696 1037913731 /nfs/dbraw/zinc/91/37/31/1037913731.db2.gz QPNBTCYOYLUEEC-UHFFFAOYSA-N 1 1 303.377 3.870 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCCC[C@@H]1O ZINC001190436887 1038315309 /nfs/dbraw/zinc/31/53/09/1038315309.db2.gz NIQOAEUWZRVWCP-MJGOQNOKSA-N 1 1 304.478 3.514 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@@H]2CCCN(c3ccccc3)C2)cc1 ZINC001191415989 1038501087 /nfs/dbraw/zinc/50/10/87/1038501087.db2.gz DIHAZYBSLHSWDB-OAQYLSRUSA-N 1 1 323.484 3.853 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487047 1038551994 /nfs/dbraw/zinc/55/19/94/1038551994.db2.gz GYLJACKXCOJFIO-LZWOXQAQSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC000775487047 1038552002 /nfs/dbraw/zinc/55/20/02/1038552002.db2.gz GYLJACKXCOJFIO-LZWOXQAQSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493283 1038569974 /nfs/dbraw/zinc/56/99/74/1038569974.db2.gz WXICDCCGKNTXIR-WBMJQRKESA-N 1 1 308.853 3.571 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1[O-] ZINC000775493283 1038569979 /nfs/dbraw/zinc/56/99/79/1038569979.db2.gz WXICDCCGKNTXIR-WBMJQRKESA-N 1 1 308.853 3.571 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@H](O)c1cc(F)ccc1F ZINC000170779213 1038958589 /nfs/dbraw/zinc/95/85/89/1038958589.db2.gz CSFWUOAQZMSFHY-SFHVURJKSA-N 1 1 321.367 3.616 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCc3ccc(F)cc3C2)c1O ZINC000761200520 1040578839 /nfs/dbraw/zinc/57/88/39/1040578839.db2.gz VFURBFZAVAPMBT-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3ccc(F)cc3C2)c1O ZINC000761200520 1040578846 /nfs/dbraw/zinc/57/88/46/1040578846.db2.gz VFURBFZAVAPMBT-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000273300314 130105461 /nfs/dbraw/zinc/10/54/61/130105461.db2.gz BEXJUCSDLSBIPL-YVEFUNNKSA-N 1 1 311.381 3.517 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc([S@](C)=O)cc1 ZINC000273481200 130126070 /nfs/dbraw/zinc/12/60/70/130126070.db2.gz MBKJQYSMPFBLEI-IBILFNBTSA-N 1 1 321.417 3.681 20 10 DHCDMO COCC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc(C)o1 ZINC000273478309 130126672 /nfs/dbraw/zinc/12/66/72/130126672.db2.gz TZDSSGKSFYJQQY-WFASDCNBSA-N 1 1 307.365 3.861 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273491839 130127422 /nfs/dbraw/zinc/12/74/22/130127422.db2.gz NKXPKYACSRHRPX-PKOBYXMFSA-N 1 1 315.388 3.883 20 10 DHCDMO Cc1ccc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(O)c1C ZINC000273533110 130133179 /nfs/dbraw/zinc/13/31/79/130133179.db2.gz WSZZNOWUSNEFIJ-HNNXBMFYSA-N 1 1 304.478 3.923 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(OC)cc1OC)c1ccc(F)cc1O ZINC000285904392 131208702 /nfs/dbraw/zinc/20/87/02/131208702.db2.gz CXRINKZJEZRKNM-INIZCTEOSA-N 1 1 319.376 3.789 20 10 DHCDMO CCc1nn(C)c(CC)c1C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000285942520 131210875 /nfs/dbraw/zinc/21/08/75/131210875.db2.gz DNAOTEOGAJAWTO-OAHLLOKOSA-N 1 1 319.424 3.631 20 10 DHCDMO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1O ZINC000285986889 131214342 /nfs/dbraw/zinc/21/43/42/131214342.db2.gz HWWVAPKCJWFLPP-GJZGRUSLSA-N 1 1 307.365 3.861 20 10 DHCDMO C[C@@H]([NH2+][C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1O ZINC000286892145 131253889 /nfs/dbraw/zinc/25/38/89/131253889.db2.gz DCSJTRCCGVPGKL-SJKOYZFVSA-N 1 1 320.383 3.624 20 10 DHCDMO CC[C@H]([NH2+]Cc1cc(F)ccc1OC)c1ccc(F)cc1O ZINC000287357887 131276163 /nfs/dbraw/zinc/27/61/63/131276163.db2.gz HEJNPNZGRHLVGY-HNNXBMFYSA-N 1 1 307.340 3.920 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1O ZINC000294031542 335116961 /nfs/dbraw/zinc/11/69/61/335116961.db2.gz VQURTXYLTXLISG-SFHVURJKSA-N 1 1 312.413 3.769 20 10 DHCDMO C[C@H](CC[S@@](C)=O)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278799734 334101536 /nfs/dbraw/zinc/10/15/36/334101536.db2.gz RBPLPGYBBUURGW-IXGDSRDXSA-N 1 1 324.273 3.507 20 10 DHCDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(F)cc1O ZINC000373254633 336954409 /nfs/dbraw/zinc/95/44/09/336954409.db2.gz FVNDDAKOILGUJS-ZBQZNYHESA-N 1 1 315.388 3.960 20 10 DHCDMO Oc1c(F)cccc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000378502288 337074596 /nfs/dbraw/zinc/07/45/96/337074596.db2.gz VWWIZACJYSEYMR-UHFFFAOYSA-N 1 1 318.367 3.747 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCC[C@@H]1n1cccn1)c1ccc(F)cc1O ZINC000185627885 337249737 /nfs/dbraw/zinc/24/97/37/337249737.db2.gz XUNUIWRNLPQUFI-RCBQFDQVSA-N 1 1 303.381 3.562 20 10 DHCDMO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccccc1O ZINC000186061742 337253281 /nfs/dbraw/zinc/25/32/81/337253281.db2.gz MIIUNIFUBPZXSW-CQSZACIVSA-N 1 1 305.381 3.700 20 10 DHCDMO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)cs1 ZINC000189933548 337283988 /nfs/dbraw/zinc/28/39/88/337283988.db2.gz WWKTXJYUNULUIH-QGZVFWFLSA-N 1 1 301.459 3.855 20 10 DHCDMO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)cc2)cs1 ZINC000189933548 337283989 /nfs/dbraw/zinc/28/39/89/337283989.db2.gz WWKTXJYUNULUIH-QGZVFWFLSA-N 1 1 301.459 3.855 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2ccsc2)cc1OC ZINC000159840994 522771545 /nfs/dbraw/zinc/77/15/45/522771545.db2.gz MQZDMPUEMJFHBL-AWEZNQCLSA-N 1 1 319.426 3.808 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2cccs2)cc1OC ZINC000159874946 522773586 /nfs/dbraw/zinc/77/35/86/522773586.db2.gz UGPPFWLXQYWFJR-LLVKDONJSA-N 1 1 307.415 3.664 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1C ZINC000128445690 525320827 /nfs/dbraw/zinc/32/08/27/525320827.db2.gz CQSCORPXTWXLNO-MRXNPFEDSA-N 1 1 303.427 3.644 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127478518 526342458 /nfs/dbraw/zinc/34/24/58/526342458.db2.gz WYLKWZUBPGNXDQ-CQSZACIVSA-N 1 1 321.218 3.820 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2CC(C)(C)CO2)C2CC2)cc1 ZINC001167107660 1013148084 /nfs/dbraw/zinc/14/80/84/1013148084.db2.gz FVCQIRQSULOTMZ-GOSISDBHSA-N 1 1 302.462 3.532 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000894698243 1013460900 /nfs/dbraw/zinc/46/09/00/1013460900.db2.gz QUHVZLMNFNIDNG-UHFFFAOYSA-N 1 1 309.278 3.835 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278347333 1018595472 /nfs/dbraw/zinc/59/54/72/1018595472.db2.gz YPMLDMGKNHNRPJ-UWVGGRQHSA-N 1 1 304.217 3.776 20 10 DHCDMO COC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccco1 ZINC000177576411 1013741686 /nfs/dbraw/zinc/74/16/86/1013741686.db2.gz HUICLKBYQZANJM-SFHVURJKSA-N 1 1 314.429 3.747 20 10 DHCDMO c1cc2c(nc[nH+]c2NCc2ccc(N3CCCCC3)cc2)[nH]1 ZINC000726967045 1013900180 /nfs/dbraw/zinc/90/01/80/1013900180.db2.gz JGVBAXXYSBMXMZ-UHFFFAOYSA-N 1 1 307.401 3.560 20 10 DHCDMO Cc1ccc(C[NH2+]Cc2cccc(Br)c2O)s1 ZINC000050225432 1014132693 /nfs/dbraw/zinc/13/26/93/1014132693.db2.gz VZVIJUGTBIGOIX-UHFFFAOYSA-N 1 1 312.232 3.814 20 10 DHCDMO COc1ccc(C[N@H+]2CCCC[C@@H]2C2CCC2)c(O)c1OC ZINC000895126145 1014485187 /nfs/dbraw/zinc/48/51/87/1014485187.db2.gz VOUGFADGCSCYBW-OAHLLOKOSA-N 1 1 305.418 3.564 20 10 DHCDMO C[N@@H+](CC[C@@H]1CCOC1)Cc1ccc(N2CCCCC2)cc1 ZINC000783498981 1014542382 /nfs/dbraw/zinc/54/23/82/1014542382.db2.gz ZDNYRMIZPWZDST-GOSISDBHSA-N 1 1 302.462 3.535 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)O1)c1cc(Cl)c(Cl)cc1O ZINC000834916020 1015056982 /nfs/dbraw/zinc/05/69/82/1015056982.db2.gz XAGSGSNAOIJCOR-BBBLOLIVSA-N 1 1 304.217 3.917 20 10 DHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)CC)cc2)C1(C)C ZINC001167474150 1015057060 /nfs/dbraw/zinc/05/70/60/1015057060.db2.gz PYYOFLGPJOKZQR-ROUUACIJSA-N 1 1 304.478 3.778 20 10 DHCDMO Cc1nc(C2([NH2+]Cc3cc(C)cc(C)c3O)CCCCC2)no1 ZINC000754727144 1015119472 /nfs/dbraw/zinc/11/94/72/1015119472.db2.gz PZTMLTMOMXXAEG-UHFFFAOYSA-N 1 1 315.417 3.650 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2cccnc2Cl)C2CC2)cc1 ZINC000729542751 1015199397 /nfs/dbraw/zinc/19/93/97/1015199397.db2.gz RQPRENJGTOQETC-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccnc2Cl)C2CC2)cc1 ZINC000729542751 1015199402 /nfs/dbraw/zinc/19/94/02/1015199402.db2.gz RQPRENJGTOQETC-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO COc1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1OC ZINC000891499142 1015327673 /nfs/dbraw/zinc/32/76/73/1015327673.db2.gz NGGOVKXBDYKTGI-ZDUSSCGKSA-N 1 1 313.397 3.529 20 10 DHCDMO COc1ccc(C[N@@H+](Cc2cccs2)C2CC2)c(O)c1OC ZINC000891600097 1015441771 /nfs/dbraw/zinc/44/17/71/1015441771.db2.gz QMVHOMAWFZJUAP-UHFFFAOYSA-N 1 1 319.426 3.636 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001140464476 1015509495 /nfs/dbraw/zinc/50/94/95/1015509495.db2.gz RCCYFTUZZYMVDY-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO Cc1ccc(C[NH2+]Cc2cccc(Br)c2O)cc1F ZINC000101590138 1015506432 /nfs/dbraw/zinc/50/64/32/1015506432.db2.gz SVWFBADCWYXHBA-UHFFFAOYSA-N 1 1 324.193 3.892 20 10 DHCDMO CCc1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)c1O ZINC000896422359 1015580683 /nfs/dbraw/zinc/58/06/83/1015580683.db2.gz AUAQSAWAUNZTNG-NVXWUHKLSA-N 1 1 301.361 3.516 20 10 DHCDMO C[C@H](CCc1n[nH]c2ccccc21)[NH2+]Cc1c(O)cccc1F ZINC000896637914 1015693730 /nfs/dbraw/zinc/69/37/30/1015693730.db2.gz RHKMJHOBFFYIRH-GFCCVEGCSA-N 1 1 313.376 3.519 20 10 DHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)[nH]1 ZINC000276848001 1015710630 /nfs/dbraw/zinc/71/06/30/1015710630.db2.gz CUVUMDKSJRKLQV-MJBXVCDLSA-N 1 1 315.465 3.796 20 10 DHCDMO CC[N@H+](Cc1ccccc1O)Cc1c(F)c(F)ccc1OC ZINC001143413425 1015732217 /nfs/dbraw/zinc/73/22/17/1015732217.db2.gz QIECHQPPWZTCJP-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1c(F)c(F)ccc1OC ZINC001143413425 1015732221 /nfs/dbraw/zinc/73/22/21/1015732221.db2.gz QIECHQPPWZTCJP-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000294743734 1032136909 /nfs/dbraw/zinc/13/69/09/1032136909.db2.gz QYSXQFINYJWPTQ-INIZCTEOSA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(Br)c1O)c1cccc(O)c1 ZINC000048797094 1016758490 /nfs/dbraw/zinc/75/84/90/1016758490.db2.gz HLZUMCYZUGDPRP-SNVBAGLBSA-N 1 1 322.202 3.711 20 10 DHCDMO COc1ccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185578465 1017029762 /nfs/dbraw/zinc/02/97/62/1017029762.db2.gz CSLDRWDAXUESRZ-STQMWFEESA-N 1 1 319.376 3.658 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccn(C)n1 ZINC000840815273 1017078406 /nfs/dbraw/zinc/07/84/06/1017078406.db2.gz DHUMPUXLMKEEQY-IUCAKERBSA-N 1 1 314.216 3.844 20 10 DHCDMO C[N@@H+](CCC(C)(C)C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877605358 1033378300 /nfs/dbraw/zinc/37/83/00/1033378300.db2.gz BMGBKOBZLMVKRK-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@@H]1CCc2nc(C[N@H+](C)Cc3ccccc3O)sc2C1 ZINC000091956818 1012348984 /nfs/dbraw/zinc/34/89/84/1012348984.db2.gz JHSPZYFMXKHKLY-GFCCVEGCSA-N 1 1 302.443 3.606 20 10 DHCDMO C[C@@H]1CCc2nc(C[N@@H+](C)Cc3ccccc3O)sc2C1 ZINC000091956818 1012348999 /nfs/dbraw/zinc/34/89/99/1012348999.db2.gz JHSPZYFMXKHKLY-GFCCVEGCSA-N 1 1 302.443 3.606 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C(C)C)C3)cc2)CC1 ZINC000828030181 1012374416 /nfs/dbraw/zinc/37/44/16/1012374416.db2.gz BOHCNOPRLWGDSB-SFHVURJKSA-N 1 1 316.489 3.780 20 10 DHCDMO Oc1cc2c(cc1O)C[N@H+](Cc1ccccc1Cl)CCC2 ZINC001203385451 1012412458 /nfs/dbraw/zinc/41/24/58/1012412458.db2.gz PLKOXWXXHYNYJM-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO Oc1cc2c(cc1O)C[N@@H+](Cc1ccccc1Cl)CCC2 ZINC001203385451 1012412466 /nfs/dbraw/zinc/41/24/66/1012412466.db2.gz PLKOXWXXHYNYJM-UHFFFAOYSA-N 1 1 303.789 3.700 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CCC[C@H]1C[NH3+] ZINC001205983212 1032639533 /nfs/dbraw/zinc/63/95/33/1032639533.db2.gz OJHLLEVWQDZKBR-MNOVXSKESA-N 1 1 317.260 3.506 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2c(O)cc(C)cc2Cl)s1 ZINC000840917927 1017479058 /nfs/dbraw/zinc/47/90/58/1017479058.db2.gz YRGRTVQAJMIRCX-UHFFFAOYSA-N 1 1 310.850 3.793 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)on1 ZINC000125515823 1032709375 /nfs/dbraw/zinc/70/93/75/1032709375.db2.gz ZSFXLEFBCQMNGS-CQSZACIVSA-N 1 1 317.408 3.963 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1c(O)cccc1F ZINC000926914329 1032715316 /nfs/dbraw/zinc/71/53/16/1032715316.db2.gz HPUYBXLJOKJBTN-KWBADKCTSA-N 1 1 321.314 3.682 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NCCC[NH+]2CCCCC2)cc1 ZINC000764661079 1018339888 /nfs/dbraw/zinc/33/98/88/1018339888.db2.gz BFXTXUYNWYJECN-KRWDZBQOSA-N 1 1 303.494 3.669 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000764661079 1018339897 /nfs/dbraw/zinc/33/98/97/1018339897.db2.gz BFXTXUYNWYJECN-KRWDZBQOSA-N 1 1 303.494 3.669 20 10 DHCDMO CC(C)N(C)CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774162618 1018340849 /nfs/dbraw/zinc/34/08/49/1018340849.db2.gz QMXFQKLPXKXSMW-SNVBAGLBSA-N 1 1 305.249 3.690 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccc(F)cc1O ZINC000926918956 1032767572 /nfs/dbraw/zinc/76/75/72/1032767572.db2.gz KMVSBAZAVPBOJS-NEPJUHHUSA-N 1 1 301.361 3.706 20 10 DHCDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c(O)ccc3ccncc32)n1 ZINC000765107674 1018477099 /nfs/dbraw/zinc/47/70/99/1018477099.db2.gz XYPUTXDSIKGHAD-IBGZPJMESA-N 1 1 319.408 3.981 20 10 DHCDMO Cc1cc([O-])c(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1Cl ZINC000825762308 1032784568 /nfs/dbraw/zinc/78/45/68/1032784568.db2.gz IFHMCWCJGCPMQA-UHFFFAOYSA-N 1 1 322.880 3.662 20 10 DHCDMO Cc1cc([O-])c(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1Cl ZINC000825762308 1032784583 /nfs/dbraw/zinc/78/45/83/1032784583.db2.gz IFHMCWCJGCPMQA-UHFFFAOYSA-N 1 1 322.880 3.662 20 10 DHCDMO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(O)cccc1F ZINC001137839827 1018767382 /nfs/dbraw/zinc/76/73/82/1018767382.db2.gz LNUBAGRXLKSAJV-ZDUSSCGKSA-N 1 1 303.377 3.603 20 10 DHCDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1c(O)cccc1F ZINC001137839827 1018767398 /nfs/dbraw/zinc/76/73/98/1018767398.db2.gz LNUBAGRXLKSAJV-ZDUSSCGKSA-N 1 1 303.377 3.603 20 10 DHCDMO COc1cccc(C[N@@H+]2CCc3sc(Cl)cc3C2)c1O ZINC000843416105 1018861396 /nfs/dbraw/zinc/86/13/96/1018861396.db2.gz ONFJRVSAMKDUIX-UHFFFAOYSA-N 1 1 309.818 3.674 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3sc(Cl)cc3C2)c1O ZINC000843416105 1018861403 /nfs/dbraw/zinc/86/14/03/1018861403.db2.gz ONFJRVSAMKDUIX-UHFFFAOYSA-N 1 1 309.818 3.674 20 10 DHCDMO CC[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715703687 1018941360 /nfs/dbraw/zinc/94/13/60/1018941360.db2.gz RMGAXEVNYARXRP-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000715703687 1018941368 /nfs/dbraw/zinc/94/13/68/1018941368.db2.gz RMGAXEVNYARXRP-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000840872730 1018997702 /nfs/dbraw/zinc/99/77/02/1018997702.db2.gz NLLRZOFDJWJLAI-NOOOWODRSA-N 1 1 317.351 3.875 20 10 DHCDMO C[C@H]([NH2+]CC1(C)OCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000278730943 1019104902 /nfs/dbraw/zinc/10/49/02/1019104902.db2.gz MTZBBBMPUVBBKB-VIFPVBQESA-N 1 1 320.216 3.503 20 10 DHCDMO COc1cc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825773971 1032809709 /nfs/dbraw/zinc/80/97/09/1032809709.db2.gz SAMWFIXAMVOXDW-DZGCQCFKSA-N 1 1 321.461 3.698 20 10 DHCDMO CC(C)(C)c1cccc(C[N@H+]2CC(C)(C)C[C@]2(C)CO)c1O ZINC001143104315 1019376313 /nfs/dbraw/zinc/37/63/13/1019376313.db2.gz RVMJMNCDBKJAIP-LJQANCHMSA-N 1 1 305.462 3.673 20 10 DHCDMO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000170789265 1019433631 /nfs/dbraw/zinc/43/36/31/1019433631.db2.gz AKMDHHOTHDOSQR-NEPJUHHUSA-N 1 1 319.376 3.960 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccc(F)cc1O ZINC000170788962 1019433769 /nfs/dbraw/zinc/43/37/69/1019433769.db2.gz RJZXDMLIMOUFGK-JTQLQIEISA-N 1 1 311.303 3.984 20 10 DHCDMO CCc1cc(N2CC=C(c3c[nH]c4ncccc34)CC2)nc(C)[nH+]1 ZINC000272936453 1019562904 /nfs/dbraw/zinc/56/29/04/1019562904.db2.gz WHRYGIBWKJOKIX-UHFFFAOYSA-N 1 1 319.412 3.517 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(F)cc1O ZINC000186188893 1019650902 /nfs/dbraw/zinc/65/09/02/1019650902.db2.gz HUEBPPZCPOLNQR-BOFPYLFWSA-N 1 1 314.404 3.627 20 10 DHCDMO CC[C@H]1CCC[N@H+]1Cc1c(O)c(C(=O)OC)cc2ccccc21 ZINC000727824177 1019824215 /nfs/dbraw/zinc/82/42/15/1019824215.db2.gz NWCZPDBVBHBZOQ-AWEZNQCLSA-N 1 1 313.397 3.706 20 10 DHCDMO CCC[N@H+](Cc1cc2c(cc1O)CCC2)C[C@H]1CCCCO1 ZINC000730256128 1019969580 /nfs/dbraw/zinc/96/95/80/1019969580.db2.gz VCCUEXJHNSGGGE-GOSISDBHSA-N 1 1 303.446 3.662 20 10 DHCDMO COc1ccc(C(=O)c2ccccc2Nc2ccc[nH+]c2N)cc1 ZINC001212405408 1020348789 /nfs/dbraw/zinc/34/87/89/1020348789.db2.gz ADBQTXRVWMWGOI-UHFFFAOYSA-N 1 1 319.364 3.647 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1O ZINC000310343180 1020370059 /nfs/dbraw/zinc/37/00/59/1020370059.db2.gz DOXPGVGMLIKNDB-PKOBYXMFSA-N 1 1 324.468 3.955 20 10 DHCDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNCc2c(O)cccc2Cl)C1 ZINC000733325213 1020371392 /nfs/dbraw/zinc/37/13/92/1020371392.db2.gz FBAZKUDDOHLFPV-OKILXGFUSA-N 1 1 324.896 3.892 20 10 DHCDMO C[C@@H]1C[C@H](C)CN(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000733325213 1020371404 /nfs/dbraw/zinc/37/14/04/1020371404.db2.gz FBAZKUDDOHLFPV-OKILXGFUSA-N 1 1 324.896 3.892 20 10 DHCDMO Oc1cc(C(F)(F)F)ccc1Nc1cc[nH+]cc1C(F)(F)F ZINC001212629146 1032905706 /nfs/dbraw/zinc/90/57/06/1032905706.db2.gz NAWPCETWZXYKAS-UHFFFAOYSA-N 1 1 322.208 3.990 20 10 DHCDMO C[C@H](NCC[NH+]1[C@H](C)CCC[C@H]1C)c1ccc(N(C)C)cc1 ZINC000765855165 1020519814 /nfs/dbraw/zinc/51/98/14/1020519814.db2.gz UWONQNWBCMMYRX-ZACQAIPSSA-N 1 1 303.494 3.666 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCCOC(C)(C)C3)c2c1 ZINC000735298411 1020714990 /nfs/dbraw/zinc/71/49/90/1020714990.db2.gz RSYBZWGOYMKEBN-UHFFFAOYSA-N 1 1 315.413 3.555 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2CN2CCCC2)cc1C(C)C ZINC000738104326 1020861686 /nfs/dbraw/zinc/86/16/86/1020861686.db2.gz KZNCRXGAVXXUBM-GOSISDBHSA-N 1 1 316.489 3.884 20 10 DHCDMO Cc1cc(O)c(CN2CCC[C@@H]2C[NH+]2CCCC2)cc1C(C)C ZINC000738104326 1020861695 /nfs/dbraw/zinc/86/16/95/1020861695.db2.gz KZNCRXGAVXXUBM-GOSISDBHSA-N 1 1 316.489 3.884 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738145064 1020862750 /nfs/dbraw/zinc/86/27/50/1020862750.db2.gz NJSOFHXJCUYNJX-INIZCTEOSA-N 1 1 304.478 3.524 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738145064 1020862745 /nfs/dbraw/zinc/86/27/45/1020862745.db2.gz NJSOFHXJCUYNJX-INIZCTEOSA-N 1 1 304.478 3.524 20 10 DHCDMO C[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C[C@@H]1CCCO1 ZINC000738060234 1020863464 /nfs/dbraw/zinc/86/34/64/1020863464.db2.gz BQZYUFNFOMQFBE-ZDUSSCGKSA-N 1 1 315.413 3.628 20 10 DHCDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)CCO1 ZINC000742160121 1021096837 /nfs/dbraw/zinc/09/68/37/1021096837.db2.gz BFULCDSDPCJHRR-NRFANRHFSA-N 1 1 323.436 3.763 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CCC[C@@H](CO)C2)cc1 ZINC000154582590 1021407056 /nfs/dbraw/zinc/40/70/56/1021407056.db2.gz OHKUOOBENCUSEF-GOSISDBHSA-N 1 1 304.478 3.517 20 10 DHCDMO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000850501886 1021562601 /nfs/dbraw/zinc/56/26/01/1021562601.db2.gz QWIAIAZQIDLJFX-NSHDSACASA-N 1 1 315.404 3.898 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc(F)cc1O ZINC000850531280 1021584720 /nfs/dbraw/zinc/58/47/20/1021584720.db2.gz IQUULFQYVPDOMX-QRTARXTBSA-N 1 1 315.388 3.755 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1nccn1C ZINC000850573181 1021616636 /nfs/dbraw/zinc/61/66/36/1021616636.db2.gz VUOCUMPIGZBKTC-IUCAKERBSA-N 1 1 314.216 3.844 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2ccc(OC)o2)cc1F ZINC000892948522 1021720309 /nfs/dbraw/zinc/72/03/09/1021720309.db2.gz UISGYHSRRQLNOC-UHFFFAOYSA-N 1 1 306.381 3.563 20 10 DHCDMO CCc1ccc(-c2noc(C[N@H+](C)Cc3ccccc3O)n2)cc1 ZINC000109771721 1021746057 /nfs/dbraw/zinc/74/60/57/1021746057.db2.gz GDHRCMZLZJODHN-UHFFFAOYSA-N 1 1 323.396 3.637 20 10 DHCDMO CCc1ccc(-c2noc(C[N@@H+](C)Cc3ccccc3O)n2)cc1 ZINC000109771721 1021746066 /nfs/dbraw/zinc/74/60/66/1021746066.db2.gz GDHRCMZLZJODHN-UHFFFAOYSA-N 1 1 323.396 3.637 20 10 DHCDMO C[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccc1O ZINC000109771136 1021747400 /nfs/dbraw/zinc/74/74/00/1021747400.db2.gz NKVGSQUOVWPNPT-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO C[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccc1O ZINC000109771136 1021747418 /nfs/dbraw/zinc/74/74/18/1021747418.db2.gz NKVGSQUOVWPNPT-UHFFFAOYSA-N 1 1 300.383 3.741 20 10 DHCDMO c1ccc([C@H]2CC[N@H+](Cc3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000155063543 1021856450 /nfs/dbraw/zinc/85/64/50/1021856450.db2.gz GQRIJDGLAUDJNN-FQEVSTJZSA-N 1 1 322.452 3.513 20 10 DHCDMO CCc1cc(C[N@H+]2CCOC(C)(C)C2)c(O)c(C(C)(C)C)c1 ZINC000919941359 1021976051 /nfs/dbraw/zinc/97/60/51/1021976051.db2.gz YFKFXANILDOBEI-UHFFFAOYSA-N 1 1 305.462 3.863 20 10 DHCDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(OC)ccc2O)c1 ZINC000179657643 1022072512 /nfs/dbraw/zinc/07/25/12/1022072512.db2.gz NTOXLVNGHYYNRG-GOSISDBHSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc1C ZINC000920304932 1022100774 /nfs/dbraw/zinc/10/07/74/1022100774.db2.gz GOTLLNRFUYFUDG-OXQOHEQNSA-N 1 1 311.425 3.971 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1 ZINC000852598557 1022147130 /nfs/dbraw/zinc/14/71/30/1022147130.db2.gz XCEMFYYLCQKUHP-IEBWSBKVSA-N 1 1 302.462 3.534 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1[O-] ZINC000853239124 1022240008 /nfs/dbraw/zinc/24/00/08/1022240008.db2.gz AKDOHSUEZDQAOY-HIFRSBDPSA-N 1 1 322.880 3.818 20 10 DHCDMO COc1c(C)cnc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)c1C ZINC000183780987 1022382650 /nfs/dbraw/zinc/38/26/50/1022382650.db2.gz UZMNCKAMJNDESX-UHFFFAOYSA-N 1 1 314.429 3.661 20 10 DHCDMO C[C@H](NCC1([NH3+])CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000854222662 1022433784 /nfs/dbraw/zinc/43/37/84/1022433784.db2.gz JPYXMVSGQLQBPA-INIZCTEOSA-N 1 1 301.478 3.599 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000179568265 1022472535 /nfs/dbraw/zinc/47/25/35/1022472535.db2.gz NAOGQGXKGFMHPG-INIZCTEOSA-N 1 1 311.381 3.501 20 10 DHCDMO CC[C@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1ccccc1O ZINC000179584208 1022474783 /nfs/dbraw/zinc/47/47/83/1022474783.db2.gz KAWIEOQFYJHKIC-QGZVFWFLSA-N 1 1 313.397 3.519 20 10 DHCDMO CC[C@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1ccccc1O ZINC000179584208 1022474789 /nfs/dbraw/zinc/47/47/89/1022474789.db2.gz KAWIEOQFYJHKIC-QGZVFWFLSA-N 1 1 313.397 3.519 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H](F)CC2)cc1Br ZINC001237677328 1022514207 /nfs/dbraw/zinc/51/42/07/1022514207.db2.gz LSBQNMRLJROOKE-LBPRGKRZSA-N 1 1 316.214 3.787 20 10 DHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC001169753952 1022531218 /nfs/dbraw/zinc/53/12/18/1022531218.db2.gz DZEPVAMZFZZSPS-IEZWGBDMSA-N 1 1 303.446 3.952 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000776770569 1022558114 /nfs/dbraw/zinc/55/81/14/1022558114.db2.gz BGGCYJWGYDUDCT-IBGZPJMESA-N 1 1 311.425 3.936 20 10 DHCDMO CC(C)[N@H+](Cc1cc(Cl)n(C)n1)Cc1ccc(N(C)C)cc1 ZINC000859081565 1033065386 /nfs/dbraw/zinc/06/53/86/1033065386.db2.gz HDSAJZOBEXZPPU-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO CC(C)[N@@H+](Cc1cc(Cl)n(C)n1)Cc1ccc(N(C)C)cc1 ZINC000859081565 1033065397 /nfs/dbraw/zinc/06/53/97/1033065397.db2.gz HDSAJZOBEXZPPU-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO CCOc1ccccc1C[N@@H+](C)Cc1cccc(OCC)c1O ZINC000180039259 1022622444 /nfs/dbraw/zinc/62/24/44/1022622444.db2.gz QVJYCICAPBETLK-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO C[N@@H+](CCCC(C)(C)C)Cc1ccc(N2CCOCC2)cc1 ZINC000781884189 1022625409 /nfs/dbraw/zinc/62/54/09/1022625409.db2.gz ACBLOOOMIMTMJY-UHFFFAOYSA-N 1 1 304.478 3.781 20 10 DHCDMO CN(CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357902 1022696561 /nfs/dbraw/zinc/69/65/61/1022696561.db2.gz BXKQLHOJTSCFRV-IBGZPJMESA-N 1 1 315.505 3.593 20 10 DHCDMO CN(CC[C@@H]1CCC[N@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357902 1022696565 /nfs/dbraw/zinc/69/65/65/1022696565.db2.gz BXKQLHOJTSCFRV-IBGZPJMESA-N 1 1 315.505 3.593 20 10 DHCDMO Cn1nc(C[N@@H+](Cc2ccccc2O)C2CCCC2)cc1Cl ZINC000859138790 1033079306 /nfs/dbraw/zinc/07/93/06/1033079306.db2.gz IXSACBDMLJZDPN-UHFFFAOYSA-N 1 1 319.836 3.724 20 10 DHCDMO C[N@@H+](CCC[C@@H]1CCO1)Cc1ccc(N2CCCCC2)cc1 ZINC000876512040 1033083330 /nfs/dbraw/zinc/08/33/30/1033083330.db2.gz YOPDRIIWZLQFLP-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO Cc1cccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c1O ZINC000180703766 1022786022 /nfs/dbraw/zinc/78/60/22/1022786022.db2.gz QEIYBABJGBXWMJ-IBGZPJMESA-N 1 1 311.425 3.534 20 10 DHCDMO Oc1ccccc1C[N@@H+](CCC[C@H]1CCO1)Cc1ccco1 ZINC000876511080 1033080462 /nfs/dbraw/zinc/08/04/62/1033080462.db2.gz VUZGNPRYKKKFSC-INIZCTEOSA-N 1 1 301.386 3.557 20 10 DHCDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3c(O)ccc4ccccc43)C2)n1 ZINC000068962491 1022830689 /nfs/dbraw/zinc/83/06/89/1022830689.db2.gz USUAREDCKOHUQX-OAHLLOKOSA-N 1 1 323.396 3.616 20 10 DHCDMO CC(C)[C@H](C)[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000768138897 1022903631 /nfs/dbraw/zinc/90/36/31/1022903631.db2.gz WHACEYIZKAICGN-HNNXBMFYSA-N 1 1 320.452 3.671 20 10 DHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(C)ccc1O ZINC000768204276 1022917079 /nfs/dbraw/zinc/91/70/79/1022917079.db2.gz WDFALROGQOPRLS-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000768338696 1022946772 /nfs/dbraw/zinc/94/67/72/1022946772.db2.gz OHJXFBTWHWSPIN-SNVBAGLBSA-N 1 1 316.239 3.784 20 10 DHCDMO Cc1ncsc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000768358495 1022952103 /nfs/dbraw/zinc/95/21/03/1022952103.db2.gz XNYUOPURNZSJQL-UHFFFAOYSA-N 1 1 303.475 3.928 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000768364886 1022952680 /nfs/dbraw/zinc/95/26/80/1022952680.db2.gz PNNDZGPKVJKOSS-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cc(OC)c(C)cc2O)cc1 ZINC000768438930 1022966343 /nfs/dbraw/zinc/96/63/43/1022966343.db2.gz YDOYOAVFMHQARC-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H]([C@H]3CCOC3)C1)CCCC2 ZINC000768463847 1022972771 /nfs/dbraw/zinc/97/27/71/1022972771.db2.gz YAGVMQIJKRSVQL-ROUUACIJSA-N 1 1 315.457 3.520 20 10 DHCDMO CCC[C@@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC)cc2O)C1 ZINC000768465814 1022974001 /nfs/dbraw/zinc/97/40/01/1022974001.db2.gz LYQOOIZIBOESKB-SFHVURJKSA-N 1 1 307.434 3.812 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cccc(OC)c1O ZINC000768471691 1022976170 /nfs/dbraw/zinc/97/61/70/1022976170.db2.gz NUGIGOZELQRKEY-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(Cl)nn1 ZINC000876584838 1033097285 /nfs/dbraw/zinc/09/72/85/1033097285.db2.gz QJDGLMWCOUXOQL-UHFFFAOYSA-N 1 1 318.852 3.607 20 10 DHCDMO CC[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCOC1 ZINC000768520652 1022978728 /nfs/dbraw/zinc/97/87/28/1022978728.db2.gz GXKVBLMFNZCMAL-MRXNPFEDSA-N 1 1 311.425 3.918 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc(OC)c1 ZINC000768536382 1022986404 /nfs/dbraw/zinc/98/64/04/1022986404.db2.gz IWPTZTPPWURCLY-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO COCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)c1ccccc1 ZINC000768595323 1022997431 /nfs/dbraw/zinc/99/74/31/1022997431.db2.gz HRGDPYXINITEGD-KRWDZBQOSA-N 1 1 312.457 3.962 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)cc1C ZINC000364310441 1023007629 /nfs/dbraw/zinc/00/76/29/1023007629.db2.gz UHYNZMUKJLFBFI-RXVVDRJESA-N 1 1 324.468 3.792 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1C ZINC000364310441 1023007645 /nfs/dbraw/zinc/00/76/45/1023007645.db2.gz UHYNZMUKJLFBFI-RXVVDRJESA-N 1 1 324.468 3.792 20 10 DHCDMO CC[N@@H+](Cc1c(O)cccc1OC)[C@@H](C)c1cccc(O)c1 ZINC000768872171 1023042798 /nfs/dbraw/zinc/04/27/98/1023042798.db2.gz FBAOJPFMGUBSIY-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO Cc1cc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000123777495 1023067603 /nfs/dbraw/zinc/06/76/03/1023067603.db2.gz PTRUGEBVYXQUFX-HNNXBMFYSA-N 1 1 317.473 3.999 20 10 DHCDMO CC(C)n1ncc2c1C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)CC2 ZINC000364377375 1023098911 /nfs/dbraw/zinc/09/89/11/1023098911.db2.gz OTMAETQBWSQBNO-SWLSCSKDSA-N 1 1 317.408 3.517 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(OCC)cc1O ZINC000769201466 1023101338 /nfs/dbraw/zinc/10/13/38/1023101338.db2.gz UWGBNGQTYLJSSA-UHFFFAOYSA-N 1 1 315.413 3.909 20 10 DHCDMO COc1cccc(C[N@H+]2CCCC[C@@H]2Cc2ccccc2)c1O ZINC000769229520 1023104217 /nfs/dbraw/zinc/10/42/17/1023104217.db2.gz MJGMWNKYOQYQPR-GOSISDBHSA-N 1 1 311.425 3.998 20 10 DHCDMO c1cn([C@@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)cn1 ZINC000769313558 1023119629 /nfs/dbraw/zinc/11/96/29/1023119629.db2.gz UMOUOVNMKJZSMW-HXUWFJFHSA-N 1 1 324.472 3.711 20 10 DHCDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769312396 1023119809 /nfs/dbraw/zinc/11/98/09/1023119809.db2.gz LXCTXJBPFDITCW-GOSISDBHSA-N 1 1 320.452 3.673 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1 ZINC000769316605 1023120659 /nfs/dbraw/zinc/12/06/59/1023120659.db2.gz KNTVLRXEJSIGSF-INIZCTEOSA-N 1 1 311.381 3.766 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000769426835 1023147258 /nfs/dbraw/zinc/14/72/58/1023147258.db2.gz IRIDDLBLPBBZOC-GOSISDBHSA-N 1 1 315.438 3.691 20 10 DHCDMO C[C@H]([NH2+]CCCOC(F)F)c1cc(Cl)c(Cl)cc1O ZINC000194026557 1023147779 /nfs/dbraw/zinc/14/77/79/1023147779.db2.gz NMFHAEBCTJQBFP-ZETCQYMHSA-N 1 1 314.159 3.979 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000769468239 1023161550 /nfs/dbraw/zinc/16/15/50/1023161550.db2.gz FGBUSXRKJUWCBM-UHFFFAOYSA-N 1 1 314.473 3.822 20 10 DHCDMO CO[C@H](C)C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C(C)C ZINC000769474080 1023163556 /nfs/dbraw/zinc/16/35/56/1023163556.db2.gz RMVDXEVVJLHLEZ-QGZVFWFLSA-N 1 1 304.478 3.922 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000769476209 1023164735 /nfs/dbraw/zinc/16/47/35/1023164735.db2.gz XGPFVDWQJAFVCE-UZLBHIALSA-N 1 1 311.425 3.971 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@@H]2C)c1O ZINC000769499338 1023166657 /nfs/dbraw/zinc/16/66/57/1023166657.db2.gz QLPUHQVUAUPYEY-RDJZCZTQSA-N 1 1 311.425 3.854 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000769507869 1023170379 /nfs/dbraw/zinc/17/03/79/1023170379.db2.gz PMGGGMKMGBTZSA-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C12CCC2 ZINC000770354553 1023304674 /nfs/dbraw/zinc/30/46/74/1023304674.db2.gz YANOPWMZCDYFTE-ZWKOTPCHSA-N 1 1 302.462 3.532 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@@H+](C)C[C@@H]3CCCCO3)c2c1 ZINC000125323223 1023476657 /nfs/dbraw/zinc/47/66/57/1023476657.db2.gz AWONDXOFYZQCAV-INIZCTEOSA-N 1 1 315.413 3.555 20 10 DHCDMO COCCSCCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000785691677 1023605586 /nfs/dbraw/zinc/60/55/86/1023605586.db2.gz AIXZQAAPSYHWRC-UHFFFAOYSA-N 1 1 323.502 3.907 20 10 DHCDMO C[C@@H]([NH2+]CCCOCC1CC1)c1cccc(C(F)(F)F)c1O ZINC000788508310 1023897514 /nfs/dbraw/zinc/89/75/14/1023897514.db2.gz USPJGSPKKLSLQC-LLVKDONJSA-N 1 1 317.351 3.878 20 10 DHCDMO CCN1CCC[C@H]1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788506635 1023897569 /nfs/dbraw/zinc/89/75/69/1023897569.db2.gz XBRWHCWYPXAUGA-NEPJUHHUSA-N 1 1 316.367 3.546 20 10 DHCDMO CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788506637 1023898085 /nfs/dbraw/zinc/89/80/85/1023898085.db2.gz XBRWHCWYPXAUGA-NWDGAFQWSA-N 1 1 316.367 3.546 20 10 DHCDMO CCN(CC)C[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788587272 1023909871 /nfs/dbraw/zinc/90/98/71/1023909871.db2.gz HPJQLDRWCYEQIX-NWDGAFQWSA-N 1 1 318.383 3.792 20 10 DHCDMO C[C@H]([NH2+]CC1(C)CCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788689274 1023920197 /nfs/dbraw/zinc/92/01/97/1023920197.db2.gz UYMLTOZABNVSCH-NSHDSACASA-N 1 1 317.351 3.878 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccc(F)cc1O ZINC000796702919 1023938781 /nfs/dbraw/zinc/93/87/81/1023938781.db2.gz QLOSAGFCWPBWFH-SJLPKXTDSA-N 1 1 303.377 3.960 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000707129732 1024054029 /nfs/dbraw/zinc/05/40/29/1024054029.db2.gz RIYPILTVMMDWQI-SMDDNHRTSA-N 1 1 310.235 3.919 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c1O ZINC000130125325 1024134449 /nfs/dbraw/zinc/13/44/49/1024134449.db2.gz WBJOQUYYNRHOOV-UHFFFAOYSA-N 1 1 319.351 3.844 20 10 DHCDMO CC[N@@H+](Cc1sc(C)nc1C)Cc1ccc(N(C)C)cc1 ZINC000130204897 1024143682 /nfs/dbraw/zinc/14/36/82/1024143682.db2.gz YNLUDFRWTDIIPY-UHFFFAOYSA-N 1 1 303.475 3.848 20 10 DHCDMO Cc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc(Cl)n1 ZINC000789744512 1024163322 /nfs/dbraw/zinc/16/33/22/1024163322.db2.gz WHDAQLZWHJBYFK-UHFFFAOYSA-N 1 1 303.837 3.741 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000883004727 1024206810 /nfs/dbraw/zinc/20/68/10/1024206810.db2.gz SVZZEDMUXWDIOZ-UHFFFAOYSA-N 1 1 310.369 3.686 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000883084168 1024233046 /nfs/dbraw/zinc/23/30/46/1024233046.db2.gz JLHCBBLUQMZSSB-HNNXBMFYSA-N 1 1 323.314 3.813 20 10 DHCDMO COCC[N@@H+](Cc1c(O)ccc2ccncc21)[C@@H]1CC[C@@H](C)C1 ZINC000790476861 1024307450 /nfs/dbraw/zinc/30/74/50/1024307450.db2.gz FDVWZHALFPJFEF-GDBMZVCRSA-N 1 1 314.429 3.577 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)Cn1cccn1)c1cc(Cl)c(Cl)cc1O ZINC000278893476 1024357304 /nfs/dbraw/zinc/35/73/04/1024357304.db2.gz YTQCXBBKJLKHQW-VHSXEESVSA-N 1 1 314.216 3.635 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1 ZINC000883312392 1024366468 /nfs/dbraw/zinc/36/64/68/1024366468.db2.gz BNCPSLYFAXYFMD-OAHLLOKOSA-N 1 1 310.445 3.663 20 10 DHCDMO CCC[N@@H+](Cc1ccnn1-c1ccccc1)Cc1ccccc1O ZINC000790906016 1024399099 /nfs/dbraw/zinc/39/90/99/1024399099.db2.gz SFZLYCYSFHBYLN-UHFFFAOYSA-N 1 1 321.424 3.990 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1CCOc2ccccc21 ZINC000790960310 1024406676 /nfs/dbraw/zinc/40/66/76/1024406676.db2.gz BYBPPZFWSSXBMZ-LLVKDONJSA-N 1 1 321.779 3.841 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000790960312 1024407251 /nfs/dbraw/zinc/40/72/51/1024407251.db2.gz BYBPPZFWSSXBMZ-NSHDSACASA-N 1 1 321.779 3.841 20 10 DHCDMO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790991693 1024414121 /nfs/dbraw/zinc/41/41/21/1024414121.db2.gz ZJYQMAISASGPHK-NWDGAFQWSA-N 1 1 315.816 3.868 20 10 DHCDMO CCO[C@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C12CCC2 ZINC000790972044 1024419670 /nfs/dbraw/zinc/41/96/70/1024419670.db2.gz FCERATQPZHJNFP-KGLIPLIRSA-N 1 1 313.800 3.622 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000790980847 1024423718 /nfs/dbraw/zinc/42/37/18/1024423718.db2.gz QDCQPDXEOUUEMG-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccco2)C2CCCC2)c1O ZINC000132192276 1024459752 /nfs/dbraw/zinc/45/97/52/1024459752.db2.gz PIQNEISYCDHCLV-UHFFFAOYSA-N 1 1 301.386 3.939 20 10 DHCDMO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cccc(F)c1O ZINC000317310856 1024520296 /nfs/dbraw/zinc/52/02/96/1024520296.db2.gz VAOKUYQVELAORJ-CYBMUJFWSA-N 1 1 303.377 3.603 20 10 DHCDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cccc(F)c1O ZINC000317310856 1024520322 /nfs/dbraw/zinc/52/03/22/1024520322.db2.gz VAOKUYQVELAORJ-CYBMUJFWSA-N 1 1 303.377 3.603 20 10 DHCDMO CS[C@H]1CCCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173448 1024640617 /nfs/dbraw/zinc/64/06/17/1024640617.db2.gz WQAJVHTWTYTWOX-JTQLQIEISA-N 1 1 303.830 3.902 20 10 DHCDMO CS[C@H]1CCCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792173448 1024640622 /nfs/dbraw/zinc/64/06/22/1024640622.db2.gz WQAJVHTWTYTWOX-JTQLQIEISA-N 1 1 303.830 3.902 20 10 DHCDMO CC[N@H+](C)Cc1cccc(C[NH2+]Cc2c([O-])cccc2Cl)c1 ZINC000113336050 1024797245 /nfs/dbraw/zinc/79/72/45/1024797245.db2.gz AYICCPJBGFMBOJ-UHFFFAOYSA-N 1 1 318.848 3.787 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2c([O-])cccc2Cl)c1 ZINC000113336050 1024797251 /nfs/dbraw/zinc/79/72/51/1024797251.db2.gz AYICCPJBGFMBOJ-UHFFFAOYSA-N 1 1 318.848 3.787 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000793231289 1024943328 /nfs/dbraw/zinc/94/33/28/1024943328.db2.gz MBJZJWZEFUKNNL-CMPLNLGQSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)C(C)(C)c2ccccc2)cc1OC ZINC000793609581 1025128845 /nfs/dbraw/zinc/12/88/45/1025128845.db2.gz PIOFXLVRHIKJLF-UHFFFAOYSA-N 1 1 315.413 3.777 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000124389095 1025423499 /nfs/dbraw/zinc/42/34/99/1025423499.db2.gz XLVOTRNBTPBICI-KRWDZBQOSA-N 1 1 320.392 3.594 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1(C)C ZINC000877349114 1033287275 /nfs/dbraw/zinc/28/72/75/1033287275.db2.gz ZNKBWYSMILSGEE-INIZCTEOSA-N 1 1 316.489 3.516 20 10 DHCDMO CC(C)Oc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cn1 ZINC000886505189 1025658875 /nfs/dbraw/zinc/65/88/75/1025658875.db2.gz ONEJNJXNPZMKQJ-GFCCVEGCSA-N 1 1 304.365 3.564 20 10 DHCDMO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1c(O)cccc1F ZINC000886530242 1025679751 /nfs/dbraw/zinc/67/97/51/1025679751.db2.gz GWKYOFAHIAHHMN-CZUORRHYSA-N 1 1 303.377 3.696 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1c(O)cccc1F ZINC000886530241 1025680481 /nfs/dbraw/zinc/68/04/81/1025680481.db2.gz GWKYOFAHIAHHMN-CJNGLKHVSA-N 1 1 303.377 3.696 20 10 DHCDMO Cc1cccc2oc(CC[NH2+][C@@H](C)c3c(O)cccc3F)nc21 ZINC000886534707 1025682921 /nfs/dbraw/zinc/68/29/21/1025682921.db2.gz MYKMUJZCLYOMBR-LBPRGKRZSA-N 1 1 314.360 3.874 20 10 DHCDMO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886543455 1025689553 /nfs/dbraw/zinc/68/95/53/1025689553.db2.gz PDMAKGLRTIITNU-JTNHKYCSSA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1c(O)cccc1F ZINC000886559673 1025708503 /nfs/dbraw/zinc/70/85/03/1025708503.db2.gz AZDSJBLMRSNKGT-GFCCVEGCSA-N 1 1 318.392 3.954 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1c(O)cccc1F ZINC000886586229 1025722993 /nfs/dbraw/zinc/72/29/93/1025722993.db2.gz NIWULUBQSYWVQC-GFCCVEGCSA-N 1 1 318.392 3.954 20 10 DHCDMO CC[C@@H](COCC(F)(F)F)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886615634 1025740104 /nfs/dbraw/zinc/74/01/04/1025740104.db2.gz KLMSOXUDPJZIGY-ZJUUUORDSA-N 1 1 309.303 3.539 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccc(F)cc1O ZINC000886774910 1025894743 /nfs/dbraw/zinc/89/47/43/1025894743.db2.gz XYWUYOVLNZDXSY-GUYCJALGSA-N 1 1 307.409 3.921 20 10 DHCDMO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1O ZINC000841746738 1026049940 /nfs/dbraw/zinc/04/99/40/1026049940.db2.gz KXXNELTZNIIFJN-LLVKDONJSA-N 1 1 320.776 3.847 20 10 DHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)cc1OC ZINC000245541280 1026062062 /nfs/dbraw/zinc/06/20/62/1026062062.db2.gz NXKCXBGIRSSWCL-BFUOFWGJSA-N 1 1 313.397 3.602 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1COc2ccc(F)cc2C1)c1ccc(F)cc1O ZINC000808730059 1026382400 /nfs/dbraw/zinc/38/24/00/1026382400.db2.gz SAXDIRLDRKHYNO-GDBMZVCRSA-N 1 1 319.351 3.715 20 10 DHCDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000809643764 1026582587 /nfs/dbraw/zinc/58/25/87/1026582587.db2.gz UASSROBUXHEEPB-KRWDZBQOSA-N 1 1 319.832 3.819 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000809758177 1026618598 /nfs/dbraw/zinc/61/85/98/1026618598.db2.gz FQUFZDJKFJHNDP-UONOGXRCSA-N 1 1 309.837 3.684 20 10 DHCDMO COc1cccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1O ZINC000809782701 1026623894 /nfs/dbraw/zinc/62/38/94/1026623894.db2.gz DXRAJLJUQUVWRP-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO COc1cccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)c1O ZINC000809782701 1026623897 /nfs/dbraw/zinc/62/38/97/1026623897.db2.gz DXRAJLJUQUVWRP-UHFFFAOYSA-N 1 1 322.408 3.761 20 10 DHCDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000809790359 1026627637 /nfs/dbraw/zinc/62/76/37/1026627637.db2.gz HMFUXXYWYZFNPW-FQEVSTJZSA-N 1 1 316.489 3.661 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[NH2+]Cc2ccon2)cc1 ZINC000747622533 1026819912 /nfs/dbraw/zinc/81/99/12/1026819912.db2.gz OAPPPBIAHJZUFH-UHFFFAOYSA-N 1 1 321.424 3.991 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@@H](C4CC4)C3)cc2)CC1 ZINC000828563489 1026963254 /nfs/dbraw/zinc/96/32/54/1026963254.db2.gz DURCEOCUFZBPPS-GOSISDBHSA-N 1 1 314.473 3.534 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccccc32)[C@H]1[C@@H]1CCCO1 ZINC000811510691 1027027816 /nfs/dbraw/zinc/02/78/16/1027027816.db2.gz MZJJXZZXTYKHIM-OALUTQOASA-N 1 1 311.425 3.935 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCCC3)[C@@H]1[C@H]1CCCO1 ZINC000811777977 1027082004 /nfs/dbraw/zinc/08/20/04/1027082004.db2.gz WHHGIZISJKUMSN-RTBURBONSA-N 1 1 315.457 3.660 20 10 DHCDMO COc1cccc2c(NCCc3ccc(O)c(O)c3)c(C)c[nH+]c12 ZINC000811811633 1027091581 /nfs/dbraw/zinc/09/15/81/1027091581.db2.gz ZCPBJPRDDWXGFH-UHFFFAOYSA-N 1 1 324.380 3.618 20 10 DHCDMO CC[C@H]([NH2+]CCCc1ncccc1C)c1ccc(F)cc1O ZINC000296444598 1027638009 /nfs/dbraw/zinc/63/80/09/1027638009.db2.gz MMUJEYKOZMXBBM-INIZCTEOSA-N 1 1 302.393 3.908 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1O ZINC000813882910 1027749421 /nfs/dbraw/zinc/74/94/21/1027749421.db2.gz AFWDMEKGKDUDLW-GXTWGEPZSA-N 1 1 318.367 3.600 20 10 DHCDMO CCc1nc([C@@H]2CCC[N@H+]([C@H](CC)c3ccccc3O)C2)no1 ZINC000364624509 1027861672 /nfs/dbraw/zinc/86/16/72/1027861672.db2.gz SYFKONWGEGQECP-UKRRQHHQSA-N 1 1 315.417 3.668 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccc(Cl)cn2)C2CC2)cc1 ZINC000778216649 1027904051 /nfs/dbraw/zinc/90/40/51/1027904051.db2.gz SOLZRMLYMCGWQW-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000366544073 1028097711 /nfs/dbraw/zinc/09/77/11/1028097711.db2.gz KNYCBRCAZHLMCY-ACJLOTCBSA-N 1 1 312.413 3.940 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321743 1028167949 /nfs/dbraw/zinc/16/79/49/1028167949.db2.gz JNNIEGKTFRGLQV-AEFFLSMTSA-N 1 1 302.462 3.794 20 10 DHCDMO CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321743 1028167954 /nfs/dbraw/zinc/16/79/54/1028167954.db2.gz JNNIEGKTFRGLQV-AEFFLSMTSA-N 1 1 302.462 3.794 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000368024356 1028280130 /nfs/dbraw/zinc/28/01/30/1028280130.db2.gz TXJLJWKTFNXVMA-HZPDHXFCSA-N 1 1 301.386 3.818 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000368024356 1028280149 /nfs/dbraw/zinc/28/01/49/1028280149.db2.gz TXJLJWKTFNXVMA-HZPDHXFCSA-N 1 1 301.386 3.818 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000368024357 1028281606 /nfs/dbraw/zinc/28/16/06/1028281606.db2.gz TXJLJWKTFNXVMA-JKSUJKDBSA-N 1 1 301.386 3.818 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000368024357 1028281618 /nfs/dbraw/zinc/28/16/18/1028281618.db2.gz TXJLJWKTFNXVMA-JKSUJKDBSA-N 1 1 301.386 3.818 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(Cl)nc2)ccc1N(C)C ZINC000815058744 1028344734 /nfs/dbraw/zinc/34/47/34/1028344734.db2.gz RQVURKJHAHKGPN-UHFFFAOYSA-N 1 1 303.837 3.741 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H]1CCOC(C)(C)C1 ZINC000815120410 1028366531 /nfs/dbraw/zinc/36/65/31/1028366531.db2.gz RYGVEXZRRUJYFE-QGZVFWFLSA-N 1 1 304.478 3.841 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000368795108 1028408484 /nfs/dbraw/zinc/40/84/84/1028408484.db2.gz DZCLNDOPFZVMGE-GDBMZVCRSA-N 1 1 312.413 3.648 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)cc1 ZINC000779152453 1028441593 /nfs/dbraw/zinc/44/15/93/1028441593.db2.gz ABZDNLCYVKGDBU-IEBWSBKVSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1O ZINC000815588312 1028560133 /nfs/dbraw/zinc/56/01/33/1028560133.db2.gz KCYXTXPBXNNSDW-IJLUTSLNSA-N 1 1 317.351 3.613 20 10 DHCDMO C[C@@H]([NH2+]Cc1ncccc1F)c1cccc(C(F)(F)F)c1O ZINC000815598215 1028562771 /nfs/dbraw/zinc/56/27/71/1028562771.db2.gz PEAYEFHXFYLCSU-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(F)nc1 ZINC000189275410 1028566041 /nfs/dbraw/zinc/56/60/41/1028566041.db2.gz URBIVCCDFULCFV-UHFFFAOYSA-N 1 1 312.344 3.722 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(F)nc1 ZINC000189275410 1028566051 /nfs/dbraw/zinc/56/60/51/1028566051.db2.gz URBIVCCDFULCFV-UHFFFAOYSA-N 1 1 312.344 3.722 20 10 DHCDMO C[C@@H]([NH2+]CC1(O)CCCCC1)c1cccc(C(F)(F)F)c1O ZINC000815573003 1028566715 /nfs/dbraw/zinc/56/67/15/1028566715.db2.gz VJWWVZHCQRETSO-LLVKDONJSA-N 1 1 317.351 3.757 20 10 DHCDMO Cc1cc(C)c([C@@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(O)c1 ZINC000815616779 1028572283 /nfs/dbraw/zinc/57/22/83/1028572283.db2.gz XZRMKLPTFRLPFC-MRXNPFEDSA-N 1 1 304.478 3.782 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000371410877 1028706571 /nfs/dbraw/zinc/70/65/71/1028706571.db2.gz IAMFXYCKSCJMHR-MRXNPFEDSA-N 1 1 319.408 3.715 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@H](n2cnc3ccccc32)C1 ZINC000371464094 1028717163 /nfs/dbraw/zinc/71/71/63/1028717163.db2.gz ONXFJAJXBJBIJN-INIZCTEOSA-N 1 1 307.397 3.579 20 10 DHCDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816493291 1028897079 /nfs/dbraw/zinc/89/70/79/1028897079.db2.gz VZJQSMJRRXUXCB-INIZCTEOSA-N 1 1 321.420 3.928 20 10 DHCDMO CC[N@H+](CCc1ccccn1)Cc1cc(Cl)c(F)cc1O ZINC000816495751 1028897827 /nfs/dbraw/zinc/89/78/27/1028897827.db2.gz IKRKPHBTIGDOAN-UHFFFAOYSA-N 1 1 308.784 3.644 20 10 DHCDMO CC[N@@H+](CCc1ccccn1)Cc1cc(Cl)c(F)cc1O ZINC000816495751 1028897838 /nfs/dbraw/zinc/89/78/38/1028897838.db2.gz IKRKPHBTIGDOAN-UHFFFAOYSA-N 1 1 308.784 3.644 20 10 DHCDMO Oc1c(C[N@H+]2CC[C@H](N3CCCCC3)C2)ccc2ccccc21 ZINC000816503545 1028909360 /nfs/dbraw/zinc/90/93/60/1028909360.db2.gz CAHFEZUCNZWDSR-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(CN2CC[C@H]([NH+]3CCCCC3)C2)ccc2ccccc21 ZINC000816503545 1028909367 /nfs/dbraw/zinc/90/93/67/1028909367.db2.gz CAHFEZUCNZWDSR-SFHVURJKSA-N 1 1 310.441 3.606 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@]3(CCCOC3)C2)ccc2ccccc21 ZINC000816514828 1028920891 /nfs/dbraw/zinc/92/08/91/1028920891.db2.gz IJZLKFDDTHMUED-HXUWFJFHSA-N 1 1 311.425 3.938 20 10 DHCDMO C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000816530050 1028922576 /nfs/dbraw/zinc/92/25/76/1028922576.db2.gz RFGRXCMMWSNBEC-LBPRGKRZSA-N 1 1 314.832 3.539 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc2c(c1)OCO2 ZINC000816533358 1028924321 /nfs/dbraw/zinc/92/43/21/1028924321.db2.gz SIDBAMIZDIAXML-VIFPVBQESA-N 1 1 323.751 3.764 20 10 DHCDMO CCOc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816539735 1028927260 /nfs/dbraw/zinc/92/72/60/1028927260.db2.gz RCRWYHXAZPCDHV-UHFFFAOYSA-N 1 1 309.768 3.873 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1OCCc2ccccc21 ZINC000816550523 1028932706 /nfs/dbraw/zinc/93/27/06/1028932706.db2.gz TVFVJSPQUYYTEB-QGZVFWFLSA-N 1 1 321.779 3.588 20 10 DHCDMO CC(C)(C[NH2+]Cc1cc(Cl)c(F)cc1O)[C@@H]1CCCCO1 ZINC000816556660 1028941777 /nfs/dbraw/zinc/94/17/77/1028941777.db2.gz QQNNRSRJVOPIGH-HNNXBMFYSA-N 1 1 315.816 3.870 20 10 DHCDMO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816554779 1028941962 /nfs/dbraw/zinc/94/19/62/1028941962.db2.gz IVUPRMPHZVHJGT-BZNIZROVSA-N 1 1 315.816 3.726 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000816566838 1028947812 /nfs/dbraw/zinc/94/78/12/1028947812.db2.gz IKOHSDPYSBTGNL-CYBMUJFWSA-N 1 1 320.795 3.644 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000816566838 1028947826 /nfs/dbraw/zinc/94/78/26/1028947826.db2.gz IKOHSDPYSBTGNL-CYBMUJFWSA-N 1 1 320.795 3.644 20 10 DHCDMO COCC[C@@H]1CCCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816570709 1028949263 /nfs/dbraw/zinc/94/92/63/1028949263.db2.gz FHBHNUAGPDDFJA-LBPRGKRZSA-N 1 1 315.816 3.823 20 10 DHCDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000816570709 1028949269 /nfs/dbraw/zinc/94/92/69/1028949269.db2.gz FHBHNUAGPDDFJA-LBPRGKRZSA-N 1 1 315.816 3.823 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@H](OC(F)F)C2)ccc2ccccc21 ZINC000816566153 1028949388 /nfs/dbraw/zinc/94/93/88/1028949388.db2.gz MLGDJQMMGQRORZ-AWEZNQCLSA-N 1 1 307.340 3.749 20 10 DHCDMO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609281 1028960053 /nfs/dbraw/zinc/96/00/53/1028960053.db2.gz WOYHXTDNBSGJMR-DGCLKSJQSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609281 1028960067 /nfs/dbraw/zinc/96/00/67/1028960067.db2.gz WOYHXTDNBSGJMR-DGCLKSJQSA-N 1 1 315.816 3.700 20 10 DHCDMO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccc3ccccc3c2O)n1 ZINC000816609858 1028960917 /nfs/dbraw/zinc/96/09/17/1028960917.db2.gz OXYHVVSMLDOAJG-INIZCTEOSA-N 1 1 309.369 3.574 20 10 DHCDMO Oc1ccc2c(c1)OCC[N@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816609163 1028961234 /nfs/dbraw/zinc/96/12/34/1028961234.db2.gz UDFXGKRFEGZPIW-UHFFFAOYSA-N 1 1 321.376 3.646 20 10 DHCDMO CC(C)c1nccn1[C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC000373144215 1028962459 /nfs/dbraw/zinc/96/24/59/1028962459.db2.gz ZDYNCFMHEGKPGQ-OAHLLOKOSA-N 1 1 317.408 3.688 20 10 DHCDMO CC(C)c1nccn1[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000373144215 1028962468 /nfs/dbraw/zinc/96/24/68/1028962468.db2.gz ZDYNCFMHEGKPGQ-OAHLLOKOSA-N 1 1 317.408 3.688 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c(O)c1 ZINC000816621852 1028968468 /nfs/dbraw/zinc/96/84/68/1028968468.db2.gz QPDDUPBKSFAOCV-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO CO[C@]1(C)CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373469445 1029054204 /nfs/dbraw/zinc/05/42/04/1029054204.db2.gz ZWDKUBCJXLPFPM-OAHLLOKOSA-N 1 1 301.789 3.576 20 10 DHCDMO CO[C@]1(C)CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373469445 1029054211 /nfs/dbraw/zinc/05/42/11/1029054211.db2.gz ZWDKUBCJXLPFPM-OAHLLOKOSA-N 1 1 301.789 3.576 20 10 DHCDMO Cc1nc2c(s1)CCC[C@@H]2C[N@H+](C)Cc1ccccc1O ZINC000373594313 1029090871 /nfs/dbraw/zinc/09/08/71/1029090871.db2.gz NVDCJZGERKRUIF-CQSZACIVSA-N 1 1 302.443 3.709 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]C[C@H]1CC12CCSCC2 ZINC000817409686 1029150461 /nfs/dbraw/zinc/15/04/61/1029150461.db2.gz DSMZXIVIZPWSCT-SNVBAGLBSA-N 1 1 315.841 3.808 20 10 DHCDMO C[C@H]([NH2+]CCCC1(O)CCC1)c1cccc(C(F)(F)F)c1O ZINC000817584905 1029214053 /nfs/dbraw/zinc/21/40/53/1029214053.db2.gz ANZNKPQCDTYBRS-NSHDSACASA-N 1 1 317.351 3.757 20 10 DHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccs1 ZINC000817938662 1029279821 /nfs/dbraw/zinc/27/98/21/1029279821.db2.gz OZANTYHTHNMIBC-JKSUJKDBSA-N 1 1 303.475 3.555 20 10 DHCDMO C[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc2c(c1)CCC2 ZINC000817938630 1029282259 /nfs/dbraw/zinc/28/22/59/1029282259.db2.gz OPXQOPVOYHPBRW-VFNWGFHPSA-N 1 1 323.484 3.592 20 10 DHCDMO Cc1cc([C@@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000817938116 1029285021 /nfs/dbraw/zinc/28/50/21/1029285021.db2.gz DUQYPXKLKKDKBE-ACJLOTCBSA-N 1 1 317.502 3.782 20 10 DHCDMO CC(C)C[C@H](C[NH3+])N[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960485 1029300634 /nfs/dbraw/zinc/30/06/34/1029300634.db2.gz ZQMUFGBUBNACAH-SJLPKXTDSA-N 1 1 303.494 3.701 20 10 DHCDMO NC1(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)CCC1 ZINC000817965094 1029304664 /nfs/dbraw/zinc/30/46/64/1029304664.db2.gz PEPCJJFTPNFQAV-GOSISDBHSA-N 1 1 310.441 3.537 20 10 DHCDMO C[C@@H](NCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969569 1029307942 /nfs/dbraw/zinc/30/79/42/1029307942.db2.gz XJJLKZMMFOGSCT-NVXWUHKLSA-N 1 1 319.468 3.609 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)c1 ZINC001324745870 1029763343 /nfs/dbraw/zinc/76/33/43/1029763343.db2.gz FRMVXSHEDTXMCL-AWEZNQCLSA-N 1 1 323.845 3.989 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)c1 ZINC001324745870 1029763351 /nfs/dbraw/zinc/76/33/51/1029763351.db2.gz FRMVXSHEDTXMCL-AWEZNQCLSA-N 1 1 323.845 3.989 20 10 DHCDMO CCCOc1ccc(C[N@@H+](Cc2ccccn2)C2CC2)c(O)c1 ZINC000290450248 1030055202 /nfs/dbraw/zinc/05/52/02/1030055202.db2.gz MHXVSYOWSRPPGK-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000290842995 1030219494 /nfs/dbraw/zinc/21/94/94/1030219494.db2.gz IMJKLPAZKPGYTD-FQEVSTJZSA-N 1 1 324.472 3.629 20 10 DHCDMO C[C@H](O)CC[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000823459025 1030294107 /nfs/dbraw/zinc/29/41/07/1030294107.db2.gz MSVWCRFFHLUFHT-HNNXBMFYSA-N 1 1 318.486 3.587 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2csc(C)c2C)c1 ZINC000866428797 1030296214 /nfs/dbraw/zinc/29/62/14/1030296214.db2.gz GLKPGHZMLADHHX-NSHDSACASA-N 1 1 319.426 3.708 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccc2c1CCOC2)c1ccc(F)cc1O ZINC000866478659 1030311906 /nfs/dbraw/zinc/31/19/06/1030311906.db2.gz JWFLYVHFULHWKJ-SFHVURJKSA-N 1 1 315.388 3.845 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccnn1C ZINC000866615239 1030404715 /nfs/dbraw/zinc/40/47/15/1030404715.db2.gz SILSYOJHINVLGE-IUCAKERBSA-N 1 1 314.216 3.844 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]CCC(C)(F)F)c1 ZINC000824483824 1030564802 /nfs/dbraw/zinc/56/48/02/1030564802.db2.gz UQJUZDZLYFAGRU-UHFFFAOYSA-N 1 1 308.166 3.598 20 10 DHCDMO CC[C@@H](CO)[N@@H+](C)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000824537601 1030584823 /nfs/dbraw/zinc/58/48/23/1030584823.db2.gz FJLFTBAGIBUTOT-INIZCTEOSA-N 1 1 318.486 3.587 20 10 DHCDMO C[C@@]1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CC1(Cl)Cl ZINC000824772240 1030629911 /nfs/dbraw/zinc/62/99/11/1030629911.db2.gz FQCLDKIZDLCDFF-NSHDSACASA-N 1 1 312.599 3.858 20 10 DHCDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000824715533 1030619974 /nfs/dbraw/zinc/61/99/74/1030619974.db2.gz LFZPAEJHACPSKR-OCCSQVGLSA-N 1 1 300.368 3.915 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000824750603 1030636707 /nfs/dbraw/zinc/63/67/07/1030636707.db2.gz LTLZSEHYCXWYNL-NSHDSACASA-N 1 1 313.800 3.624 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)cc1 ZINC000093507400 1030647711 /nfs/dbraw/zinc/64/77/11/1030647711.db2.gz NUDSMGABMNUNJH-MJGOQNOKSA-N 1 1 302.462 3.534 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccc(F)cc1O ZINC000248526591 1030734367 /nfs/dbraw/zinc/73/43/67/1030734367.db2.gz VAVJYOITHPVARW-HYEYJGRESA-N 1 1 305.393 3.530 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)c(O)c1 ZINC000825215075 1030749449 /nfs/dbraw/zinc/74/94/49/1030749449.db2.gz FYHGBPNBZHRSME-KRWDZBQOSA-N 1 1 307.459 3.510 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)cc1Cl ZINC000825484270 1030841050 /nfs/dbraw/zinc/84/10/50/1030841050.db2.gz JNZPRMXVIJXLMZ-HNNXBMFYSA-N 1 1 316.832 3.814 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1cc(F)cc(F)c1O ZINC000927064662 1031063508 /nfs/dbraw/zinc/06/35/08/1031063508.db2.gz XIBJANXWBCCPSA-BMIGLBTASA-N 1 1 304.340 3.794 20 10 DHCDMO c1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000123654378 1031226730 /nfs/dbraw/zinc/22/67/30/1031226730.db2.gz ITXAOIBKAMNLDV-OAQYLSRUSA-N 1 1 322.452 3.860 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844745709 1031309830 /nfs/dbraw/zinc/30/98/30/1031309830.db2.gz FEQMEKDMPCBLMV-MRXNPFEDSA-N 1 1 304.340 3.562 20 10 DHCDMO C[C@@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccc(F)cc1O ZINC000844927369 1031404190 /nfs/dbraw/zinc/40/41/90/1031404190.db2.gz ZKJDLJLVOKJCFJ-CJNGLKHVSA-N 1 1 314.404 3.999 20 10 DHCDMO CC1CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144298495 1031436817 /nfs/dbraw/zinc/43/68/17/1031436817.db2.gz DTEKXRIQMUHICJ-UHFFFAOYSA-N 1 1 302.187 3.526 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]Cc2ncc(Cl)s2)c2c1c(F)ccc2O ZINC000872114838 1031506614 /nfs/dbraw/zinc/50/66/14/1031506614.db2.gz COPGUYXVUVNQFA-CBAPKCEASA-N 1 1 312.797 3.979 20 10 DHCDMO CC[N@@H+](Cc1c[nH]c2nc(Cl)ccc12)Cc1ccccc1O ZINC001144416485 1031557107 /nfs/dbraw/zinc/55/71/07/1031557107.db2.gz JRZFQTMUJIGYID-UHFFFAOYSA-N 1 1 315.804 3.944 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872260041 1031565796 /nfs/dbraw/zinc/56/57/96/1031565796.db2.gz HBGJZKXPHXMYNK-QGZVFWFLSA-N 1 1 319.445 3.715 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CC[C@H]3CSC[C@H]3C2)c1 ZINC000872721185 1031648774 /nfs/dbraw/zinc/64/87/74/1031648774.db2.gz CVVVSILHDMVGFE-GXTWGEPZSA-N 1 1 321.486 3.580 20 10 DHCDMO C[N@@H+](Cc1cccc2ccccc21)Cc1c(O)cc(O)cc1O ZINC001144509185 1031665503 /nfs/dbraw/zinc/66/55/03/1031665503.db2.gz OGAAPTXIUZOYRC-UHFFFAOYSA-N 1 1 309.365 3.589 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c(C)nn1 ZINC000929972021 1031666095 /nfs/dbraw/zinc/66/60/95/1031666095.db2.gz RBTKGNHFDGRHID-UHFFFAOYSA-N 1 1 323.396 3.594 20 10 DHCDMO Cc1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c(C)nn1 ZINC000929972021 1031666100 /nfs/dbraw/zinc/66/61/00/1031666100.db2.gz RBTKGNHFDGRHID-UHFFFAOYSA-N 1 1 323.396 3.594 20 10 DHCDMO CC(=O)Nc1ccc2c(c1)C[N@H+](Cc1cc(C)cc(C)c1O)CC2 ZINC000872814320 1031667158 /nfs/dbraw/zinc/66/71/58/1031667158.db2.gz ZAWFROHAQXPHHD-UHFFFAOYSA-N 1 1 324.424 3.526 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](C(F)(F)F)O[C@H](C)C2)c1 ZINC000872817451 1031667288 /nfs/dbraw/zinc/66/72/88/1031667288.db2.gz ZTVUEIROEZNXMT-TZMCWYRMSA-N 1 1 317.351 3.551 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)cc1C ZINC000873097430 1031708708 /nfs/dbraw/zinc/70/87/08/1031708708.db2.gz QSQMZAACFMDXQM-AWEZNQCLSA-N 1 1 316.449 3.876 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(N3CCCC3)o2)cc1 ZINC001137070251 1031786573 /nfs/dbraw/zinc/78/65/73/1031786573.db2.gz HIABPFAGGDHCQH-UHFFFAOYSA-N 1 1 313.445 3.578 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCC[C@](O)(c2ccc(Cl)cc2)C1 ZINC000846010865 1031806614 /nfs/dbraw/zinc/80/66/14/1031806614.db2.gz RUUDVSCXMZZESU-GOSISDBHSA-N 1 1 317.816 3.529 20 10 DHCDMO C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000561314781 1031819021 /nfs/dbraw/zinc/81/90/21/1031819021.db2.gz KHOXMEGGSRKDTC-RMKNXTFCSA-N 1 1 323.396 3.560 20 10 DHCDMO CCn1cc(C[N@@H+](Cc2ccc(N(C)C)cc2C)C(C)C)cn1 ZINC000846054507 1031847178 /nfs/dbraw/zinc/84/71/78/1031847178.db2.gz CTTYOZDOHBHHET-UHFFFAOYSA-N 1 1 314.477 3.688 20 10 DHCDMO COc1cccc([C@@H](C)NCCC[N@H+](C)C2CCCCC2)c1O ZINC000846135524 1031900462 /nfs/dbraw/zinc/90/04/62/1031900462.db2.gz DPMMAVPRAUFLGW-OAHLLOKOSA-N 1 1 320.477 3.706 20 10 DHCDMO COc1cccc([C@@H](C)NCCC[N@@H+](C)C2CCCCC2)c1O ZINC000846135524 1031900477 /nfs/dbraw/zinc/90/04/77/1031900477.db2.gz DPMMAVPRAUFLGW-OAHLLOKOSA-N 1 1 320.477 3.706 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccc(F)cc1O ZINC000846188886 1031922760 /nfs/dbraw/zinc/92/27/60/1031922760.db2.gz QSJHFCPTSIASQC-AEFFLSMTSA-N 1 1 307.409 3.777 20 10 DHCDMO CCC1([NH+]2CCCC2)CCN(Cc2cccc(C)c2O)CC1 ZINC000877673234 1033407654 /nfs/dbraw/zinc/40/76/54/1033407654.db2.gz CPZAHEDXTYETCT-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1C ZINC000877674938 1033407790 /nfs/dbraw/zinc/40/77/90/1033407790.db2.gz XMWIZLKMMSSYSE-OALUTQOASA-N 1 1 311.425 3.707 20 10 DHCDMO CCC1([NH+](C)C)CC[NH+](Cc2ccc3ccccc3c2[O-])CC1 ZINC000877689908 1033412491 /nfs/dbraw/zinc/41/24/91/1033412491.db2.gz KYROYAPBYLYPQV-UHFFFAOYSA-N 1 1 312.457 3.852 20 10 DHCDMO Cc1ccc(O)c(CN2CCC(C)([NH+]3CCCCC3)CC2)c1 ZINC000877795699 1033453184 /nfs/dbraw/zinc/45/31/84/1033453184.db2.gz SUTSOBQFHHJETF-UHFFFAOYSA-N 1 1 302.462 3.541 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](C(F)(F)F)CC2)cc1Cl ZINC000877819884 1033470948 /nfs/dbraw/zinc/47/09/48/1033470948.db2.gz BHHDSIFRPCUPQO-CYBMUJFWSA-N 1 1 323.742 3.507 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](C(F)(F)F)CC2)cc1Cl ZINC000877819884 1033470951 /nfs/dbraw/zinc/47/09/51/1033470951.db2.gz BHHDSIFRPCUPQO-CYBMUJFWSA-N 1 1 323.742 3.507 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1OC1CC1 ZINC000862228802 1033787363 /nfs/dbraw/zinc/78/73/63/1033787363.db2.gz XYSKEEPLWWCHMT-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862323428 1033816268 /nfs/dbraw/zinc/81/62/68/1033816268.db2.gz VECSSZOXSFSPFJ-LBPRGKRZSA-N 1 1 305.372 3.619 20 10 DHCDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862323428 1033816284 /nfs/dbraw/zinc/81/62/84/1033816284.db2.gz VECSSZOXSFSPFJ-LBPRGKRZSA-N 1 1 305.372 3.619 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)n(C)n2)cc1 ZINC000927112377 1033829635 /nfs/dbraw/zinc/82/96/35/1033829635.db2.gz NLCTZUMNUPHSQA-CQSZACIVSA-N 1 1 312.461 3.604 20 10 DHCDMO CN(C)c1ccc(Cn2c[nH+]c3c2CCCC3)c(C(F)(F)F)c1 ZINC000862432215 1033849448 /nfs/dbraw/zinc/84/94/48/1033849448.db2.gz VQDYZSSMEPQXQV-UHFFFAOYSA-N 1 1 323.362 3.895 20 10 DHCDMO Cc1ccc(O)c(CNC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000862476022 1033863407 /nfs/dbraw/zinc/86/34/07/1033863407.db2.gz FKTLCVZLANMLCE-DNVCBOLYSA-N 1 1 316.489 3.833 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCc3c(O)cccc3C2)cc1 ZINC000862530278 1033875512 /nfs/dbraw/zinc/87/55/12/1033875512.db2.gz YMEUJPURWQWDOS-PLNGDYQASA-N 1 1 308.425 3.530 20 10 DHCDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(F)ccc3O)C2)cc1F ZINC000862541381 1033881515 /nfs/dbraw/zinc/88/15/15/1033881515.db2.gz PVLXEBXCLVQLMQ-CYBMUJFWSA-N 1 1 319.351 3.669 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3C[C@H](C)[C@H](C)[C@@H]3C)cc2)CC1 ZINC000842163105 1034219491 /nfs/dbraw/zinc/21/94/91/1034219491.db2.gz JZXSWYSVEPEGLB-ULQDDVLXSA-N 1 1 316.489 3.778 20 10 DHCDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185143163 1034531183 /nfs/dbraw/zinc/53/11/83/1034531183.db2.gz IIKFFDMZKQOIHZ-LBPRGKRZSA-N 1 1 304.365 3.566 20 10 DHCDMO C[C@@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000185737643 1034570817 /nfs/dbraw/zinc/57/08/17/1034570817.db2.gz RETCEYUXWAIXCX-YCPHGPKFSA-N 1 1 317.404 3.737 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccc(F)cc1O ZINC000186009348 1034592500 /nfs/dbraw/zinc/59/25/00/1034592500.db2.gz MJMSFZAGUZCGQG-BMIGLBTASA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1[O-] ZINC000186518271 1034637411 /nfs/dbraw/zinc/63/74/11/1034637411.db2.gz UGACFSIQHDCTFH-RRFJBIMHSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518940 1034638590 /nfs/dbraw/zinc/63/85/90/1034638590.db2.gz FPQLFRJDJAAAKD-RRFJBIMHSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1[O-] ZINC000186518940 1034638599 /nfs/dbraw/zinc/63/85/99/1034638599.db2.gz FPQLFRJDJAAAKD-RRFJBIMHSA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cc(F)ccc1O ZINC000186819458 1034662679 /nfs/dbraw/zinc/66/26/79/1034662679.db2.gz APXZDULMSLPUIZ-LLVKDONJSA-N 1 1 322.380 3.685 20 10 DHCDMO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)on1 ZINC000192830717 1034817669 /nfs/dbraw/zinc/81/76/69/1034817669.db2.gz MRESCJYAOBVXQB-MRVPVSSYSA-N 1 1 301.173 3.846 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+]Cc1ccccc1F ZINC000042411689 1035118757 /nfs/dbraw/zinc/11/87/57/1035118757.db2.gz JVLNMODFWJZWDS-UHFFFAOYSA-N 1 1 310.166 3.584 20 10 DHCDMO C[C@H]([NH2+]Cc1nccc2c1CCCC2)c1cc(F)cc(F)c1O ZINC000903182615 1035287689 /nfs/dbraw/zinc/28/76/89/1035287689.db2.gz SSHDSQGVHOMKSS-NSHDSACASA-N 1 1 318.367 3.795 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCC3(CCOCC3)C2)cc1 ZINC000773752886 1035437748 /nfs/dbraw/zinc/43/77/48/1035437748.db2.gz KTMVFZNNKDNTTB-UHFFFAOYSA-N 1 1 302.462 3.535 20 10 DHCDMO COC[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232385 1035452830 /nfs/dbraw/zinc/45/28/30/1035452830.db2.gz BSWWYKPKSJVHMV-QGZVFWFLSA-N 1 1 312.457 3.907 20 10 DHCDMO CC(C)[C@H]1COCC[N@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204240411 1035469109 /nfs/dbraw/zinc/46/91/09/1035469109.db2.gz RPAYBJFXWCTIFF-HXUWFJFHSA-N 1 1 312.457 3.763 20 10 DHCDMO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958403 1035562231 /nfs/dbraw/zinc/56/22/31/1035562231.db2.gz ZNGPGHSFFAXTKP-ZBFHGGJFSA-N 1 1 315.816 3.820 20 10 DHCDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958403 1035562248 /nfs/dbraw/zinc/56/22/48/1035562248.db2.gz ZNGPGHSFFAXTKP-ZBFHGGJFSA-N 1 1 315.816 3.820 20 10 DHCDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180097117 1035574471 /nfs/dbraw/zinc/57/44/71/1035574471.db2.gz BDNIAPMXXMYMCO-CYBMUJFWSA-N 1 1 316.395 3.978 20 10 DHCDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180097117 1035574488 /nfs/dbraw/zinc/57/44/88/1035574488.db2.gz BDNIAPMXXMYMCO-CYBMUJFWSA-N 1 1 316.395 3.978 20 10 DHCDMO Oc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(O)c1 ZINC001204278876 1035742199 /nfs/dbraw/zinc/74/21/99/1035742199.db2.gz LKPRIOIIPQAEEY-UHFFFAOYSA-N 1 1 323.314 3.675 20 10 DHCDMO Oc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(O)c1 ZINC001204278876 1035742216 /nfs/dbraw/zinc/74/22/16/1035742216.db2.gz LKPRIOIIPQAEEY-UHFFFAOYSA-N 1 1 323.314 3.675 20 10 DHCDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)Cc1ccc(O)cc1O ZINC001204279374 1035753720 /nfs/dbraw/zinc/75/37/20/1035753720.db2.gz WQVHIOWWLDQXNC-UHFFFAOYSA-N 1 1 315.489 3.977 20 10 DHCDMO CCc1cc(C[N@@H+]2CC[C@@H](CN(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144265 1035768216 /nfs/dbraw/zinc/76/82/16/1035768216.db2.gz ZWLAMTJYIIWUJM-INIZCTEOSA-N 1 1 318.505 3.636 20 10 DHCDMO CCc1cc(C[N@H+]2CC[C@@H](CN(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144265 1035768227 /nfs/dbraw/zinc/76/82/27/1035768227.db2.gz ZWLAMTJYIIWUJM-INIZCTEOSA-N 1 1 318.505 3.636 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2O)CCC1(F)F ZINC001233452425 1036009699 /nfs/dbraw/zinc/00/96/99/1036009699.db2.gz WDQWSJUDGXDONV-SECBINFHSA-N 1 1 309.278 3.888 20 10 DHCDMO CC(C)[C@@H](CO)[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)C(C)C ZINC001181891535 1036035911 /nfs/dbraw/zinc/03/59/11/1036035911.db2.gz BJPSTHZRNNUFKS-WBMJQRKESA-N 1 1 317.832 3.563 20 10 DHCDMO CCc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)[nH]n1 ZINC000774187765 1036214806 /nfs/dbraw/zinc/21/48/06/1036214806.db2.gz HCLLDCAYHIFGOI-MRVPVSSYSA-N 1 1 314.216 3.835 20 10 DHCDMO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCC[C@@H]1C ZINC001195358061 1036227421 /nfs/dbraw/zinc/22/74/21/1036227421.db2.gz KCKWXYFIFGUPRR-HOTGVXAUSA-N 1 1 319.445 3.584 20 10 DHCDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1(CC)CC ZINC001204335834 1036252394 /nfs/dbraw/zinc/25/23/94/1036252394.db2.gz XMDUBUCTRAMKHR-MSOLQXFVSA-N 1 1 321.461 3.816 20 10 DHCDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cccc(C)c2O)c1 ZINC000775659994 1036268757 /nfs/dbraw/zinc/26/87/57/1036268757.db2.gz QVTJYLQOKGWCEQ-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO C[C@@H]([NH2+][C@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774266304 1036270278 /nfs/dbraw/zinc/27/02/78/1036270278.db2.gz NEJJTIXEQZPUGK-SCZZXKLOSA-N 1 1 304.217 3.511 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)CCc2ccc(Cl)cc2)c1 ZINC000775665870 1036292404 /nfs/dbraw/zinc/29/24/04/1036292404.db2.gz MKCDEVXBPNEKCD-UHFFFAOYSA-N 1 1 305.805 3.729 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)Cc2cc(C)c(OC)c(C)c2)c1 ZINC000775671155 1036330613 /nfs/dbraw/zinc/33/06/13/1036330613.db2.gz WTABQKBVZVJZKT-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2cc(F)c(F)cc2O)CC2CC2)cn1 ZINC001182556791 1036374195 /nfs/dbraw/zinc/37/41/95/1036374195.db2.gz ZYHQKXWPDKLQDZ-UHFFFAOYSA-N 1 1 318.367 3.786 20 10 DHCDMO Cc1ccc(C[N@H+](Cc2cc(F)c(F)cc2O)CC2CC2)cn1 ZINC001182556791 1036374214 /nfs/dbraw/zinc/37/42/14/1036374214.db2.gz ZYHQKXWPDKLQDZ-UHFFFAOYSA-N 1 1 318.367 3.786 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1O ZINC000775676296 1036401214 /nfs/dbraw/zinc/40/12/14/1036401214.db2.gz PQIWMDBTJDQOPQ-INIZCTEOSA-N 1 1 311.381 3.766 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000775699138 1036474419 /nfs/dbraw/zinc/47/44/19/1036474419.db2.gz ZZRIALIPMZCJDS-GOSISDBHSA-N 1 1 315.438 3.691 20 10 DHCDMO Cc1cccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1O ZINC000775713731 1036523997 /nfs/dbraw/zinc/52/39/97/1036523997.db2.gz MBZLWCMWSHCZSV-APWZRJJASA-N 1 1 311.425 3.971 20 10 DHCDMO C[N@@H+](Cc1ccc(F)c(Cl)c1)Cc1cc2c(cc1O)OCO2 ZINC000762118536 1036530270 /nfs/dbraw/zinc/53/02/70/1036530270.db2.gz HOSQNXHNHXJBIF-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)c1 ZINC000775727010 1036571614 /nfs/dbraw/zinc/57/16/14/1036571614.db2.gz DYSSNWJNUGZTFO-CJNGLKHVSA-N 1 1 301.386 3.967 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC001183671409 1036645805 /nfs/dbraw/zinc/64/58/05/1036645805.db2.gz HTWYYCVIPPXIFA-HNNXBMFYSA-N 1 1 300.368 3.835 20 10 DHCDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(O)cccc1F ZINC001183919792 1036710866 /nfs/dbraw/zinc/71/08/66/1036710866.db2.gz QAVHCSFQFLGAIB-LBPRGKRZSA-N 1 1 318.348 3.550 20 10 DHCDMO COCc1ccccc1/C=C(\C)C[NH2+]Cc1c(O)cccc1F ZINC001183919603 1036712923 /nfs/dbraw/zinc/71/29/23/1036712923.db2.gz MQTALVXBELFLHC-GXDHUFHOSA-N 1 1 315.388 3.871 20 10 DHCDMO C[C@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1ccc(N(C)C)cc1 ZINC000775834577 1036994830 /nfs/dbraw/zinc/99/48/30/1036994830.db2.gz VBTZPVNDAQEZDM-AWEZNQCLSA-N 1 1 322.412 3.653 20 10 DHCDMO CCC[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1ccccc1O ZINC000774869555 1037127542 /nfs/dbraw/zinc/12/75/42/1037127542.db2.gz MAAWIOJZFHFEDD-UHFFFAOYSA-N 1 1 322.449 3.519 20 10 DHCDMO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911344 1037206174 /nfs/dbraw/zinc/20/61/74/1037206174.db2.gz YYSFZFKMVLZCNE-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774911344 1037206189 /nfs/dbraw/zinc/20/61/89/1037206189.db2.gz YYSFZFKMVLZCNE-TZMCWYRMSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[NH2+]C2CCCCCCC2)ccc1[N+](=O)[O-] ZINC000774941485 1037246541 /nfs/dbraw/zinc/24/65/41/1037246541.db2.gz AEMRNHMFPAZAFX-UHFFFAOYSA-N 1 1 308.378 3.512 20 10 DHCDMO CCCOc1ccc(CNC[C@H](C)C[NH+]2CCCCC2)cc1C ZINC001199580932 1037284908 /nfs/dbraw/zinc/28/49/08/1037284908.db2.gz DDPKHNREEYDQJM-KRWDZBQOSA-N 1 1 318.505 3.995 20 10 DHCDMO CCC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CCCCC1 ZINC000775068212 1037544235 /nfs/dbraw/zinc/54/42/35/1037544235.db2.gz ICCBLLZTZVVUPH-UHFFFAOYSA-N 1 1 322.405 3.759 20 10 DHCDMO Cc1ccc(F)c(C[NH2+]Cc2cccc(Br)c2O)c1 ZINC000775153924 1037753812 /nfs/dbraw/zinc/75/38/12/1037753812.db2.gz WSHWAJBTVQQXAK-UHFFFAOYSA-N 1 1 324.193 3.892 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccsc2)c1 ZINC000800985081 1037995983 /nfs/dbraw/zinc/99/59/83/1037995983.db2.gz LJFXRZNCCOICQL-QWRGUYRKSA-N 1 1 305.399 3.652 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c1O ZINC000164519595 1038204876 /nfs/dbraw/zinc/20/48/76/1038204876.db2.gz NNGGTWXODICKPM-QGZVFWFLSA-N 1 1 312.413 3.750 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[C@@H](C2CC2)O1 ZINC001190436878 1038315573 /nfs/dbraw/zinc/31/55/73/1038315573.db2.gz NEQHTNCQBCSMSK-UXHICEINSA-N 1 1 316.489 3.921 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)Cc1cc(C)[nH]n1)c1cc(Cl)ccc1O ZINC000775522632 1038632326 /nfs/dbraw/zinc/63/23/26/1038632326.db2.gz WIXXXSZYAFOYIZ-BONVTDFDSA-N 1 1 307.825 3.749 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)Cc1cc(C)[nH]n1)c1cc(Cl)ccc1O ZINC000775522634 1038633638 /nfs/dbraw/zinc/63/36/38/1038633638.db2.gz WIXXXSZYAFOYIZ-ZUZCIYMTSA-N 1 1 307.825 3.749 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000172484952 1039918876 /nfs/dbraw/zinc/91/88/76/1039918876.db2.gz MGQZZQYPUZTVAT-KRWDZBQOSA-N 1 1 310.441 3.606 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2C)c1O ZINC000761184104 1040493864 /nfs/dbraw/zinc/49/38/64/1040493864.db2.gz PYZLYBIKERPUSI-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCS[C@@H](C(C)C)C2)c1O ZINC000761203797 1040576773 /nfs/dbraw/zinc/57/67/73/1040576773.db2.gz MGRPVKLFYPFLLL-CQSZACIVSA-N 1 1 315.866 3.628 20 10 DHCDMO Nc1ccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1 ZINC001120370988 1040603416 /nfs/dbraw/zinc/60/34/16/1040603416.db2.gz LUQGRFPNQISXIA-INIZCTEOSA-N 1 1 302.443 3.512 20 10 DHCDMO CCC[N@@H+](CCCC(=O)OC(C)(C)C)Cc1ccccc1O ZINC000784164800 1040689423 /nfs/dbraw/zinc/68/94/23/1040689423.db2.gz XPBJWGXCVXPLKT-UHFFFAOYSA-N 1 1 307.434 3.726 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1 ZINC000761226273 1040817690 /nfs/dbraw/zinc/81/76/90/1040817690.db2.gz NRXSMWVYHMTCQO-NRFANRHFSA-N 1 1 324.468 3.526 20 10 DHCDMO CC[N@@H+](Cc1cc(C)ccc1O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000761226949 1040819743 /nfs/dbraw/zinc/81/97/43/1040819743.db2.gz XWSMKNMXYIZXJE-HXUWFJFHSA-N 1 1 324.468 3.797 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(OCC)ccc2O)CC1 ZINC000093317578 193230908 /nfs/dbraw/zinc/23/09/08/193230908.db2.gz DCMFKXVOVWBJRO-MRXNPFEDSA-N 1 1 307.434 3.572 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@H+](Cc2cccc(F)c2O)C1 ZINC000272226426 130010111 /nfs/dbraw/zinc/01/01/11/130010111.db2.gz CZFYISMDOWKFSF-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cccc(F)c2O)C1 ZINC000272226426 130010113 /nfs/dbraw/zinc/01/01/13/130010113.db2.gz CZFYISMDOWKFSF-CYBMUJFWSA-N 1 1 301.361 3.529 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1[N+](=O)[O-] ZINC000273533384 130133720 /nfs/dbraw/zinc/13/37/20/130133720.db2.gz WVRSSGFZYVQJJB-MNOVXSKESA-N 1 1 304.321 3.851 20 10 DHCDMO Cc1noc([C@@H]2CCC[N@H+]2Cc2c(O)ccc3ccccc32)n1 ZINC000285206620 131147517 /nfs/dbraw/zinc/14/75/17/131147517.db2.gz SZDXLKGQHYWXIF-INIZCTEOSA-N 1 1 309.369 3.574 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(OC(C)C)nc1)c1ccc(F)cc1O ZINC000285600016 131185230 /nfs/dbraw/zinc/18/52/30/131185230.db2.gz JSNHDLNIZVHQAS-MRXNPFEDSA-N 1 1 318.392 3.954 20 10 DHCDMO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(F)cc1O ZINC000285986891 131214098 /nfs/dbraw/zinc/21/40/98/131214098.db2.gz HWWVAPKCJWFLPP-HUUCEWRRSA-N 1 1 307.365 3.861 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](O)c1ccccc1C)c1ccc(F)cc1O ZINC000286234940 131225631 /nfs/dbraw/zinc/22/56/31/131225631.db2.gz SZDDIFDFQOMKLV-AEFFLSMTSA-N 1 1 303.377 3.614 20 10 DHCDMO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286301674 131229091 /nfs/dbraw/zinc/22/90/91/131229091.db2.gz WRWOPRPENIBIJQ-DLBZAZTESA-N 1 1 303.377 3.696 20 10 DHCDMO COC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000293545088 131744884 /nfs/dbraw/zinc/74/48/84/131744884.db2.gz GJVDNMASQALJOV-HNNXBMFYSA-N 1 1 309.768 3.662 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccc(F)cc1O ZINC000296608784 131975741 /nfs/dbraw/zinc/97/57/41/131975741.db2.gz WEIBGVIEJGIDFG-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2csc(C(C)(C)C)n2)cc1 ZINC000067184691 333447635 /nfs/dbraw/zinc/44/76/35/333447635.db2.gz FGWUNRHNEQTGFZ-UHFFFAOYSA-N 1 1 303.475 3.796 20 10 DHCDMO C[C@H](CCCO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296603855 335145184 /nfs/dbraw/zinc/14/51/84/335145184.db2.gz VUBRYISNAHBVKN-ZJUUUORDSA-N 1 1 306.233 3.758 20 10 DHCDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)c2O)no1 ZINC000375018898 337001657 /nfs/dbraw/zinc/00/16/57/337001657.db2.gz KCDDSDYPXZNIMH-OAHLLOKOSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)no1 ZINC000375018898 337001658 /nfs/dbraw/zinc/00/16/58/337001658.db2.gz KCDDSDYPXZNIMH-OAHLLOKOSA-N 1 1 306.793 3.988 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1O ZINC000375531173 337012984 /nfs/dbraw/zinc/01/29/84/337012984.db2.gz ZPMLVTZMZIMWRM-SCTDSRPQSA-N 1 1 303.446 3.606 20 10 DHCDMO COc1ccc(O)c([C@H](C)[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)c1 ZINC000377624214 337056656 /nfs/dbraw/zinc/05/66/56/337056656.db2.gz KLRJKGFPUHMXEH-GLJUWKHASA-N 1 1 312.413 3.940 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000377631066 337056774 /nfs/dbraw/zinc/05/67/74/337056774.db2.gz SLSNMOQQJSVHPC-HIFRSBDPSA-N 1 1 317.351 3.623 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1C ZINC000184807835 337200226 /nfs/dbraw/zinc/20/02/26/337200226.db2.gz JLHWZUMLTSVZHE-FQEVSTJZSA-N 1 1 309.409 3.640 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1ccc(F)cc1O ZINC000527953272 337774154 /nfs/dbraw/zinc/77/41/54/337774154.db2.gz VUDDYGGLBMFEML-CZUORRHYSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000528006714 337782977 /nfs/dbraw/zinc/78/29/77/337782977.db2.gz NRKYHXMRXUQDJI-SEKJGCFDSA-N 1 1 317.351 3.874 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccs2)cc1OC ZINC000159492164 522772888 /nfs/dbraw/zinc/77/28/88/522772888.db2.gz QCTILEHSDBGEDQ-CYBMUJFWSA-N 1 1 319.426 3.808 20 10 DHCDMO COc1cc(O)c(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)cc1OC ZINC000160316346 522779296 /nfs/dbraw/zinc/77/92/96/522779296.db2.gz NXKCXBGIRSSWCL-YJYMSZOUSA-N 1 1 313.397 3.602 20 10 DHCDMO Cn1cc(C[N@@H+](C)Cc2ccccc2O)c(C2CCCCC2)n1 ZINC000183005696 523491458 /nfs/dbraw/zinc/49/14/58/523491458.db2.gz LQEBPAQFGUWRKG-UHFFFAOYSA-N 1 1 313.445 3.805 20 10 DHCDMO Cc1cc(N2CC=C(c3cncc4ccccc43)CC2)nc(C)[nH+]1 ZINC000365027481 525053437 /nfs/dbraw/zinc/05/34/37/525053437.db2.gz OVJNICVPORDFAT-UHFFFAOYSA-N 1 1 316.408 3.935 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000180257717 526348576 /nfs/dbraw/zinc/34/85/76/526348576.db2.gz SAVNRMAIKCAMNX-HOCLYGCPSA-N 1 1 321.417 3.681 20 10 DHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc(Cl)c2[O-])C1 ZINC000287753857 534948773 /nfs/dbraw/zinc/94/87/73/534948773.db2.gz QMGBDPASPOCDSI-XJKSGUPXSA-N 1 1 310.869 3.818 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2noc3c2CCCC3)cc1 ZINC000288571177 535687013 /nfs/dbraw/zinc/68/70/13/535687013.db2.gz ZSJBUQKLIVIYIF-UHFFFAOYSA-N 1 1 313.445 3.689 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccc(F)cc1O ZINC000286128826 535804394 /nfs/dbraw/zinc/80/43/94/535804394.db2.gz OKXFKLQFQPKVJD-CRAIPNDOSA-N 1 1 317.404 3.738 20 10 DHCDMO COCC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)c1ccc(C)o1 ZINC000273478305 536809516 /nfs/dbraw/zinc/80/95/16/536809516.db2.gz TZDSSGKSFYJQQY-IUODEOHRSA-N 1 1 307.365 3.861 20 10 DHCDMO Cc1ccc(C[NH2+]Cc2cccc(Br)c2O)cc1 ZINC000042411716 1013197779 /nfs/dbraw/zinc/19/77/79/1013197779.db2.gz LEBMJSWRQJECOO-UHFFFAOYSA-N 1 1 306.203 3.753 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(OC)c2O)cc1 ZINC000155149814 1013244157 /nfs/dbraw/zinc/24/41/57/1013244157.db2.gz XZZWJJBYGYMZNT-KRWDZBQOSA-N 1 1 313.397 3.747 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000894491208 1013387706 /nfs/dbraw/zinc/38/77/06/1013387706.db2.gz LESNXOYQGBYNSA-YPMHNXCESA-N 1 1 317.351 3.872 20 10 DHCDMO [O-]c1c(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)ccc2ccccc21 ZINC001204743063 1013391947 /nfs/dbraw/zinc/39/19/47/1013391947.db2.gz ZJSYUYXOEFFKGK-UHFFFAOYSA-N 1 1 310.441 3.511 20 10 DHCDMO [O-]c1c(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)ccc2ccccc21 ZINC001204743063 1013391953 /nfs/dbraw/zinc/39/19/53/1013391953.db2.gz ZJSYUYXOEFFKGK-UHFFFAOYSA-N 1 1 310.441 3.511 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)c2nnc(C)[nH]2)cc1 ZINC000894771823 1013481480 /nfs/dbraw/zinc/48/14/80/1013481480.db2.gz XPEUTVZBSXDNAZ-AWEZNQCLSA-N 1 1 315.465 3.590 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2nccs2)cc1F ZINC000093843864 1013514954 /nfs/dbraw/zinc/51/49/54/1013514954.db2.gz OIAOEHSGAMVPIF-UHFFFAOYSA-N 1 1 321.465 3.803 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cnc(Cl)c(F)c2)cc1 ZINC000846771465 1032077299 /nfs/dbraw/zinc/07/72/99/1032077299.db2.gz KABSQTQMYZVMLK-UHFFFAOYSA-N 1 1 307.800 3.572 20 10 DHCDMO CCCCOC(=O)[C@H](C)[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC001167353750 1014032134 /nfs/dbraw/zinc/03/21/34/1014032134.db2.gz NWTDTESJRWCAOA-HNNXBMFYSA-N 1 1 319.445 3.869 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c(O)cc1C ZINC000160435477 1014068262 /nfs/dbraw/zinc/06/82/62/1014068262.db2.gz ACXBKGLLHLOUJW-KRWDZBQOSA-N 1 1 312.413 3.750 20 10 DHCDMO C[C@H]([NH2+]C1CC(F)(F)C1)c1cc(Br)c(F)cc1O ZINC000760037860 1014266729 /nfs/dbraw/zinc/26/67/29/1014266729.db2.gz JIDIWXXNXGZUAA-LURJTMIESA-N 1 1 324.140 3.742 20 10 DHCDMO CCC[N@@H+](Cc1cnc(Cl)c(F)c1)Cc1ccccc1O ZINC000846810679 1032089851 /nfs/dbraw/zinc/08/98/51/1032089851.db2.gz ZUEVGJUGVUHKKC-UHFFFAOYSA-N 1 1 308.784 3.992 20 10 DHCDMO COc1ccc(C[N@H+]2CCCC[C@H]2C2CCC2)c(O)c1OC ZINC000895126143 1014486169 /nfs/dbraw/zinc/48/61/69/1014486169.db2.gz VOUGFADGCSCYBW-HNNXBMFYSA-N 1 1 305.418 3.564 20 10 DHCDMO Oc1cccc(Br)c1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000707129662 1015085652 /nfs/dbraw/zinc/08/56/52/1015085652.db2.gz ORWUPFJJXVHIQG-TXEJJXNPSA-N 1 1 310.235 3.777 20 10 DHCDMO Oc1cccc(Br)c1C[N@H+]1CCc2ccccc2C1 ZINC000707157684 1015133872 /nfs/dbraw/zinc/13/38/72/1015133872.db2.gz ORWRCKHMEBTUSL-UHFFFAOYSA-N 1 1 318.214 3.713 20 10 DHCDMO C[C@@H]([NH2+]Cc1csc(C(F)(F)F)n1)c1ccccc1O ZINC000895850951 1015333771 /nfs/dbraw/zinc/33/37/71/1015333771.db2.gz HBZLLZTYRJBLJK-MRVPVSSYSA-N 1 1 302.321 3.718 20 10 DHCDMO COc1ccc(C[N@@H+](C)[C@H]2CCc3ccccc32)c(O)c1OC ZINC000891558230 1015388677 /nfs/dbraw/zinc/38/86/77/1015388677.db2.gz BNPHSMNDKHLCLD-INIZCTEOSA-N 1 1 313.397 3.529 20 10 DHCDMO C[N@@H+](Cc1cnc(CC(F)(F)F)s1)Cc1ccccc1O ZINC000891714322 1015563169 /nfs/dbraw/zinc/56/31/69/1015563169.db2.gz WLNLZYIATIQXJU-UHFFFAOYSA-N 1 1 316.348 3.586 20 10 DHCDMO CCc1nnc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)s1 ZINC000290285923 1015634482 /nfs/dbraw/zinc/63/44/82/1015634482.db2.gz XOSHXKGDEQNVTO-NSHDSACASA-N 1 1 313.426 3.810 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000896608660 1015676987 /nfs/dbraw/zinc/67/69/87/1015676987.db2.gz HRNBZRZOBPWEJQ-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+](C)Cc2nc(C)cs2)cc1 ZINC000176318698 1015992875 /nfs/dbraw/zinc/99/28/75/1015992875.db2.gz GPASXJIXKHEPSO-UHFFFAOYSA-N 1 1 303.475 3.930 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2nc(C)cs2)cc1 ZINC000176318698 1015992878 /nfs/dbraw/zinc/99/28/78/1015992878.db2.gz GPASXJIXKHEPSO-UHFFFAOYSA-N 1 1 303.475 3.930 20 10 DHCDMO COc1ccccc1O[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185580014 1017029028 /nfs/dbraw/zinc/02/90/28/1017029028.db2.gz PCXJHBLLOBOABQ-QWHCGFSZSA-N 1 1 319.376 3.658 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CC[C@H](C)[C@H]3C)cc2)CC1 ZINC000294960564 1032226941 /nfs/dbraw/zinc/22/69/41/1032226941.db2.gz KXTYABFLRMSRRS-JKSUJKDBSA-N 1 1 302.462 3.532 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC(C)(C)C3)cc2)CC1 ZINC000295032352 1032249498 /nfs/dbraw/zinc/24/94/98/1032249498.db2.gz NEXABNZOPMLHMT-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO CC[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccc(C)cc1O ZINC000295098207 1032273546 /nfs/dbraw/zinc/27/35/46/1032273546.db2.gz VQLWBOZTMKWHGK-KRWDZBQOSA-N 1 1 322.412 3.522 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CCC(=O)OC(C)C ZINC001172762135 1033355194 /nfs/dbraw/zinc/35/51/94/1033355194.db2.gz IHHFXTXQJIUNSG-MRXNPFEDSA-N 1 1 320.477 3.695 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCO[C@H](c3ccccc3)C1)CCC2 ZINC000729851304 1032600730 /nfs/dbraw/zinc/60/07/30/1032600730.db2.gz JRBIACMIKOUOCM-NRFANRHFSA-N 1 1 323.436 3.845 20 10 DHCDMO CC(=O)c1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2)c1O ZINC000050132558 1017117618 /nfs/dbraw/zinc/11/76/18/1017117618.db2.gz GIANKZFYUMCADY-UHFFFAOYSA-N 1 1 303.789 3.880 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c(Cl)c1 ZINC000840921530 1017483326 /nfs/dbraw/zinc/48/33/26/1017483326.db2.gz VEVKZOLFICSJRA-ZIAGYGMSSA-N 1 1 309.837 3.603 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000186142710 1017931113 /nfs/dbraw/zinc/93/11/13/1017931113.db2.gz ZVZWISOMFRWSIT-LSDHHAIUSA-N 1 1 308.441 3.550 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000186142710 1017931124 /nfs/dbraw/zinc/93/11/24/1017931124.db2.gz ZVZWISOMFRWSIT-LSDHHAIUSA-N 1 1 308.441 3.550 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000186142710 1017931128 /nfs/dbraw/zinc/93/11/28/1017931128.db2.gz ZVZWISOMFRWSIT-LSDHHAIUSA-N 1 1 308.441 3.550 20 10 DHCDMO Oc1cccc(F)c1C[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC001137833277 1018210758 /nfs/dbraw/zinc/21/07/58/1018210758.db2.gz ZHUDTFXQZGWLBJ-UHFFFAOYSA-N 1 1 320.795 3.507 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171544167 1032756846 /nfs/dbraw/zinc/75/68/46/1032756846.db2.gz RLYGUTZPKYMWJL-CYBMUJFWSA-N 1 1 321.342 3.799 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2c(F)ccc(F)c2Cl)cc1 ZINC000858088529 1032761336 /nfs/dbraw/zinc/76/13/36/1032761336.db2.gz IGTMXIFPPSZGFL-UHFFFAOYSA-N 1 1 310.775 3.974 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+]Cc2ccc(F)cc2F)cc1F ZINC000858116060 1032774828 /nfs/dbraw/zinc/77/48/28/1032774828.db2.gz NMFSSSCVKMFJFM-UHFFFAOYSA-N 1 1 312.310 3.599 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1F ZINC000858129721 1032773602 /nfs/dbraw/zinc/77/36/02/1032773602.db2.gz PJEAPFUPIPNSID-UHFFFAOYSA-N 1 1 320.358 3.949 20 10 DHCDMO Cc1cccc(F)c1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858147145 1032780511 /nfs/dbraw/zinc/78/05/11/1032780511.db2.gz WYIJMKATRRDGNP-UHFFFAOYSA-N 1 1 308.347 3.768 20 10 DHCDMO C[C@@H](N[C@@H](C)C[N@@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765303383 1018748668 /nfs/dbraw/zinc/74/86/68/1018748668.db2.gz ZZTICWCCMSQGKH-IXDOHACOSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@@H](N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000765303383 1018748676 /nfs/dbraw/zinc/74/86/76/1018748676.db2.gz ZZTICWCCMSQGKH-IXDOHACOSA-N 1 1 303.494 3.524 20 10 DHCDMO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)CC2CC2)cn1 ZINC000765583436 1018958275 /nfs/dbraw/zinc/95/82/75/1018958275.db2.gz LQJONHLUPILSQV-UHFFFAOYSA-N 1 1 309.457 3.868 20 10 DHCDMO C[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)COCc1ccccc1 ZINC000708517355 1019097373 /nfs/dbraw/zinc/09/73/73/1019097373.db2.gz OAXLUBXTWPHIFY-CYBMUJFWSA-N 1 1 321.367 3.613 20 10 DHCDMO C[C@@H]([NH2+]CC1(C)OCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000278730939 1019104719 /nfs/dbraw/zinc/10/47/19/1019104719.db2.gz MTZBBBMPUVBBKB-SECBINFHSA-N 1 1 320.216 3.503 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)CC[C@]1(C)O ZINC001143103340 1019359173 /nfs/dbraw/zinc/35/91/73/1019359173.db2.gz AMGNUBVMWZKRNJ-LIRRHRJNSA-N 1 1 305.462 3.673 20 10 DHCDMO CC[N@H+](CCN1CCCC1)Cc1cccc(C(C)(C)C)c1O ZINC001143110542 1019396283 /nfs/dbraw/zinc/39/62/83/1019396283.db2.gz IQGWKTIXALCWMB-UHFFFAOYSA-N 1 1 304.478 3.607 20 10 DHCDMO CC[N@@H+](CCN1CCCC1)Cc1cccc(C(C)(C)C)c1O ZINC001143110542 1019396295 /nfs/dbraw/zinc/39/62/95/1019396295.db2.gz IQGWKTIXALCWMB-UHFFFAOYSA-N 1 1 304.478 3.607 20 10 DHCDMO CCn1ccnc1C[NH2+]Cc1cc(C)n(-c2cccc(C)c2)c1C ZINC000858292741 1032832410 /nfs/dbraw/zinc/83/24/10/1032832410.db2.gz DUZFSYYZNQLIQQ-UHFFFAOYSA-N 1 1 322.456 3.909 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000170789538 1019433841 /nfs/dbraw/zinc/43/38/41/1019433841.db2.gz JBASYHLQBAKUDM-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000170789270 1019435284 /nfs/dbraw/zinc/43/52/84/1019435284.db2.gz AKMDHHOTHDOSQR-VXGBXAGGSA-N 1 1 319.376 3.960 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1O ZINC000170789543 1019437547 /nfs/dbraw/zinc/43/75/47/1019437547.db2.gz JBASYHLQBAKUDM-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccc2nccnc2c1 ZINC001137091156 1032858340 /nfs/dbraw/zinc/85/83/40/1032858340.db2.gz NTLFWPLMLHAKBM-UHFFFAOYSA-N 1 1 320.440 3.718 20 10 DHCDMO CCC[N@H+](Cc1c(O)ccc2ccncc21)C[C@@H]1CCCCO1 ZINC000730256022 1019969763 /nfs/dbraw/zinc/96/97/63/1019969763.db2.gz QRYCSLXZYOWERJ-INIZCTEOSA-N 1 1 314.429 3.722 20 10 DHCDMO Fc1ccc2c(c1)onc2C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922319064 1019995458 /nfs/dbraw/zinc/99/54/58/1019995458.db2.gz VEGWBBCJNMOXBT-UHFFFAOYSA-N 1 1 312.344 3.582 20 10 DHCDMO CCOCC[N@@H+](CC)Cc1c2c(ccc1O)oc1c2CCCC1 ZINC000730801898 1020027464 /nfs/dbraw/zinc/02/74/64/1020027464.db2.gz RGMMUTIOWPCXND-UHFFFAOYSA-N 1 1 317.429 3.876 20 10 DHCDMO Oc1c(Br)cccc1C[NH2+]C1(c2ccccc2)CC1 ZINC000731677903 1020135954 /nfs/dbraw/zinc/13/59/54/1020135954.db2.gz BOYXVHNECVXFCE-UHFFFAOYSA-N 1 1 318.214 3.934 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1F ZINC000922582714 1020142248 /nfs/dbraw/zinc/14/22/48/1020142248.db2.gz QGBFHJCWFCDMEO-GOSISDBHSA-N 1 1 317.383 3.667 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCN(Cc3ccccc3)C[C@H]2C)cc1C ZINC000732187503 1020206796 /nfs/dbraw/zinc/20/67/96/1020206796.db2.gz OERNBMDOHRBVEE-GOSISDBHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000732187503 1020206801 /nfs/dbraw/zinc/20/68/01/1020206801.db2.gz OERNBMDOHRBVEE-GOSISDBHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000732187503 1020206811 /nfs/dbraw/zinc/20/68/11/1020206811.db2.gz OERNBMDOHRBVEE-GOSISDBHSA-N 1 1 324.468 3.715 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)Cc2cccc(OC)n2)cc1 ZINC000733026187 1020315806 /nfs/dbraw/zinc/31/58/06/1020315806.db2.gz GVIIEBGGLDWKQM-UHFFFAOYSA-N 1 1 313.445 3.568 20 10 DHCDMO COc1ccc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000310077282 1020317030 /nfs/dbraw/zinc/31/70/30/1020317030.db2.gz GZOIOGRGQIPGAD-FQEVSTJZSA-N 1 1 324.468 3.615 20 10 DHCDMO COc1ccc(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC000310077282 1020317047 /nfs/dbraw/zinc/31/70/47/1020317047.db2.gz GZOIOGRGQIPGAD-FQEVSTJZSA-N 1 1 324.468 3.615 20 10 DHCDMO COc1ccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310077282 1020317056 /nfs/dbraw/zinc/31/70/56/1020317056.db2.gz GZOIOGRGQIPGAD-FQEVSTJZSA-N 1 1 324.468 3.615 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490705 1032919187 /nfs/dbraw/zinc/91/91/87/1032919187.db2.gz MHSJNFYLBHJNGX-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1[O-] ZINC000858490705 1032919201 /nfs/dbraw/zinc/91/92/01/1032919201.db2.gz MHSJNFYLBHJNGX-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO Cc1ncsc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000154708860 1020714748 /nfs/dbraw/zinc/71/47/48/1020714748.db2.gz IVLUXCMEQJCQRI-UHFFFAOYSA-N 1 1 314.410 3.953 20 10 DHCDMO Cc1ncsc1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000154708860 1020714756 /nfs/dbraw/zinc/71/47/56/1020714756.db2.gz IVLUXCMEQJCQRI-UHFFFAOYSA-N 1 1 314.410 3.953 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2CN2CCCC2)cc1C(C)C ZINC000738104328 1020862108 /nfs/dbraw/zinc/86/21/08/1020862108.db2.gz KZNCRXGAVXXUBM-SFHVURJKSA-N 1 1 316.489 3.884 20 10 DHCDMO Cc1cc(O)c(CN2CCC[C@H]2C[NH+]2CCCC2)cc1C(C)C ZINC000738104328 1020862114 /nfs/dbraw/zinc/86/21/14/1020862114.db2.gz KZNCRXGAVXXUBM-SFHVURJKSA-N 1 1 316.489 3.884 20 10 DHCDMO CCc1cc(C[N@@H+]2CCC[C@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738146128 1020863561 /nfs/dbraw/zinc/86/35/61/1020863561.db2.gz XQAOPIMKIQKTPM-KRWDZBQOSA-N 1 1 318.505 3.778 20 10 DHCDMO CCc1cc(C[N@H+]2CCC[C@H](N(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000738146128 1020863569 /nfs/dbraw/zinc/86/35/69/1020863569.db2.gz XQAOPIMKIQKTPM-KRWDZBQOSA-N 1 1 318.505 3.778 20 10 DHCDMO CCCC[N@@H+](CC)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000743271607 1021253010 /nfs/dbraw/zinc/25/30/10/1021253010.db2.gz GOAZIXALCRAKOJ-UHFFFAOYSA-N 1 1 304.478 3.924 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@@H](C)CO1 ZINC000917428769 1021264607 /nfs/dbraw/zinc/26/46/07/1021264607.db2.gz XKNSMJPPPRAJBV-QWHCGFSZSA-N 1 1 315.413 3.626 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000743402690 1021285046 /nfs/dbraw/zinc/28/50/46/1021285046.db2.gz MIFWJIMBUMZHCX-IBGZPJMESA-N 1 1 320.392 3.514 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccc(Cl)n2)C2CC2)cc1 ZINC000743841185 1021368063 /nfs/dbraw/zinc/36/80/63/1021368063.db2.gz HKNAQUXYYZUABT-UHFFFAOYSA-N 1 1 315.848 3.966 20 10 DHCDMO CCc1cnc(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000743841647 1021369032 /nfs/dbraw/zinc/36/90/32/1021369032.db2.gz PTPNNDQHHWFTFU-UHFFFAOYSA-N 1 1 301.434 3.714 20 10 DHCDMO CCc1cnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000743841647 1021369051 /nfs/dbraw/zinc/36/90/51/1021369051.db2.gz PTPNNDQHHWFTFU-UHFFFAOYSA-N 1 1 301.434 3.714 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1cccc(Cl)c1 ZINC000743870484 1021399350 /nfs/dbraw/zinc/39/93/50/1021399350.db2.gz TWJAZKBBTYHMGS-GOSISDBHSA-N 1 1 319.832 3.991 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)c1 ZINC000877812299 1033464493 /nfs/dbraw/zinc/46/44/93/1033464493.db2.gz LYWDDJNHWYICFF-CQSZACIVSA-N 1 1 303.324 3.565 20 10 DHCDMO CC1(C)[C@@H](C[NH2+]Cc2cccc(Br)c2O)C1(F)F ZINC000850394224 1021508334 /nfs/dbraw/zinc/50/83/34/1021508334.db2.gz NLSWZAOTBKLPCN-SNVBAGLBSA-N 1 1 320.177 3.536 20 10 DHCDMO N#Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000154721596 1021516440 /nfs/dbraw/zinc/51/64/40/1021516440.db2.gz QFKAXTVJUBPBII-UHFFFAOYSA-N 1 1 308.337 3.652 20 10 DHCDMO N#Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)o1 ZINC000154721596 1021516444 /nfs/dbraw/zinc/51/64/44/1021516444.db2.gz QFKAXTVJUBPBII-UHFFFAOYSA-N 1 1 308.337 3.652 20 10 DHCDMO C[C@@H]([NH2+][C@H]1COC(C)(C)C1)c1cccc(C(F)(F)F)c1O ZINC000850481246 1021556909 /nfs/dbraw/zinc/55/69/09/1021556909.db2.gz FGYNIEKKNUQWGP-NXEZZACHSA-N 1 1 303.324 3.629 20 10 DHCDMO CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000850554360 1021600666 /nfs/dbraw/zinc/60/06/66/1021600666.db2.gz JCKJGFZKXHXASW-MJXNMMHHSA-N 1 1 317.404 3.940 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)c1nccn1C ZINC000850573029 1021615821 /nfs/dbraw/zinc/61/58/21/1021615821.db2.gz SODZCZXZYXLTJW-NXEZZACHSA-N 1 1 313.323 3.556 20 10 DHCDMO [O-]c1ccc(Cl)c(Cl)c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC001237077758 1021629679 /nfs/dbraw/zinc/62/96/79/1021629679.db2.gz KGUSWVGSLUSXJA-OAHLLOKOSA-N 1 1 316.228 3.702 20 10 DHCDMO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC001237077758 1021629686 /nfs/dbraw/zinc/62/96/86/1021629686.db2.gz KGUSWVGSLUSXJA-OAHLLOKOSA-N 1 1 316.228 3.702 20 10 DHCDMO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC001237077758 1021629692 /nfs/dbraw/zinc/62/96/92/1021629692.db2.gz KGUSWVGSLUSXJA-OAHLLOKOSA-N 1 1 316.228 3.702 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000119080901 1021786321 /nfs/dbraw/zinc/78/63/21/1021786321.db2.gz BQVSFDPWXKGYBZ-AWEZNQCLSA-N 1 1 321.804 3.820 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000119080901 1021786332 /nfs/dbraw/zinc/78/63/32/1021786332.db2.gz BQVSFDPWXKGYBZ-AWEZNQCLSA-N 1 1 321.804 3.820 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000919954223 1021984533 /nfs/dbraw/zinc/98/45/33/1021984533.db2.gz NTRACXYFPYOXNM-GOSISDBHSA-N 1 1 305.381 3.673 20 10 DHCDMO Cc1nc(C[N@@H+](Cc2ccccc2O)C2CCCC2)c(C)o1 ZINC000851771849 1021995397 /nfs/dbraw/zinc/99/53/97/1021995397.db2.gz QFGGGUVQUZFKKK-UHFFFAOYSA-N 1 1 300.402 3.942 20 10 DHCDMO C[C@@H](NCC[N@@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384004 1022083219 /nfs/dbraw/zinc/08/32/19/1022083219.db2.gz VDZKUCNJXYFNOQ-ZWKOTPCHSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@@H](NCC[N@H+]1CC[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384004 1022083230 /nfs/dbraw/zinc/08/32/30/1022083230.db2.gz VDZKUCNJXYFNOQ-ZWKOTPCHSA-N 1 1 315.505 3.669 20 10 DHCDMO CC[N@@H+](Cc1cc(OC)ccc1O)[C@H](C)c1cccc(O)c1 ZINC000179770842 1022084114 /nfs/dbraw/zinc/08/41/14/1022084114.db2.gz MUCQKRZNKWCYQV-CYBMUJFWSA-N 1 1 301.386 3.690 20 10 DHCDMO C[C@@H](NCC[N@@H+]1CC[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384000 1022084341 /nfs/dbraw/zinc/08/43/41/1022084341.db2.gz VDZKUCNJXYFNOQ-QZTJIDSGSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@@H](NCC[N@H+]1CC[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766384000 1022084357 /nfs/dbraw/zinc/08/43/57/1022084357.db2.gz VDZKUCNJXYFNOQ-QZTJIDSGSA-N 1 1 315.505 3.669 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H]3COC[C@H]3C1)oc1ccccc12 ZINC000853586615 1022296404 /nfs/dbraw/zinc/29/64/04/1022296404.db2.gz VCNLZHICIVBWCP-DZGCQCFKSA-N 1 1 323.392 3.760 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@](C)(C(F)F)O1 ZINC000853631262 1022300024 /nfs/dbraw/zinc/30/00/24/1022300024.db2.gz UQQOLVZOYMFBEF-XIKOKIGWSA-N 1 1 321.367 3.790 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(N)c1)c1cccc(C(F)(F)F)c1O ZINC000854216592 1022433555 /nfs/dbraw/zinc/43/35/55/1022433555.db2.gz CUFBYESWSXXBAF-SNVBAGLBSA-N 1 1 310.319 3.844 20 10 DHCDMO C[C@H](C[NH+]1CCCCC1)NCc1ccc(N2CCCCC2)cc1 ZINC000237662157 1022491284 /nfs/dbraw/zinc/49/12/84/1022491284.db2.gz YMBDBJWLORLMNQ-GOSISDBHSA-N 1 1 315.505 3.641 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cc(F)ccc2O)C[C@H](c2ccc(F)cc2)O1 ZINC000180188863 1022657466 /nfs/dbraw/zinc/65/74/66/1022657466.db2.gz YSKHAFQZOZAHEK-KPZWWZAWSA-N 1 1 319.351 3.632 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)C[C@H](c2ccc(F)cc2)O1 ZINC000180188863 1022657470 /nfs/dbraw/zinc/65/74/70/1022657470.db2.gz YSKHAFQZOZAHEK-KPZWWZAWSA-N 1 1 319.351 3.632 20 10 DHCDMO Cc1cccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)c1O ZINC000180242645 1022671911 /nfs/dbraw/zinc/67/19/11/1022671911.db2.gz UNTBENZDZFCWBJ-LJQANCHMSA-N 1 1 311.425 3.573 20 10 DHCDMO CC[N@@H+](Cc1ccccc1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876527899 1033083111 /nfs/dbraw/zinc/08/31/11/1033083111.db2.gz MRDDYJXTHSTPSL-UHFFFAOYSA-N 1 1 324.468 3.670 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1CCc2cccc(F)c2C1 ZINC000767988405 1022856109 /nfs/dbraw/zinc/85/61/09/1022856109.db2.gz FOHHUUIPFKVKEB-UHFFFAOYSA-N 1 1 308.356 3.638 20 10 DHCDMO OCC[N@@H+](Cc1ccccc1)Cc1ccc(N2CCCCC2)cc1 ZINC000768142117 1022892234 /nfs/dbraw/zinc/89/22/34/1022892234.db2.gz HPCQPGBDYHWURI-UHFFFAOYSA-N 1 1 324.468 3.671 20 10 DHCDMO COCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000768159390 1022906541 /nfs/dbraw/zinc/90/65/41/1022906541.db2.gz DPBUKVDKTPWOAH-UHFFFAOYSA-N 1 1 305.805 3.694 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1)Cc1ccc(N2CCOCC2)cc1 ZINC000768159359 1022907870 /nfs/dbraw/zinc/90/78/70/1022907870.db2.gz BRZAEARLGQEEJO-UHFFFAOYSA-N 1 1 324.468 3.935 20 10 DHCDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000768171640 1022909496 /nfs/dbraw/zinc/90/94/96/1022909496.db2.gz FXMDYRJYLTUPOA-AEFFLSMTSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1ccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 ZINC000768204280 1022915984 /nfs/dbraw/zinc/91/59/84/1022915984.db2.gz WFIOYQNEMDLGCC-UHFFFAOYSA-N 1 1 324.468 3.772 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)CCOc1ccccc1Cl ZINC000768211685 1022916033 /nfs/dbraw/zinc/91/60/33/1022916033.db2.gz CJSXROHAYFTUPM-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000768238586 1022925746 /nfs/dbraw/zinc/92/57/46/1022925746.db2.gz QSUNLPYOSTVNNN-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000768238586 1022925758 /nfs/dbraw/zinc/92/57/58/1022925758.db2.gz QSUNLPYOSTVNNN-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1CCCCCC1 ZINC000768215062 1022926785 /nfs/dbraw/zinc/92/67/85/1022926785.db2.gz WDUWXCYVIZVWHO-UHFFFAOYSA-N 1 1 320.452 3.817 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000768235643 1022930635 /nfs/dbraw/zinc/93/06/35/1022930635.db2.gz BUQNUWFKTWSZCO-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000768235643 1022930643 /nfs/dbraw/zinc/93/06/43/1022930643.db2.gz BUQNUWFKTWSZCO-KRWDZBQOSA-N 1 1 303.789 3.619 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(OC)cc2)c(O)c1 ZINC000768235874 1022931046 /nfs/dbraw/zinc/93/10/46/1022931046.db2.gz AJWHWLJIRUSXSA-AWEZNQCLSA-N 1 1 315.413 3.993 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1)c1cc(F)cc(F)c1O ZINC000768291749 1022940357 /nfs/dbraw/zinc/94/03/57/1022940357.db2.gz FPYHXXCGEKGEAM-LZVXQISVSA-N 1 1 311.372 3.526 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H]1CO ZINC000857061282 1022941207 /nfs/dbraw/zinc/94/12/07/1022941207.db2.gz NNNZKCDVUUCCDL-BEFAXECRSA-N 1 1 311.425 3.510 20 10 DHCDMO CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)ccc2[O-])CC1 ZINC000768301918 1022942224 /nfs/dbraw/zinc/94/22/24/1022942224.db2.gz FGKIAIXVLAIQRJ-UHFFFAOYSA-N 1 1 310.869 3.599 20 10 DHCDMO COCc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)o1 ZINC000768351809 1022950826 /nfs/dbraw/zinc/95/08/26/1022950826.db2.gz KSDBIMRVJQDQDP-UHFFFAOYSA-N 1 1 316.445 3.903 20 10 DHCDMO CCO[C@@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C1CC1 ZINC000859189642 1033094086 /nfs/dbraw/zinc/09/40/86/1033094086.db2.gz BBZOPQQZOUWCLR-IBGZPJMESA-N 1 1 315.413 3.803 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)C[C@@H](C)c2ccccc2)cc1OC ZINC000768452044 1022968529 /nfs/dbraw/zinc/96/85/29/1022968529.db2.gz NOHBLXXVDOMIGT-CQSZACIVSA-N 1 1 315.413 3.645 20 10 DHCDMO CC(C)(C)[N@H+]1CCCN(Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444906 1022968636 /nfs/dbraw/zinc/96/86/36/1022968636.db2.gz OFPCAZBXCPWBGN-UHFFFAOYSA-N 1 1 316.489 3.577 20 10 DHCDMO CC(C)(C)N1CCC[N@H+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444906 1022968640 /nfs/dbraw/zinc/96/86/40/1022968640.db2.gz OFPCAZBXCPWBGN-UHFFFAOYSA-N 1 1 316.489 3.577 20 10 DHCDMO CC(C)(C)N1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)CC1 ZINC000768444906 1022968650 /nfs/dbraw/zinc/96/86/50/1022968650.db2.gz OFPCAZBXCPWBGN-UHFFFAOYSA-N 1 1 316.489 3.577 20 10 DHCDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768465745 1022972444 /nfs/dbraw/zinc/97/24/44/1022972444.db2.gz KFHZWGVEDIXTPE-DZGCQCFKSA-N 1 1 307.434 3.810 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOC[C@@H]1C)c1cc(Cl)c(Cl)cc1O ZINC000278831195 1022992630 /nfs/dbraw/zinc/99/26/30/1022992630.db2.gz UARREXZZHFUZLW-MWODSPESSA-N 1 1 304.217 3.775 20 10 DHCDMO CN1CCC[C@H](C[N@H+](C)Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000768547647 1022994722 /nfs/dbraw/zinc/99/47/22/1022994722.db2.gz WKOUBNVLOFJNON-KRWDZBQOSA-N 1 1 324.468 3.833 20 10 DHCDMO CN1CCC[C@H](C[N@@H+](C)Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000768547647 1022994731 /nfs/dbraw/zinc/99/47/31/1022994731.db2.gz WKOUBNVLOFJNON-KRWDZBQOSA-N 1 1 324.468 3.833 20 10 DHCDMO CC(C)CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 ZINC000876569823 1033094390 /nfs/dbraw/zinc/09/43/90/1033094390.db2.gz MSKQQYJKRNXDIE-UHFFFAOYSA-N 1 1 316.489 3.658 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[NH+]1CCN(CC2CC2)CC1 ZINC000768771750 1023024515 /nfs/dbraw/zinc/02/45/15/1023024515.db2.gz LGTYNFIQCGQSJQ-UHFFFAOYSA-N 1 1 322.452 3.587 20 10 DHCDMO CCO[C@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C1CC1 ZINC000859189643 1033095410 /nfs/dbraw/zinc/09/54/10/1033095410.db2.gz BBZOPQQZOUWCLR-LJQANCHMSA-N 1 1 315.413 3.803 20 10 DHCDMO COc1ccccc1OCC[N@@H+](C)Cc1c(O)cccc1Cl ZINC000768822415 1023037608 /nfs/dbraw/zinc/03/76/08/1023037608.db2.gz ILWVGUFZJAFZRV-UHFFFAOYSA-N 1 1 321.804 3.565 20 10 DHCDMO C[N@@H+](Cc1cccc(OC(F)(F)F)c1)Cc1ccccc1O ZINC000768872109 1023043953 /nfs/dbraw/zinc/04/39/53/1023043953.db2.gz CXCNVKOCLREBKN-UHFFFAOYSA-N 1 1 311.303 3.923 20 10 DHCDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 ZINC000768914257 1023055688 /nfs/dbraw/zinc/05/56/88/1023055688.db2.gz UPPLFUDZKMDQNX-QLFBSQMISA-N 1 1 322.880 3.883 20 10 DHCDMO CCOc1ccc(C[N@@H+](Cc2ccccn2)C(C)C)c(O)c1 ZINC000768926145 1023058603 /nfs/dbraw/zinc/05/86/03/1023058603.db2.gz NJJSLJHCUVXUQU-UHFFFAOYSA-N 1 1 300.402 3.597 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c1O ZINC000768993020 1023066841 /nfs/dbraw/zinc/06/68/41/1023066841.db2.gz TYTSVACTNRQQON-QGZVFWFLSA-N 1 1 315.388 3.747 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCCO1 ZINC000769030129 1023071030 /nfs/dbraw/zinc/07/10/30/1023071030.db2.gz PRPNISDYBNWLPP-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1O ZINC000769039564 1023074041 /nfs/dbraw/zinc/07/40/41/1023074041.db2.gz XSISOUPSYFHARR-KWOWKCNFSA-N 1 1 301.430 3.801 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000769106890 1023085765 /nfs/dbraw/zinc/08/57/65/1023085765.db2.gz RLMIDRMLSQXTSF-SFHVURJKSA-N 1 1 313.397 3.834 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1 ZINC000769244335 1023107464 /nfs/dbraw/zinc/10/74/64/1023107464.db2.gz NGGOEGFIXZGBKN-RTWAWAEBSA-N 1 1 324.468 3.841 20 10 DHCDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1C ZINC001172372715 1033105889 /nfs/dbraw/zinc/10/58/89/1033105889.db2.gz GTKIGNGSMKRMKK-HLIPFELVSA-N 1 1 316.489 3.780 20 10 DHCDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769315717 1023119863 /nfs/dbraw/zinc/11/98/63/1023119863.db2.gz WATWUKLXVQDWOM-SFHVURJKSA-N 1 1 302.462 3.534 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC(C)(C)O ZINC000769326689 1023123254 /nfs/dbraw/zinc/12/32/54/1023123254.db2.gz MGADWRDBXJTPNF-UHFFFAOYSA-N 1 1 304.478 3.660 20 10 DHCDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000769339497 1023128709 /nfs/dbraw/zinc/12/87/09/1023128709.db2.gz QIOKKLRYCFCTCB-IRXDYDNUSA-N 1 1 316.489 3.922 20 10 DHCDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000769339495 1023128932 /nfs/dbraw/zinc/12/89/32/1023128932.db2.gz QIOKKLRYCFCTCB-IAGOWNOFSA-N 1 1 316.489 3.922 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCCC[C@@H](SCC)C2)c(O)c1 ZINC000769403958 1023141393 /nfs/dbraw/zinc/14/13/93/1023141393.db2.gz LBJFMVIHNRFKTN-MRXNPFEDSA-N 1 1 309.475 3.899 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)cc1 ZINC000769422844 1023144512 /nfs/dbraw/zinc/14/45/12/1023144512.db2.gz DKTMBZVGYBDCOD-NRFANRHFSA-N 1 1 324.468 3.625 20 10 DHCDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(N(CC)CC)c(F)c2)C1 ZINC000769421685 1023145292 /nfs/dbraw/zinc/14/52/92/1023145292.db2.gz CIBCDTIEJJYYGE-KRWDZBQOSA-N 1 1 322.468 3.920 20 10 DHCDMO COc1cccc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c1O ZINC000769425401 1023147068 /nfs/dbraw/zinc/14/70/68/1023147068.db2.gz PKXBSHGBFWBSJT-GFCCVEGCSA-N 1 1 301.361 3.659 20 10 DHCDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2)C1 ZINC000769447370 1023155474 /nfs/dbraw/zinc/15/54/74/1023155474.db2.gz YROFLESGEPTGCY-IBGZPJMESA-N 1 1 302.462 3.535 20 10 DHCDMO CO[C@@H](C)C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C(C)C ZINC000769474077 1023163482 /nfs/dbraw/zinc/16/34/82/1023163482.db2.gz RMVDXEVVJLHLEZ-KRWDZBQOSA-N 1 1 304.478 3.922 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)cc1F ZINC000770287024 1023291381 /nfs/dbraw/zinc/29/13/81/1023291381.db2.gz UNFSLUYLDZQNQI-FUHWJXTLSA-N 1 1 320.452 3.673 20 10 DHCDMO CCOc1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c(O)c1 ZINC000770305479 1023294209 /nfs/dbraw/zinc/29/42/09/1023294209.db2.gz UAXXQVWSOQIICE-UHFFFAOYSA-N 1 1 317.351 3.955 20 10 DHCDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N(C)C)cc2)C12CCC2 ZINC000770354551 1023304093 /nfs/dbraw/zinc/30/40/93/1023304093.db2.gz YANOPWMZCDYFTE-QZTJIDSGSA-N 1 1 302.462 3.532 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3cccc4c3OC(C)(C)C4)ccc21 ZINC000770590096 1023328640 /nfs/dbraw/zinc/32/86/40/1023328640.db2.gz VFVMQDVLZWQCHK-UHFFFAOYSA-N 1 1 307.397 3.899 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1ccc(Cl)nn1)C1CCCC1 ZINC000876721575 1033129040 /nfs/dbraw/zinc/12/90/40/1033129040.db2.gz JOTBXNDODFABAU-UHFFFAOYSA-N 1 1 317.820 3.780 20 10 DHCDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000771869925 1023479587 /nfs/dbraw/zinc/47/95/87/1023479587.db2.gz XQHNFPCXKQFVIB-HNNXBMFYSA-N 1 1 319.445 3.526 20 10 DHCDMO COc1ccccc1/C=C\C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000771935173 1023489950 /nfs/dbraw/zinc/48/99/50/1023489950.db2.gz MPLQVOLXSQKYFP-CLFYSBASSA-N 1 1 310.441 3.906 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000876778917 1033140165 /nfs/dbraw/zinc/14/01/65/1033140165.db2.gz RZBNAXDDRIIHML-CXAGYDPISA-N 1 1 303.427 3.724 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c(O)c1 ZINC000876771039 1033140920 /nfs/dbraw/zinc/14/09/20/1033140920.db2.gz UBBHYIPDRKTUBN-GOSISDBHSA-N 1 1 311.425 3.739 20 10 DHCDMO C[C@@H](NCCC[NH+]1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000178414396 1023588036 /nfs/dbraw/zinc/58/80/36/1023588036.db2.gz YWNAFMVLNPPCJC-GOSISDBHSA-N 1 1 315.505 3.813 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1CCSC1 ZINC000787041881 1023752618 /nfs/dbraw/zinc/75/26/18/1023752618.db2.gz LXCSYTMJAFDXKY-CQSZACIVSA-N 1 1 303.427 3.741 20 10 DHCDMO CCc1cccc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c1 ZINC000787151330 1023762194 /nfs/dbraw/zinc/76/21/94/1023762194.db2.gz AYOGWCKZHLEBCY-UHFFFAOYSA-N 1 1 324.468 3.718 20 10 DHCDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccccc1O ZINC000787332774 1023784376 /nfs/dbraw/zinc/78/43/76/1023784376.db2.gz ORIKMIVFXHGVQJ-MRXNPFEDSA-N 1 1 305.805 3.865 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1 ZINC000787417505 1023790788 /nfs/dbraw/zinc/79/07/88/1023790788.db2.gz OCWQLDGDGWGAGJ-CQSZACIVSA-N 1 1 300.368 3.915 20 10 DHCDMO CCCCn1cc(C[NH2+][C@H](C)c2ccc(F)cc2O)c(C)n1 ZINC000756788910 1023849846 /nfs/dbraw/zinc/84/98/46/1023849846.db2.gz YNIFXBYSIIUGDY-CYBMUJFWSA-N 1 1 305.397 3.687 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2C[C@@H](O)C[C@@H]2C)cc1 ZINC000788270105 1023869731 /nfs/dbraw/zinc/86/97/31/1023869731.db2.gz PFMSVQZPDWMIPU-UWJYYQICSA-N 1 1 324.468 3.668 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)C1CCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788629721 1023916974 /nfs/dbraw/zinc/91/69/74/1023916974.db2.gz CYVNWAJIUFPUBU-GHMZBOCLSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]1CC[C@@H](C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)O1 ZINC000789306481 1024042696 /nfs/dbraw/zinc/04/26/96/1024042696.db2.gz OYADKLYAJXCICS-APWZRJJASA-N 1 1 302.462 3.676 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000876944857 1033189474 /nfs/dbraw/zinc/18/94/74/1033189474.db2.gz QSVGNMQDIJBQBX-UHFFFAOYSA-N 1 1 309.866 3.933 20 10 DHCDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C1 ZINC000130657245 1024196650 /nfs/dbraw/zinc/19/66/50/1024196650.db2.gz VDBSDUXLOLOVBK-LPHOPBHVSA-N 1 1 302.462 3.534 20 10 DHCDMO CC[C@@](C)([NH2+]Cc1cc(F)cc(F)c1O)c1nc(C)cs1 ZINC000883017777 1024211568 /nfs/dbraw/zinc/21/15/68/1024211568.db2.gz APXCSDURBLEYKS-OAHLLOKOSA-N 1 1 312.385 3.850 20 10 DHCDMO CC[C@@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000269054838 1024232062 /nfs/dbraw/zinc/23/20/62/1024232062.db2.gz WNKAMEIBNMXNRI-HXUWFJFHSA-N 1 1 315.505 3.810 20 10 DHCDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883089990 1024239513 /nfs/dbraw/zinc/23/95/13/1024239513.db2.gz ZIPPDMQIHIPEBR-JTQLQIEISA-N 1 1 323.387 3.781 20 10 DHCDMO C[C@@H](Cn1cccn1)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278893475 1024356663 /nfs/dbraw/zinc/35/66/63/1024356663.db2.gz YTQCXBBKJLKHQW-UWVGGRQHSA-N 1 1 314.216 3.635 20 10 DHCDMO Cc1c(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)cccc1[N+](=O)[O-] ZINC000790696042 1024356938 /nfs/dbraw/zinc/35/69/38/1024356938.db2.gz PKBSLUAFFWGIIV-SNVBAGLBSA-N 1 1 322.311 3.738 20 10 DHCDMO COC[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)C1 ZINC000883319462 1024374122 /nfs/dbraw/zinc/37/41/22/1024374122.db2.gz CTPLDPOZLMZDQA-BBBLOLIVSA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCOC1 ZINC000278898611 1024383053 /nfs/dbraw/zinc/38/30/53/1024383053.db2.gz ZDHGKKKDRTUQGM-UTLUCORTSA-N 1 1 304.217 3.775 20 10 DHCDMO C[C@@H](Cc1cccc(O)c1)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790959482 1024405144 /nfs/dbraw/zinc/40/51/44/1024405144.db2.gz GPCSZXUMOXMXRR-JTQLQIEISA-N 1 1 309.768 3.611 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(N(C)C)cc1 ZINC000271599142 1024548590 /nfs/dbraw/zinc/54/85/90/1024548590.db2.gz ZKZBJDZLZCVTCV-BBRMVZONSA-N 1 1 315.465 3.796 20 10 DHCDMO C[C@H]([NH2+][C@@H]1C[C@H]2OCCC[C@H]12)c1cc(Cl)c(Cl)cc1O ZINC000373206291 1024619438 /nfs/dbraw/zinc/61/94/38/1024619438.db2.gz AQPSABRAPIRTSU-QGQFXCMDSA-N 1 1 316.228 3.917 20 10 DHCDMO CC[N@@H+](Cc1ccco1)Cc1cc(Br)ccc1O ZINC000133364033 1024628662 /nfs/dbraw/zinc/62/86/62/1024628662.db2.gz CFEILPGQYDFGRF-UHFFFAOYSA-N 1 1 310.191 3.770 20 10 DHCDMO CCc1ccc([C@H]2C[N@H+](Cc3cc(F)ccc3O)CCO2)cc1 ZINC000792190886 1024646116 /nfs/dbraw/zinc/64/61/16/1024646116.db2.gz VWDDRBYDTRDBLG-LJQANCHMSA-N 1 1 315.388 3.667 20 10 DHCDMO CCc1ccc([C@H]2C[N@@H+](Cc3cc(F)ccc3O)CCO2)cc1 ZINC000792190886 1024646119 /nfs/dbraw/zinc/64/61/19/1024646119.db2.gz VWDDRBYDTRDBLG-LJQANCHMSA-N 1 1 315.388 3.667 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)cc1 ZINC000163369702 1024768063 /nfs/dbraw/zinc/76/80/63/1024768063.db2.gz OSTYPUCISKJJLF-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO COc1nc2ccccc2cc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001137207924 1025033242 /nfs/dbraw/zinc/03/32/42/1025033242.db2.gz DAAGQGAOTHHNRE-UHFFFAOYSA-N 1 1 320.392 3.507 20 10 DHCDMO CC[N@@H+](Cc1ccnn1C(C)C)Cc1ccc(N(C)C)cc1 ZINC000279552843 1025073834 /nfs/dbraw/zinc/07/38/34/1025073834.db2.gz DOJUPNMJQZFVMD-UHFFFAOYSA-N 1 1 300.450 3.552 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)[C@@H]1c1cccnc1 ZINC000793566318 1025104319 /nfs/dbraw/zinc/10/43/19/1025104319.db2.gz AEHPSQMKGNATOH-LJQANCHMSA-N 1 1 319.408 3.919 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@@H]1c1cccnc1 ZINC000793573408 1025126866 /nfs/dbraw/zinc/12/68/66/1025126866.db2.gz NHTDGAFRIIISON-LJQANCHMSA-N 1 1 308.425 3.859 20 10 DHCDMO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C(C)(C)c1ccccc1 ZINC000793610999 1025130694 /nfs/dbraw/zinc/13/06/94/1025130694.db2.gz ZUDWCEMTUJDXPN-UHFFFAOYSA-N 1 1 324.468 3.890 20 10 DHCDMO C[N@@H+](Cc1ccc(Cl)c(F)c1)Cc1cc2c(cc1O)OCO2 ZINC000134814594 1025134549 /nfs/dbraw/zinc/13/45/49/1025134549.db2.gz UNZQDHAYWYIWNC-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO CC[C@@H](Cc1ccc2c(c1)OCO2)[N@@H+](C)Cc1ccccc1O ZINC001170451572 1025298253 /nfs/dbraw/zinc/29/82/53/1025298253.db2.gz ZFBQKWNYIHKMMT-INIZCTEOSA-N 1 1 313.397 3.574 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC(C)(C)C1 ZINC000877306249 1033280269 /nfs/dbraw/zinc/28/02/69/1033280269.db2.gz KPVYUKADHBSTCD-MRXNPFEDSA-N 1 1 316.489 3.516 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)CC1(C)C ZINC000877349115 1033286280 /nfs/dbraw/zinc/28/62/80/1033286280.db2.gz ZNKBWYSMILSGEE-MRXNPFEDSA-N 1 1 316.489 3.516 20 10 DHCDMO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(F)cc(F)c2O)s1 ZINC000894014610 1025654873 /nfs/dbraw/zinc/65/48/73/1025654873.db2.gz NLNUMVQDWMPWNH-SECBINFHSA-N 1 1 312.385 3.937 20 10 DHCDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(F)cc(F)c2O)s1 ZINC000894014610 1025654876 /nfs/dbraw/zinc/65/48/76/1025654876.db2.gz NLNUMVQDWMPWNH-SECBINFHSA-N 1 1 312.385 3.937 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)c1O ZINC000894014921 1025657195 /nfs/dbraw/zinc/65/71/95/1025657195.db2.gz USKXZCLQRMYLGV-GFCCVEGCSA-N 1 1 320.458 3.976 20 10 DHCDMO CCOCc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)cc1 ZINC000886501426 1025657885 /nfs/dbraw/zinc/65/78/85/1025657885.db2.gz KCJNQQUPCUGTKO-CYBMUJFWSA-N 1 1 303.377 3.919 20 10 DHCDMO CCOc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1OC ZINC000886502860 1025657937 /nfs/dbraw/zinc/65/79/37/1025657937.db2.gz QYQDYJIJIOPXNK-LBPRGKRZSA-N 1 1 319.376 3.789 20 10 DHCDMO Cc1csc(CCCC[NH2+][C@@H](C)c2c(O)cccc2F)n1 ZINC000886521207 1025674177 /nfs/dbraw/zinc/67/41/77/1025674177.db2.gz WUYVWKLGEYXCKA-LBPRGKRZSA-N 1 1 308.422 3.970 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1c(O)cccc1F ZINC000886527932 1025677495 /nfs/dbraw/zinc/67/74/95/1025677495.db2.gz CSOTXJVTYBWGNU-CYBMUJFWSA-N 1 1 302.393 3.757 20 10 DHCDMO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1c(O)cccc1F ZINC000886542892 1025690175 /nfs/dbraw/zinc/69/01/75/1025690175.db2.gz HLJMRDRTJOQSAG-OHNRDTAOSA-N 1 1 315.388 3.960 20 10 DHCDMO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886543454 1025691082 /nfs/dbraw/zinc/69/10/82/1025691082.db2.gz PDMAKGLRTIITNU-GYSYKLTISA-N 1 1 309.406 3.756 20 10 DHCDMO C[C@H]([NH2+]C1(c2ccc3c(c2)OCO3)CC1)c1c(O)cccc1F ZINC000886576790 1025716790 /nfs/dbraw/zinc/71/67/90/1025716790.db2.gz PDSCTESJVACNHO-NSHDSACASA-N 1 1 315.344 3.600 20 10 DHCDMO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886609093 1025735383 /nfs/dbraw/zinc/73/53/83/1025735383.db2.gz MEAUCHOPZWLMHH-ZJNRKIDTSA-N 1 1 303.377 3.612 20 10 DHCDMO C[C@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886610907 1025737942 /nfs/dbraw/zinc/73/79/42/1025737942.db2.gz MXLKBJCPZGVJEJ-WCQYABFASA-N 1 1 323.795 3.611 20 10 DHCDMO C[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1c(O)cccc1F ZINC000886621954 1025748096 /nfs/dbraw/zinc/74/80/96/1025748096.db2.gz HAILFLBBQIGUDV-KPPDAEKUSA-N 1 1 303.324 3.732 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC(c2cccnc2)CC1 ZINC000809737040 1026609864 /nfs/dbraw/zinc/60/98/64/1026609864.db2.gz CBARFFVGUAIGSR-UHFFFAOYSA-N 1 1 320.795 3.959 20 10 DHCDMO C[NH+](C)Cc1ccc(C[N@H+](C)Cc2c([O-])cccc2Cl)cc1 ZINC000809739168 1026611701 /nfs/dbraw/zinc/61/17/01/1026611701.db2.gz ZVNGIOYNJKRZGK-UHFFFAOYSA-N 1 1 318.848 3.739 20 10 DHCDMO C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2c([O-])cccc2Cl)cc1 ZINC000809739168 1026611703 /nfs/dbraw/zinc/61/17/03/1026611703.db2.gz ZVNGIOYNJKRZGK-UHFFFAOYSA-N 1 1 318.848 3.739 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)C[C@@H](O)C2CC2)cc1 ZINC000809751441 1026616473 /nfs/dbraw/zinc/61/64/73/1026616473.db2.gz HJVJPSAWQTZTJZ-LJQANCHMSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765519 1026620891 /nfs/dbraw/zinc/62/08/91/1026620891.db2.gz NSEGANLEUGTAJA-JXFKEZNVSA-N 1 1 324.468 3.831 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2cccc(Br)c2O)CCC1(F)F ZINC000811512717 1027028602 /nfs/dbraw/zinc/02/86/02/1027028602.db2.gz QJUQAFKTNYZRMF-VIFPVBQESA-N 1 1 320.177 3.632 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1O ZINC000811518439 1027020176 /nfs/dbraw/zinc/02/01/76/1027020176.db2.gz KMHUVLYLQLKKHI-RDJZCZTQSA-N 1 1 321.848 3.888 20 10 DHCDMO C[C@H]1C[N@H+](Cc2cccc(Br)c2O)CCC1(F)F ZINC000811512717 1027028597 /nfs/dbraw/zinc/02/85/97/1027028597.db2.gz QJUQAFKTNYZRMF-VIFPVBQESA-N 1 1 320.177 3.632 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000811513573 1027028677 /nfs/dbraw/zinc/02/86/77/1027028677.db2.gz KMBBPXNAZBWVOS-HNNXBMFYSA-N 1 1 322.246 3.919 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCCC3)[C@H]1[C@@H]1CCCO1 ZINC000811777972 1027082282 /nfs/dbraw/zinc/08/22/82/1027082282.db2.gz WHHGIZISJKUMSN-OALUTQOASA-N 1 1 315.457 3.660 20 10 DHCDMO COc1cc(C[N@@H+](C(C)C)[C@@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000812291056 1027236771 /nfs/dbraw/zinc/23/67/71/1027236771.db2.gz JNOHJBUVDQASAP-OAHLLOKOSA-N 1 1 321.461 3.698 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812854100 1027453295 /nfs/dbraw/zinc/45/32/95/1027453295.db2.gz VJUWEMPMEWVSBV-OXQOHEQNSA-N 1 1 312.457 3.697 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCCC[C@@H](F)C2)c(OC)c1 ZINC001138386820 1027456536 /nfs/dbraw/zinc/45/65/36/1027456536.db2.gz XIQVGIOUOGIQTO-MRXNPFEDSA-N 1 1 308.441 3.865 20 10 DHCDMO COC1CCN(c2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000296619022 1027686736 /nfs/dbraw/zinc/68/67/36/1027686736.db2.gz UPYKDGQZZMWMKE-INIZCTEOSA-N 1 1 302.462 3.534 20 10 DHCDMO Oc1ccc(F)cc1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000778996963 1027741951 /nfs/dbraw/zinc/74/19/51/1027741951.db2.gz XTEGBAWJBAQJFC-FQEVSTJZSA-N 1 1 322.383 3.938 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000778996963 1027741969 /nfs/dbraw/zinc/74/19/69/1027741969.db2.gz XTEGBAWJBAQJFC-FQEVSTJZSA-N 1 1 322.383 3.938 20 10 DHCDMO C[C@H](CN[C@H](C)c1ccc(N2CCCCC2)cc1)C[NH+](C)C ZINC000813877964 1027746186 /nfs/dbraw/zinc/74/61/86/1027746186.db2.gz IVQLBKQOOSNYLP-IAGOWNOFSA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)CN(C)C ZINC000813877964 1027746201 /nfs/dbraw/zinc/74/62/01/1027746201.db2.gz IVQLBKQOOSNYLP-IAGOWNOFSA-N 1 1 303.494 3.525 20 10 DHCDMO CCc1nccn1[C@H]1CCC[N@H+]([C@H](CC)c2ccccc2O)C1 ZINC000364622940 1027854517 /nfs/dbraw/zinc/85/45/17/1027854517.db2.gz MLHLWJXPJVYNJZ-DOTOQJQBSA-N 1 1 313.445 3.939 20 10 DHCDMO CC1(C)C[N@@H+](Cc2c(O)ccc3ccncc32)[C@@H]1c1ccncc1 ZINC000814227898 1027961181 /nfs/dbraw/zinc/96/11/81/1027961181.db2.gz OSRCMVMKJUDOIJ-LJQANCHMSA-N 1 1 319.408 3.919 20 10 DHCDMO COc1cccc([C@@H](C[NH2+][C@H](C)c2ccc(F)cc2O)OC)c1 ZINC000527929614 1027989480 /nfs/dbraw/zinc/98/94/80/1027989480.db2.gz STLLUMPTRKSIEF-KZULUSFZSA-N 1 1 319.376 3.578 20 10 DHCDMO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2c(O)ccc3ccccc32)no1 ZINC000367474342 1028192844 /nfs/dbraw/zinc/19/28/44/1028192844.db2.gz FKVLZZUWAXCLHS-KRWDZBQOSA-N 1 1 323.396 3.964 20 10 DHCDMO Cc1nc([C@@H]2CCCC[N@H+]2Cc2c(O)ccc3ccccc32)no1 ZINC000367474342 1028192852 /nfs/dbraw/zinc/19/28/52/1028192852.db2.gz FKVLZZUWAXCLHS-KRWDZBQOSA-N 1 1 323.396 3.964 20 10 DHCDMO CCOC1CC2(C1)CC[N@H+](Cc1c(O)ccc(Cl)c1F)C2 ZINC000367698238 1028227015 /nfs/dbraw/zinc/22/70/15/1028227015.db2.gz DVLGWXQVQIMQJO-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1c(O)ccc(Cl)c1F)C2 ZINC000367698238 1028227030 /nfs/dbraw/zinc/22/70/30/1028227030.db2.gz DVLGWXQVQIMQJO-UHFFFAOYSA-N 1 1 313.800 3.576 20 10 DHCDMO Cc1cc(C[N@@H+](C)[C@H](CCO)c2ccccc2)ccc1N(C)C ZINC000815055107 1028335054 /nfs/dbraw/zinc/33/50/54/1028335054.db2.gz VZQZNEGWPXHJQK-HXUWFJFHSA-N 1 1 312.457 3.617 20 10 DHCDMO CCc1cnc(C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)s1 ZINC000815057157 1028336380 /nfs/dbraw/zinc/33/63/80/1028336380.db2.gz JXGRBYPDDYKBGH-UHFFFAOYSA-N 1 1 303.475 3.712 20 10 DHCDMO CCc1cnc(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)s1 ZINC000815057157 1028336392 /nfs/dbraw/zinc/33/63/92/1028336392.db2.gz JXGRBYPDDYKBGH-UHFFFAOYSA-N 1 1 303.475 3.712 20 10 DHCDMO COc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000368329293 1028338107 /nfs/dbraw/zinc/33/81/07/1028338107.db2.gz RYLRGTBPKKCYAC-NHYWBVRUSA-N 1 1 317.360 3.714 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2nc3ccccc3o2)ccc1N(C)C ZINC000815073299 1028350698 /nfs/dbraw/zinc/35/06/98/1028350698.db2.gz IVFZOUFOJPXYFF-UHFFFAOYSA-N 1 1 309.413 3.834 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1N(C)C ZINC000815080545 1028352858 /nfs/dbraw/zinc/35/28/58/1028352858.db2.gz SMMYKPVECAGUPX-HKUYNNGSSA-N 1 1 316.489 3.700 20 10 DHCDMO CCc1nc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cs1 ZINC000815088213 1028359649 /nfs/dbraw/zinc/35/96/49/1028359649.db2.gz CFEWKRROINEIAA-CYBMUJFWSA-N 1 1 303.475 3.931 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc1 ZINC000815120009 1028366112 /nfs/dbraw/zinc/36/61/12/1028366112.db2.gz LZPTYLXJNNBRLU-ROUUACIJSA-N 1 1 302.462 3.532 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC=C(Br)C2)ccc1N(C)C ZINC000815106889 1028380790 /nfs/dbraw/zinc/38/07/90/1028380790.db2.gz COERNBFWJWFRIR-UHFFFAOYSA-N 1 1 309.251 3.546 20 10 DHCDMO Cc1cc(C[N@H+]2CCC=C(Br)C2)ccc1N(C)C ZINC000815106889 1028380806 /nfs/dbraw/zinc/38/08/06/1028380806.db2.gz COERNBFWJWFRIR-UHFFFAOYSA-N 1 1 309.251 3.546 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCC=C(Br)C2)cc1 ZINC000815108511 1028382472 /nfs/dbraw/zinc/38/24/72/1028382472.db2.gz YLBFPSJEAVZSRQ-UHFFFAOYSA-N 1 1 309.251 3.627 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC=C(Br)C2)cc1 ZINC000815108511 1028382490 /nfs/dbraw/zinc/38/24/90/1028382490.db2.gz YLBFPSJEAVZSRQ-UHFFFAOYSA-N 1 1 309.251 3.627 20 10 DHCDMO c1cc(N2CCOCC2)ccc1CNc1ccc(C2CCC2)c[nH+]1 ZINC000815161015 1028386729 /nfs/dbraw/zinc/38/67/29/1028386729.db2.gz VNGWBWQPPOIKOW-UHFFFAOYSA-N 1 1 323.440 3.798 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC3(CCOCC3)[C@H]2C)c1O ZINC000368819702 1028415312 /nfs/dbraw/zinc/41/53/12/1028415312.db2.gz XBDKDTAELKUHBX-CYBMUJFWSA-N 1 1 309.837 3.745 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)cc1 ZINC000779152454 1028441640 /nfs/dbraw/zinc/44/16/40/1028441640.db2.gz ABZDNLCYVKGDBU-MJGOQNOKSA-N 1 1 304.478 3.516 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)cc1 ZINC000779152452 1028452091 /nfs/dbraw/zinc/45/20/91/1028452091.db2.gz ABZDNLCYVKGDBU-HKUYNNGSSA-N 1 1 304.478 3.516 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)[C@H](C)C[S@](C)=O)cc1 ZINC000187831348 1028477340 /nfs/dbraw/zinc/47/73/40/1028477340.db2.gz PRWGOIHYRDLQNF-ZHRRBRCNSA-N 1 1 324.534 3.512 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCCO1)c1cccc(C(F)(F)F)c1O ZINC000815566286 1028547097 /nfs/dbraw/zinc/54/70/97/1028547097.db2.gz OLGSPOXINSQFBJ-GHMZBOCLSA-N 1 1 303.324 3.631 20 10 DHCDMO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815578602 1028552280 /nfs/dbraw/zinc/55/22/80/1028552280.db2.gz RTVGKUMGBSLKFV-HZMBPMFUSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583714 1028555737 /nfs/dbraw/zinc/55/57/37/1028555737.db2.gz MRVSTXXVFPPALT-WOPDTQHZSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1[O-] ZINC000815583714 1028555743 /nfs/dbraw/zinc/55/57/43/1028555743.db2.gz MRVSTXXVFPPALT-WOPDTQHZSA-N 1 1 316.367 3.544 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(F)cn1)c1cccc(C(F)(F)F)c1O ZINC000815589389 1028558463 /nfs/dbraw/zinc/55/84/63/1028558463.db2.gz QPJAYXOXZNKKES-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO COCCC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CC1 ZINC000815596663 1028560963 /nfs/dbraw/zinc/56/09/63/1028560963.db2.gz AGCQHLMRXSGMLS-NSHDSACASA-N 1 1 317.351 3.878 20 10 DHCDMO CO[C@@H]1CCC[C@H]1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815600674 1028564241 /nfs/dbraw/zinc/56/42/41/1028564241.db2.gz AYGZYZSOPFFWGH-UHIISALHSA-N 1 1 317.351 3.877 20 10 DHCDMO COC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)CCC1 ZINC000815614660 1028572387 /nfs/dbraw/zinc/57/23/87/1028572387.db2.gz YAAWZAPBKVFOIC-JTQLQIEISA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1CCOC[C@@H]1C)c1cccc(C(F)(F)F)c1O ZINC000815625619 1028576695 /nfs/dbraw/zinc/57/66/95/1028576695.db2.gz ICPFPSPSSQCKRT-SRVKXCTJSA-N 1 1 317.351 3.734 20 10 DHCDMO COCC(C)(C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628915 1028580445 /nfs/dbraw/zinc/58/04/45/1028580445.db2.gz NYIMCDNRAQEJTF-JTQLQIEISA-N 1 1 305.340 3.734 20 10 DHCDMO C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000815647581 1028593053 /nfs/dbraw/zinc/59/30/53/1028593053.db2.gz OPICTHNHAMMPLK-AWEZNQCLSA-N 1 1 310.869 3.962 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C(C)(C)O ZINC000815652380 1028594202 /nfs/dbraw/zinc/59/42/02/1028594202.db2.gz ZXRQUSOYWYZUGH-ISVAXAHUSA-N 1 1 306.233 3.899 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@@H]2c2cccs2)c1 ZINC000371426423 1028709460 /nfs/dbraw/zinc/70/94/60/1028709460.db2.gz XGZGQSSZPHHGFM-CQSZACIVSA-N 1 1 321.467 3.752 20 10 DHCDMO Cc1cncc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000189951770 1028721088 /nfs/dbraw/zinc/72/10/88/1028721088.db2.gz VWTYEXKXPWKZSM-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1cncc(C[N@@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000189951770 1028721097 /nfs/dbraw/zinc/72/10/97/1028721097.db2.gz VWTYEXKXPWKZSM-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](Cc3ccsc3C)CC2)cc1 ZINC000816495126 1028900023 /nfs/dbraw/zinc/90/00/23/1028900023.db2.gz LGQDDZDKQRDABP-UHFFFAOYSA-N 1 1 316.470 3.777 20 10 DHCDMO OCCC[N@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816504229 1028909564 /nfs/dbraw/zinc/90/95/64/1028909564.db2.gz DRWVRXQEMGVWMF-UHFFFAOYSA-N 1 1 323.795 3.569 20 10 DHCDMO OCCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816504229 1028909565 /nfs/dbraw/zinc/90/95/65/1028909565.db2.gz DRWVRXQEMGVWMF-UHFFFAOYSA-N 1 1 323.795 3.569 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccc2c(c1)OCO2 ZINC000816533357 1028921997 /nfs/dbraw/zinc/92/19/97/1028921997.db2.gz SIDBAMIZDIAXML-SECBINFHSA-N 1 1 323.751 3.764 20 10 DHCDMO C[N@H+](CCNCc1ccc2ccccc2c1O)C1CCCCC1 ZINC000816542108 1028926136 /nfs/dbraw/zinc/92/61/36/1028926136.db2.gz DBROHMLVUWCBPY-UHFFFAOYSA-N 1 1 312.457 3.900 20 10 DHCDMO C[N@@H+](CCNCc1ccc2ccccc2c1O)C1CCCCC1 ZINC000816542108 1028926149 /nfs/dbraw/zinc/92/61/49/1028926149.db2.gz DBROHMLVUWCBPY-UHFFFAOYSA-N 1 1 312.457 3.900 20 10 DHCDMO C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)Oc1ccccc1 ZINC000816551410 1028934052 /nfs/dbraw/zinc/93/40/52/1028934052.db2.gz ARHCXZQZZMZEHS-NSHDSACASA-N 1 1 309.768 3.742 20 10 DHCDMO CCO[C@H]1C[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C12CCC2 ZINC000816552032 1028938045 /nfs/dbraw/zinc/93/80/45/1028938045.db2.gz YXFWYBIXCBXUHH-GJZGRUSLSA-N 1 1 313.800 3.622 20 10 DHCDMO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816589763 1028939878 /nfs/dbraw/zinc/93/98/78/1028939878.db2.gz HOZWCKBVARCPCX-INIZCTEOSA-N 1 1 315.816 3.558 20 10 DHCDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816589763 1028939892 /nfs/dbraw/zinc/93/98/92/1028939892.db2.gz HOZWCKBVARCPCX-INIZCTEOSA-N 1 1 315.816 3.558 20 10 DHCDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C[C@H]1O ZINC000816560438 1028943946 /nfs/dbraw/zinc/94/39/46/1028943946.db2.gz OYDZUZWKHIPSQV-ZWKOTPCHSA-N 1 1 313.441 3.774 20 10 DHCDMO CN(C)[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816561019 1028946588 /nfs/dbraw/zinc/94/65/88/1028946588.db2.gz JAGINNKEVRQTEE-MRXNPFEDSA-N 1 1 322.811 3.577 20 10 DHCDMO C[C@H]1[C@H](N2CCCC2)CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816610050 1028960525 /nfs/dbraw/zinc/96/05/25/1028960525.db2.gz WKUOGVJKJDFBCF-HNAYVOBHSA-N 1 1 310.441 3.604 20 10 DHCDMO C[C@H]1[C@H]([NH+]2CCCC2)CCN1Cc1ccc2ccccc2c1O ZINC000816610050 1028960535 /nfs/dbraw/zinc/96/05/35/1028960535.db2.gz WKUOGVJKJDFBCF-HNAYVOBHSA-N 1 1 310.441 3.604 20 10 DHCDMO Oc1c(C[N@H+]2CCOC[C@H](C3CCC3)C2)ccc2ccccc21 ZINC000816617099 1028964036 /nfs/dbraw/zinc/96/40/36/1028964036.db2.gz OYDIBAGKLHTCCZ-GOSISDBHSA-N 1 1 311.425 3.794 20 10 DHCDMO C[C@@H]([NH2+]CCCC1(O)CCC1)c1cccc(C(F)(F)F)c1O ZINC000817584904 1029215385 /nfs/dbraw/zinc/21/53/85/1029215385.db2.gz ANZNKPQCDTYBRS-LLVKDONJSA-N 1 1 317.351 3.757 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000817934790 1029280251 /nfs/dbraw/zinc/28/02/51/1029280251.db2.gz PGJKFTNIYQMKRX-IWMITWMQSA-N 1 1 323.484 3.726 20 10 DHCDMO CC[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccs1 ZINC000817938661 1029280625 /nfs/dbraw/zinc/28/06/25/1029280625.db2.gz OZANTYHTHNMIBC-HZPDHXFCSA-N 1 1 303.475 3.555 20 10 DHCDMO CC[C@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817938474 1029283332 /nfs/dbraw/zinc/28/33/32/1029283332.db2.gz LDEDVBCNBZKDLJ-OALUTQOASA-N 1 1 315.436 3.632 20 10 DHCDMO C[C@@H]1C[C@@H](NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c2ccccc21 ZINC000817939503 1029284097 /nfs/dbraw/zinc/28/40/97/1029284097.db2.gz BXAWYCGDTJCNOE-VOBQZIQPSA-N 1 1 309.457 3.591 20 10 DHCDMO CC(C)C[C@@H](C[NH3+])N[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960483 1029302153 /nfs/dbraw/zinc/30/21/53/1029302153.db2.gz ZQMUFGBUBNACAH-AEFFLSMTSA-N 1 1 303.494 3.701 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc2ccccc2c1[O-] ZINC000817975640 1029315216 /nfs/dbraw/zinc/31/52/16/1029315216.db2.gz PFPYUBVMRNMLGB-JYJNAYRXSA-N 1 1 312.457 3.961 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977996 1029315784 /nfs/dbraw/zinc/31/57/84/1029315784.db2.gz SSQOTFQGCUYDHL-GXFFZTMASA-N 1 1 304.356 3.579 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000817977036 1029318323 /nfs/dbraw/zinc/31/83/23/1029318323.db2.gz ZQLMTHKNYCCYDW-FZMZJTMJSA-N 1 1 318.383 3.969 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817983006 1029320160 /nfs/dbraw/zinc/32/01/60/1029320160.db2.gz XMWVYAHBHCRTFI-RNCFNFMXSA-N 1 1 317.260 3.867 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1[O-] ZINC000817984998 1029323844 /nfs/dbraw/zinc/32/38/44/1029323844.db2.gz DXHOFTYDCUEUEA-ZFWWWQNUSA-N 1 1 308.853 3.761 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1C ZINC000819904268 1029622800 /nfs/dbraw/zinc/62/28/00/1029622800.db2.gz QTWHZMLOCGFDGW-IBGZPJMESA-N 1 1 315.457 3.790 20 10 DHCDMO CC(C)n1cncc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000822443143 1030026086 /nfs/dbraw/zinc/02/60/86/1030026086.db2.gz PCCBEPDHDPYFHC-UHFFFAOYSA-N 1 1 314.477 3.941 20 10 DHCDMO CCOc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c(O)c1 ZINC000865822622 1030040571 /nfs/dbraw/zinc/04/05/71/1030040571.db2.gz MLDZLIRRLQPKIR-MRXNPFEDSA-N 1 1 307.340 3.730 20 10 DHCDMO C[N@H+](Cc1cc(Cl)c(F)cc1O)C[C@@](C)(O)c1ccccc1 ZINC000822520515 1030041195 /nfs/dbraw/zinc/04/11/95/1030041195.db2.gz DYFZSCKJDWIOSR-QGZVFWFLSA-N 1 1 323.795 3.524 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C[C@@](C)(O)c1ccccc1 ZINC000822520515 1030041211 /nfs/dbraw/zinc/04/12/11/1030041211.db2.gz DYFZSCKJDWIOSR-QGZVFWFLSA-N 1 1 323.795 3.524 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1 ZINC000822530362 1030044581 /nfs/dbraw/zinc/04/45/81/1030044581.db2.gz YTEHIIIIRNDXTG-LJQANCHMSA-N 1 1 314.473 3.534 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@H](CC)c2ccncc2)c1O ZINC000290519893 1030086612 /nfs/dbraw/zinc/08/66/12/1030086612.db2.gz PZWHPZPJLHYWJE-MRXNPFEDSA-N 1 1 300.402 3.769 20 10 DHCDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(N4CCCCC4)cc3)C2)c1 ZINC000290842997 1030218984 /nfs/dbraw/zinc/21/89/84/1030218984.db2.gz IMJKLPAZKPGYTD-HXUWFJFHSA-N 1 1 324.472 3.629 20 10 DHCDMO C[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(Cl)cc1O ZINC000841759358 1030228672 /nfs/dbraw/zinc/22/86/72/1030228672.db2.gz YYISMYMESBFERS-NWDGAFQWSA-N 1 1 303.789 3.872 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2C(F)F)cc1 ZINC000866567557 1030379767 /nfs/dbraw/zinc/37/97/67/1030379767.db2.gz QPBISGCMYAWOJH-GFCCVEGCSA-N 1 1 322.403 3.665 20 10 DHCDMO C[C@H](Cc1ccccc1)N1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000823752801 1030386616 /nfs/dbraw/zinc/38/66/16/1030386616.db2.gz NPBIMXRESYPSNM-QGZVFWFLSA-N 1 1 324.468 3.577 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)c1ccnn1C ZINC000866614735 1030405067 /nfs/dbraw/zinc/40/50/67/1030405067.db2.gz OPTUVMPMGRBKIY-VHSXEESVSA-N 1 1 313.323 3.556 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2ccccc2N2CCCC2)c1 ZINC000121239545 1030439665 /nfs/dbraw/zinc/43/96/65/1030439665.db2.gz SPXUSUXMZUHLCX-UHFFFAOYSA-N 1 1 310.441 3.933 20 10 DHCDMO Cc1cc(C[NH2+][C@H]2CCn3ccnc32)c(C)n1-c1cccc(C)c1 ZINC000824520823 1030572143 /nfs/dbraw/zinc/57/21/43/1030572143.db2.gz AOPUTQXNLJHPFE-IBGZPJMESA-N 1 1 320.440 3.834 20 10 DHCDMO COC[C@@]1(C)CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000824576522 1030584252 /nfs/dbraw/zinc/58/42/52/1030584252.db2.gz MZJFGFKAWBHNOV-FQEVSTJZSA-N 1 1 311.425 3.918 20 10 DHCDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)c(C)cc2O)on1 ZINC000824596319 1030590798 /nfs/dbraw/zinc/59/07/98/1030590798.db2.gz DWWKNSXBJRQNJU-AWEZNQCLSA-N 1 1 306.793 3.988 20 10 DHCDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]2C2CC2)ccc1N1CCCCC1 ZINC000824651327 1030600653 /nfs/dbraw/zinc/60/06/53/1030600653.db2.gz XFZGEQHJSVMQFC-INIZCTEOSA-N 1 1 315.417 3.569 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824697028 1030603242 /nfs/dbraw/zinc/60/32/42/1030603242.db2.gz YANNKMKNHXJYID-INMHGKMJSA-N 1 1 309.837 3.561 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1C ZINC000824695936 1030613147 /nfs/dbraw/zinc/61/31/47/1030613147.db2.gz DXJZDXYLDFRYAP-KZNAEPCWSA-N 1 1 303.446 3.525 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1O ZINC000824695763 1030614227 /nfs/dbraw/zinc/61/42/27/1030614227.db2.gz CJRNXQCDICPTJG-BRWVUGGUSA-N 1 1 323.864 3.870 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1O ZINC000824695764 1030614450 /nfs/dbraw/zinc/61/44/50/1030614450.db2.gz CJRNXQCDICPTJG-GVDBMIGSSA-N 1 1 323.864 3.870 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000824716402 1030620274 /nfs/dbraw/zinc/62/02/74/1030620274.db2.gz UFPNFZRJMSDCQK-AAEUAGOBSA-N 1 1 317.351 3.954 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](OC)[C@H](C)C2)cc1F ZINC000824815725 1030645520 /nfs/dbraw/zinc/64/55/20/1030645520.db2.gz XQWZCFBMHZOEKS-RDTXWAMCSA-N 1 1 308.441 3.529 20 10 DHCDMO CO[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000824815586 1030648642 /nfs/dbraw/zinc/64/86/42/1030648642.db2.gz UGQAJOSFRGDURJ-LPHOPBHVSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@]3(CCCOC3)C2)cc1Cl ZINC000824856092 1030653839 /nfs/dbraw/zinc/65/38/39/1030653839.db2.gz SOCOBJUMMSEMJM-KRWDZBQOSA-N 1 1 309.837 3.747 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000824893135 1030661832 /nfs/dbraw/zinc/66/18/32/1030661832.db2.gz LHYIGWVSPNCBMY-CVEARBPZSA-N 1 1 321.848 3.827 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H]1OCCc2sccc21 ZINC000291935070 1030709406 /nfs/dbraw/zinc/70/94/06/1030709406.db2.gz PDGQAGYPYUOCBD-RVPKQNPDSA-N 1 1 321.417 3.946 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000825247517 1030757936 /nfs/dbraw/zinc/75/79/36/1030757936.db2.gz TUJWJJGJRRTKJI-AWEZNQCLSA-N 1 1 310.869 3.564 20 10 DHCDMO Cc1cc([O-])c(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1Cl ZINC000825247517 1030757917 /nfs/dbraw/zinc/75/79/17/1030757917.db2.gz TUJWJJGJRRTKJI-AWEZNQCLSA-N 1 1 310.869 3.564 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000825247517 1030757902 /nfs/dbraw/zinc/75/79/02/1030757902.db2.gz TUJWJJGJRRTKJI-AWEZNQCLSA-N 1 1 310.869 3.564 20 10 DHCDMO Cc1cccc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000825321619 1030775209 /nfs/dbraw/zinc/77/52/09/1030775209.db2.gz JAKISEMIIPVETE-GOSISDBHSA-N 1 1 323.484 3.598 20 10 DHCDMO Cc1nnsc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000844295833 1031050735 /nfs/dbraw/zinc/05/07/35/1031050735.db2.gz FTUSVAYWKFUBND-UHFFFAOYSA-N 1 1 317.458 3.887 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1cc(F)cc(F)c1O ZINC000927062154 1031058748 /nfs/dbraw/zinc/05/87/48/1031058748.db2.gz XIBJANXWBCCPSA-MEBBXXQBSA-N 1 1 304.340 3.794 20 10 DHCDMO COc1ccc(C[NH2+][C@H](C)c2c(O)cccc2F)c(C)c1OC ZINC000927122827 1031106112 /nfs/dbraw/zinc/10/61/12/1031106112.db2.gz JXJPIXXOGSGEEL-GFCCVEGCSA-N 1 1 319.376 3.708 20 10 DHCDMO Cc1cc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)ccc1N1CCCCC1 ZINC000844464594 1031161437 /nfs/dbraw/zinc/16/14/37/1031161437.db2.gz XOTTVGLNTUZWNP-IYBDPMFKSA-N 1 1 306.400 3.682 20 10 DHCDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000844718289 1031303791 /nfs/dbraw/zinc/30/37/91/1031303791.db2.gz GEBUMAIMEWFZEX-MRXNPFEDSA-N 1 1 321.461 3.785 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CNc2ccccc2C1)c1ccc(F)cc1O ZINC000844921743 1031402059 /nfs/dbraw/zinc/40/20/59/1031402059.db2.gz SMKLDJDMXMBPFN-GOEBONIOSA-N 1 1 300.377 3.609 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872030478 1031414392 /nfs/dbraw/zinc/41/43/92/1031414392.db2.gz GDBPXQNQZJRHFZ-LLVKDONJSA-N 1 1 316.332 3.520 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001144292627 1031432229 /nfs/dbraw/zinc/43/22/29/1031432229.db2.gz GVBOGILYMKCBSH-AOOOYVTPSA-N 1 1 314.198 3.526 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001144292627 1031432244 /nfs/dbraw/zinc/43/22/44/1031432244.db2.gz GVBOGILYMKCBSH-AOOOYVTPSA-N 1 1 314.198 3.526 20 10 DHCDMO C[C@H]1C[C@H](C)C[NH+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144306869 1031456318 /nfs/dbraw/zinc/45/63/18/1031456318.db2.gz UYMWXVJTCHNBLY-UWVGGRQHSA-N 1 1 316.214 3.772 20 10 DHCDMO COc1ccccc1-c1cnc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000360521311 1031460395 /nfs/dbraw/zinc/46/03/95/1031460395.db2.gz BBAKTJUWYKQDAH-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO COc1ccccc1-c1cnc(C[N@@H+](C)Cc2ccccc2O)o1 ZINC000360521311 1031460401 /nfs/dbraw/zinc/46/04/01/1031460401.db2.gz BBAKTJUWYKQDAH-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO Cc1nc(CC[NH2+]Cc2cc(Cl)c(F)cc2O)sc1C ZINC000293636819 1031549206 /nfs/dbraw/zinc/54/92/06/1031549206.db2.gz NQCOIMLWMDABFO-UHFFFAOYSA-N 1 1 314.813 3.590 20 10 DHCDMO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293697605 1031574585 /nfs/dbraw/zinc/57/45/85/1031574585.db2.gz SUNWLHYVQHOITK-AWEZNQCLSA-N 1 1 307.752 3.667 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)c1 ZINC000872817449 1031666512 /nfs/dbraw/zinc/66/65/12/1031666512.db2.gz ZTVUEIROEZNXMT-JSGCOSHPSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](C(F)(F)F)O[C@@H](C)C2)c1 ZINC000872817448 1031667199 /nfs/dbraw/zinc/66/71/99/1031667199.db2.gz ZTVUEIROEZNXMT-GXTWGEPZSA-N 1 1 317.351 3.551 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)c(O)c1 ZINC001144514658 1031672483 /nfs/dbraw/zinc/67/24/83/1031672483.db2.gz NTUXITJIHYVDLR-OAHLLOKOSA-N 1 1 313.397 3.573 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c(O)c1 ZINC001144515617 1031675799 /nfs/dbraw/zinc/67/57/99/1031675799.db2.gz SRKISHHCSKINNK-HNNXBMFYSA-N 1 1 319.788 3.794 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](CCO)c2ccco2)cc1C ZINC000873105958 1031713413 /nfs/dbraw/zinc/71/34/13/1031713413.db2.gz DWIAQNUOZVMLLN-INIZCTEOSA-N 1 1 303.402 3.590 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@](C)(O)c1ccccc1 ZINC000846043854 1031839402 /nfs/dbraw/zinc/83/94/02/1031839402.db2.gz LPYJRDLKKKOLFZ-PIGZYNQJSA-N 1 1 323.795 3.571 20 10 DHCDMO FC1(F)C[C@]12CC[N@@H+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000846117185 1031866635 /nfs/dbraw/zinc/86/66/35/1031866635.db2.gz OFHWZGOBUOEVQR-KRWDZBQOSA-N 1 1 306.400 3.908 20 10 DHCDMO COc1cccc([C@H](C)NCCC[NH+](C(C)C)C(C)C)c1O ZINC000846149130 1031883619 /nfs/dbraw/zinc/88/36/19/1031883619.db2.gz WFOBTALPJXKLRI-HNNXBMFYSA-N 1 1 308.466 3.560 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1cccc(C(F)(F)F)c1O ZINC000846205387 1031911146 /nfs/dbraw/zinc/91/11/46/1031911146.db2.gz PGJMRXQAGGJGKP-WDEREUQCSA-N 1 1 317.351 3.877 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000898323179 1032021689 /nfs/dbraw/zinc/02/16/89/1032021689.db2.gz ZBVWWGFZYDJVNK-INIZCTEOSA-N 1 1 306.768 3.821 20 10 DHCDMO Cc1cccc(O)c1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000877469854 1033310111 /nfs/dbraw/zinc/31/01/11/1033310111.db2.gz AKQGRKZMWFMSQK-ZDUSSCGKSA-N 1 1 315.417 3.982 20 10 DHCDMO OC1CCN(c2ccc(CNc3cc(C4CC4)cc[nH+]3)cc2)CC1 ZINC000877542091 1033347232 /nfs/dbraw/zinc/34/72/32/1033347232.db2.gz VBTHIJUSLVALIQ-UHFFFAOYSA-N 1 1 323.440 3.532 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000302742702 1033347839 /nfs/dbraw/zinc/34/78/39/1033347839.db2.gz SCIGYYODNWGGRQ-UHFFFAOYSA-N 1 1 313.401 3.683 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](O)C[C@H]1c1ccccc1 ZINC000877672368 1033405637 /nfs/dbraw/zinc/40/56/37/1033405637.db2.gz CPRHVIVTDVQTRU-SJORKVTESA-N 1 1 317.816 3.744 20 10 DHCDMO COc1cc(C[N@@H+]2Cc3cccc(O)c3C2)ccc1OC(F)F ZINC000877703757 1033417747 /nfs/dbraw/zinc/41/77/47/1033417747.db2.gz SQNSPLDXFDMMHU-UHFFFAOYSA-N 1 1 321.323 3.518 20 10 DHCDMO COc1cc(C[N@H+]2Cc3cccc(O)c3C2)ccc1OC(F)F ZINC000877703757 1033417752 /nfs/dbraw/zinc/41/77/52/1033417752.db2.gz SQNSPLDXFDMMHU-UHFFFAOYSA-N 1 1 321.323 3.518 20 10 DHCDMO C[NH+](C)C1(C)CCC([NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000877711354 1033421318 /nfs/dbraw/zinc/42/13/18/1033421318.db2.gz FKPGQTLJSIQZBB-UHFFFAOYSA-N 1 1 312.457 3.898 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)c(O)c1 ZINC000877811963 1033459693 /nfs/dbraw/zinc/45/96/93/1033459693.db2.gz DFXNRYFWRMYCPD-CQSZACIVSA-N 1 1 303.324 3.565 20 10 DHCDMO Cc1csc([C@@H]2CC[N@H+](Cc3ccc(N(C)C)c(F)c3)C2)n1 ZINC000877813711 1033464236 /nfs/dbraw/zinc/46/42/36/1033464236.db2.gz OEZMBOIJAOTUSF-CQSZACIVSA-N 1 1 319.449 3.646 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)cc1Cl ZINC000826016418 1033582731 /nfs/dbraw/zinc/58/27/31/1033582731.db2.gz IOUJZYNWOAHNIH-QGZVFWFLSA-N 1 1 311.853 3.585 20 10 DHCDMO C[C@@]1(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCCS1 ZINC000862212093 1033780008 /nfs/dbraw/zinc/78/00/08/1033780008.db2.gz GMNYWQMXVDUDSV-WMZOPIPTSA-N 1 1 321.486 3.659 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cccc3n[nH]cc32)C2CC2)cc1 ZINC000862218357 1033783626 /nfs/dbraw/zinc/78/36/26/1033783626.db2.gz KIGZFZZJRIYHSN-UHFFFAOYSA-N 1 1 320.440 3.794 20 10 DHCDMO COc1ccc(N2CCC(n3c[nH+]c4c3CCCC4)CC2)cc1 ZINC000862431975 1033850478 /nfs/dbraw/zinc/85/04/78/1033850478.db2.gz YHUXGVOQJPCLNR-UHFFFAOYSA-N 1 1 311.429 3.612 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1 ZINC000862473093 1033863108 /nfs/dbraw/zinc/86/31/08/1033863108.db2.gz DWDFROBROKQPFC-GUDHTMSVSA-N 1 1 302.487 3.736 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1O ZINC000862473036 1033863846 /nfs/dbraw/zinc/86/38/46/1033863846.db2.gz BFPXTUZSCHQZPF-OLZOCXBDSA-N 1 1 313.850 3.524 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)c1O ZINC000862528870 1033874133 /nfs/dbraw/zinc/87/41/33/1033874133.db2.gz KVCSFQRPAKEWJE-OKZBNKHCSA-N 1 1 309.409 3.636 20 10 DHCDMO Oc1ccc([C@@H]2CC[N@@H+](Cc3c(O)cccc3Cl)C2)cc1 ZINC000862541551 1033881237 /nfs/dbraw/zinc/88/12/37/1033881237.db2.gz WECUDPXBUQHTST-CYBMUJFWSA-N 1 1 303.789 3.741 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](CCF)C2)c(O)c(C(C)(C)C)c1 ZINC000863315896 1034062495 /nfs/dbraw/zinc/06/24/95/1034062495.db2.gz HORFMJMRUFDHQY-HNNXBMFYSA-N 1 1 309.425 3.559 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C)O[C@H](C3CC3)C2)cc1C(C)C ZINC000794647378 1034313723 /nfs/dbraw/zinc/31/37/23/1034313723.db2.gz OYXFFVMKRZQSAW-KUHUBIRLSA-N 1 1 303.446 3.823 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000179574108 1034317544 /nfs/dbraw/zinc/31/75/44/1034317544.db2.gz OBFUBUXEKQIJPU-UHFFFAOYSA-N 1 1 311.425 3.821 20 10 DHCDMO CCOCc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1OC ZINC000179802870 1034336258 /nfs/dbraw/zinc/33/62/58/1034336258.db2.gz JNLOEHNZTFRYTC-UHFFFAOYSA-N 1 1 315.413 3.569 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2ccncc2)c1O ZINC000184744936 1034498230 /nfs/dbraw/zinc/49/82/30/1034498230.db2.gz YSZUCKOHCDNIIS-NSHDSACASA-N 1 1 306.793 3.642 20 10 DHCDMO CCOc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1OC ZINC000185009547 1034519178 /nfs/dbraw/zinc/51/91/78/1034519178.db2.gz OZMGPXIZOBTVSF-GFCCVEGCSA-N 1 1 319.376 3.789 20 10 DHCDMO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185143183 1034531058 /nfs/dbraw/zinc/53/10/58/1034531058.db2.gz IIKFFDMZKQOIHZ-GFCCVEGCSA-N 1 1 304.365 3.566 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)c(O)c1 ZINC000185459589 1034549195 /nfs/dbraw/zinc/54/91/95/1034549195.db2.gz IGXNOOOZEUMESQ-CQSZACIVSA-N 1 1 316.420 3.752 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185643526 1034561715 /nfs/dbraw/zinc/56/17/15/1034561715.db2.gz SEUCZYWTXMBBQH-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185643526 1034561724 /nfs/dbraw/zinc/56/17/24/1034561724.db2.gz SEUCZYWTXMBBQH-QGZVFWFLSA-N 1 1 303.789 3.619 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000120545246 1034633867 /nfs/dbraw/zinc/63/38/67/1034633867.db2.gz QGXRZPLWZIOYLL-MRXNPFEDSA-N 1 1 317.454 3.943 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1[O-] ZINC000186518304 1034639363 /nfs/dbraw/zinc/63/93/63/1034639363.db2.gz UGACFSIQHDCTFH-RBSFLKMASA-N 1 1 320.452 3.835 20 10 DHCDMO C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC001206297666 1035361327 /nfs/dbraw/zinc/36/13/27/1035361327.db2.gz ZRNXFJBXNVACRX-HNNXBMFYSA-N 1 1 317.260 3.650 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000195134663 1035415465 /nfs/dbraw/zinc/41/54/65/1035415465.db2.gz XPGHJKOOTMZXDK-AEFFLSMTSA-N 1 1 310.441 3.565 20 10 DHCDMO Cc1ccc(NCc2ccc(N3CCCC3)cc2)c(N(C)C)[nH+]1 ZINC001178377881 1035424077 /nfs/dbraw/zinc/42/40/77/1035424077.db2.gz VMZCUWFNIVPUHV-UHFFFAOYSA-N 1 1 310.445 3.668 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000773756013 1035436055 /nfs/dbraw/zinc/43/60/55/1035436055.db2.gz SSTWEMLEVXPMDV-FQEVSTJZSA-N 1 1 310.441 3.716 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000773756013 1035436057 /nfs/dbraw/zinc/43/60/57/1035436057.db2.gz SSTWEMLEVXPMDV-FQEVSTJZSA-N 1 1 310.441 3.716 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000773766725 1035443241 /nfs/dbraw/zinc/44/32/41/1035443241.db2.gz UWOIACXACMWWIW-SFHVURJKSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000773766725 1035443244 /nfs/dbraw/zinc/44/32/44/1035443244.db2.gz UWOIACXACMWWIW-SFHVURJKSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(CC)c1ccc(CN[C@H]2CC[N@H+](C(C)(C)C)C2)cc1F ZINC001179139434 1035466485 /nfs/dbraw/zinc/46/64/85/1035466485.db2.gz HFLBZZFQPHLVBW-INIZCTEOSA-N 1 1 321.484 3.634 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2CCN(C(C)(C)C)C2)cc1F ZINC001179139434 1035466488 /nfs/dbraw/zinc/46/64/88/1035466488.db2.gz HFLBZZFQPHLVBW-INIZCTEOSA-N 1 1 321.484 3.634 20 10 DHCDMO COCC1([NH2+]Cc2c(O)ccc(Cl)c2F)CCCCC1 ZINC001179242454 1035470590 /nfs/dbraw/zinc/47/05/90/1035470590.db2.gz FVOBSSYSGHKTAF-UHFFFAOYSA-N 1 1 301.789 3.624 20 10 DHCDMO Cc1cc([O-])c(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c(Cl)c1 ZINC001180165182 1035617303 /nfs/dbraw/zinc/61/73/03/1035617303.db2.gz DWLATBHGQPGQHD-UHFFFAOYSA-N 1 1 324.896 3.906 20 10 DHCDMO Cc1cc([O-])c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(Cl)c1 ZINC001180165182 1035617308 /nfs/dbraw/zinc/61/73/08/1035617308.db2.gz DWLATBHGQPGQHD-UHFFFAOYSA-N 1 1 324.896 3.906 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@]2(C)Cc2ccccc2)c1 ZINC001180593865 1035727529 /nfs/dbraw/zinc/72/75/29/1035727529.db2.gz PORPVVQBTLIEOS-FQEVSTJZSA-N 1 1 311.425 3.998 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)OC)[C@@H](C)CC ZINC001193840259 1035735486 /nfs/dbraw/zinc/73/54/86/1035735486.db2.gz YAEAEGWPTSHGPC-WMLDXEAASA-N 1 1 307.434 3.582 20 10 DHCDMO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(O)c1 ZINC001204280608 1035757649 /nfs/dbraw/zinc/75/76/49/1035757649.db2.gz LJZUSAGZEPHZNK-MRXNPFEDSA-N 1 1 305.324 3.713 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2[O-])CC[C@@H]1C[NH3+] ZINC001205651216 1035760463 /nfs/dbraw/zinc/76/04/63/1035760463.db2.gz BBSJXVIJUKZSCS-WDEREUQCSA-N 1 1 317.260 3.506 20 10 DHCDMO Cc1ccc(N2CCC[N@@H+](Cc3cccc(C)c3O)CC2)cc1 ZINC000775633874 1036125304 /nfs/dbraw/zinc/12/53/04/1036125304.db2.gz MNGLTSYVYPEJCJ-UHFFFAOYSA-N 1 1 310.441 3.721 20 10 DHCDMO Cn1cccc1[C@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775644519 1036182278 /nfs/dbraw/zinc/18/22/78/1036182278.db2.gz MTZYLWHVHCPRSG-OAHLLOKOSA-N 1 1 308.784 3.860 20 10 DHCDMO C[C@H]([NH2+]C[C@H](C1CC1)N(C)C)c1cc(Cl)c(Cl)cc1O ZINC000774131707 1036189019 /nfs/dbraw/zinc/18/90/19/1036189019.db2.gz RJCSWJQZIOOOFI-LKFCYVNXSA-N 1 1 317.260 3.690 20 10 DHCDMO C[C@@H]([NH2+]CC1(O)CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000774189316 1036217951 /nfs/dbraw/zinc/21/79/51/1036217951.db2.gz WBCOMOXEWSKMTF-SECBINFHSA-N 1 1 304.217 3.655 20 10 DHCDMO C[C@H]([NH2+]C[C@](C)(O)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774184966 1036234523 /nfs/dbraw/zinc/23/45/23/1036234523.db2.gz TZCSOLRXHIKJEI-RTHLEPHNSA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@H]([NH2+]C[C@@](C)(O)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774184965 1036235376 /nfs/dbraw/zinc/23/53/76/1036235376.db2.gz TZCSOLRXHIKJEI-RMLUDKJBSA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@@H]([NH2+]C[C@](C)(O)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774184964 1036236937 /nfs/dbraw/zinc/23/69/37/1036236937.db2.gz TZCSOLRXHIKJEI-CLAHSXSESA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774266306 1036268981 /nfs/dbraw/zinc/26/89/81/1036268981.db2.gz NEJJTIXEQZPUGK-WCBMZHEXSA-N 1 1 304.217 3.511 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)CCCOc2ccccc2C)c1 ZINC000775658003 1036277158 /nfs/dbraw/zinc/27/71/58/1036277158.db2.gz KNRZVFBPLWUMMU-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1O ZINC000775676317 1036400008 /nfs/dbraw/zinc/40/00/08/1036400008.db2.gz QITMLIRDDCZEKW-UHFFFAOYSA-N 1 1 307.397 3.626 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1O ZINC000775676317 1036400020 /nfs/dbraw/zinc/40/00/20/1036400020.db2.gz QITMLIRDDCZEKW-UHFFFAOYSA-N 1 1 307.397 3.626 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000775680405 1036409425 /nfs/dbraw/zinc/40/94/25/1036409425.db2.gz BYHJYVKWAPAOKH-AWEZNQCLSA-N 1 1 301.361 3.529 20 10 DHCDMO C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@@H](CCO)c1ccccc1 ZINC000775698701 1036474106 /nfs/dbraw/zinc/47/41/06/1036474106.db2.gz QXYSAAGPTUCXOR-INIZCTEOSA-N 1 1 323.795 3.740 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+]CC1CCc2ccccc2CC1 ZINC001183052941 1036512678 /nfs/dbraw/zinc/51/26/78/1036512678.db2.gz CWRGPGJXIYFVHV-UHFFFAOYSA-N 1 1 317.379 3.955 20 10 DHCDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775725066 1036566620 /nfs/dbraw/zinc/56/66/20/1036566620.db2.gz GRYZTLUSZLXWNN-UHFFFAOYSA-N 1 1 314.813 3.706 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H](CC(=O)OC(C)(C)C)C2)c1O ZINC000775737516 1036585053 /nfs/dbraw/zinc/58/50/53/1036585053.db2.gz JFEIEHSBRWJTDI-HNNXBMFYSA-N 1 1 319.445 3.644 20 10 DHCDMO COc1ccc(O)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC000775737860 1036598091 /nfs/dbraw/zinc/59/80/91/1036598091.db2.gz NNGZSXFUBWYBNC-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC000775737860 1036598100 /nfs/dbraw/zinc/59/81/00/1036598100.db2.gz NNGZSXFUBWYBNC-NSHDSACASA-N 1 1 319.351 3.798 20 10 DHCDMO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2F)C12CCC2 ZINC001183920314 1036711370 /nfs/dbraw/zinc/71/13/70/1036711370.db2.gz WWPGFRNQEFXSEH-CVEARBPZSA-N 1 1 307.409 3.747 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H]2COC(C)(C)C)ccc1N(C)C ZINC001197629076 1036811798 /nfs/dbraw/zinc/81/17/98/1036811798.db2.gz AYLGMRMYCJRHBQ-QGZVFWFLSA-N 1 1 304.478 3.841 20 10 DHCDMO C[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(N(C)C)cc1 ZINC000775832725 1036985817 /nfs/dbraw/zinc/98/58/17/1036985817.db2.gz AULRYMHXWDBMJF-LBPRGKRZSA-N 1 1 313.376 3.884 20 10 DHCDMO CCC(CC)C[N@H+](CC)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774841972 1037070538 /nfs/dbraw/zinc/07/05/38/1037070538.db2.gz SHWCRZKTLCDIAB-UHFFFAOYSA-N 1 1 310.394 3.567 20 10 DHCDMO CCC(CC)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774841972 1037070555 /nfs/dbraw/zinc/07/05/55/1037070555.db2.gz SHWCRZKTLCDIAB-UHFFFAOYSA-N 1 1 310.394 3.567 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776014249 1037298197 /nfs/dbraw/zinc/29/81/97/1037298197.db2.gz QQNQWGWHDSWUSP-GXFFZTMASA-N 1 1 303.324 3.564 20 10 DHCDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000776013176 1037298453 /nfs/dbraw/zinc/29/84/53/1037298453.db2.gz LAINGGNPSGNZGW-SWLSCSKDSA-N 1 1 300.368 3.915 20 10 DHCDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2ccccc2O)cc1F ZINC000761504915 1037339695 /nfs/dbraw/zinc/33/96/95/1037339695.db2.gz AOOLGGPXLZMKEA-CQSZACIVSA-N 1 1 317.404 3.851 20 10 DHCDMO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775005245 1037364138 /nfs/dbraw/zinc/36/41/38/1037364138.db2.gz QKPMPIIEXPHMMF-TZMCWYRMSA-N 1 1 322.405 3.758 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001203636134 1037365722 /nfs/dbraw/zinc/36/57/22/1037365722.db2.gz PRBNYZOYBROSGU-NWDGAFQWSA-N 1 1 310.235 3.777 20 10 DHCDMO CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775028990 1037436304 /nfs/dbraw/zinc/43/63/04/1037436304.db2.gz JHWCYLOVINXQFS-JSGCOSHPSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000775033245 1037443571 /nfs/dbraw/zinc/44/35/71/1037443571.db2.gz NVTZUXOCLTUMCD-DGCLKSJQSA-N 1 1 322.405 3.613 20 10 DHCDMO CCC(CC)(CC)C[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775036216 1037452453 /nfs/dbraw/zinc/45/24/53/1037452453.db2.gz DCJIAOLBRCSOCR-UHFFFAOYSA-N 1 1 310.394 3.615 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3CCOC(C)(C)[C@@H]3C)c2c1 ZINC000763213908 1037487544 /nfs/dbraw/zinc/48/75/44/1037487544.db2.gz VVXPKRQZEOBABP-ZDUSSCGKSA-N 1 1 315.413 3.553 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2-n2cccn2)cc1 ZINC000155177643 1037526287 /nfs/dbraw/zinc/52/62/87/1037526287.db2.gz LMCADTKPMXVWCJ-UHFFFAOYSA-N 1 1 320.440 3.570 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c(O)c1 ZINC000775136792 1037688949 /nfs/dbraw/zinc/68/89/49/1037688949.db2.gz LTUQUKXKPGRKRN-NSHDSACASA-N 1 1 303.324 3.565 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)CC1CCC1 ZINC000775175584 1037911016 /nfs/dbraw/zinc/91/10/16/1037911016.db2.gz GIJKYHQKGWGCCD-UHFFFAOYSA-N 1 1 320.452 3.673 20 10 DHCDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc(OCC)cc1O ZINC000775203040 1038002286 /nfs/dbraw/zinc/00/22/86/1038002286.db2.gz JANIWIJMVTWKHK-SFHVURJKSA-N 1 1 307.434 3.572 20 10 DHCDMO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccccc1O ZINC000775487341 1038556131 /nfs/dbraw/zinc/55/61/31/1038556131.db2.gz LYQPETDPFYDVAY-HKUYNNGSSA-N 1 1 321.424 3.956 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]CC2(CN(C)C)CCCC2)c2c1c(F)ccc2O ZINC000760896574 1039032425 /nfs/dbraw/zinc/03/24/25/1039032425.db2.gz HGAOYXZFZVQWJS-DZGCQCFKSA-N 1 1 320.452 3.791 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc2ccccc2c1[O-] ZINC000171141661 1039283851 /nfs/dbraw/zinc/28/38/51/1039283851.db2.gz NJAFUWQPUFQRCP-JKSUJKDBSA-N 1 1 312.457 3.928 20 10 DHCDMO C[N@H+](Cc1ccccc1O)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172179904 1039766739 /nfs/dbraw/zinc/76/67/39/1039766739.db2.gz RHYIVSBDFVGLFK-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172179904 1039766751 /nfs/dbraw/zinc/76/67/51/1039766751.db2.gz RHYIVSBDFVGLFK-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO COc1cccc(C[N@@H+](Cc2ccccc2O)C2CCCC2)n1 ZINC000172193926 1039771351 /nfs/dbraw/zinc/77/13/51/1039771351.db2.gz WBQPYILTSATUGC-UHFFFAOYSA-N 1 1 312.413 3.741 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CCOCC2(CCC2)C1 ZINC000761226338 1040823955 /nfs/dbraw/zinc/82/39/55/1040823955.db2.gz OXVPRTZXWKAJOX-UHFFFAOYSA-N 1 1 314.473 3.679 20 10 DHCDMO CCOc1cccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000093315651 193229719 /nfs/dbraw/zinc/22/97/19/193229719.db2.gz TYYZUKYYSNVFAJ-ZDUSSCGKSA-N 1 1 301.386 3.690 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)c(O)c1C ZINC000273525902 130131942 /nfs/dbraw/zinc/13/19/42/130131942.db2.gz VCLLMCATTRIGHI-MLGOLLRUSA-N 1 1 321.367 3.671 20 10 DHCDMO Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000273599665 130142434 /nfs/dbraw/zinc/14/24/34/130142434.db2.gz RQUVYXOVTQVOHB-VIFPVBQESA-N 1 1 314.216 3.555 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000294986477 335129613 /nfs/dbraw/zinc/12/96/13/335129613.db2.gz KFFGXSSTJZIFCK-WCQYABFASA-N 1 1 317.351 3.954 20 10 DHCDMO CC[C@H]([NH2+]C[C@](C)(O)c1ccsc1)c1ccc(F)cc1O ZINC000286244415 334152285 /nfs/dbraw/zinc/15/22/85/334152285.db2.gz UCTZUHMYANZRCD-HOCLYGCPSA-N 1 1 309.406 3.541 20 10 DHCDMO CC[C@@H]([NH2+]Cc1nc(C)n2c1CCCC2)c1ccc(F)cc1O ZINC000368616593 336849288 /nfs/dbraw/zinc/84/92/88/336849288.db2.gz DQODLHWYWZPHBN-OAHLLOKOSA-N 1 1 317.408 3.613 20 10 DHCDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000371871234 336915378 /nfs/dbraw/zinc/91/53/78/336915378.db2.gz YLNVKQBFUFOLRA-BZNIZROVSA-N 1 1 317.360 3.714 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000373821094 336973848 /nfs/dbraw/zinc/97/38/48/336973848.db2.gz FHZCEQAHLXUAHF-HNNXBMFYSA-N 1 1 313.800 3.576 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1 ZINC000375531016 337012996 /nfs/dbraw/zinc/01/29/96/337012996.db2.gz YQSVPCQJJPXCPG-SCTDSRPQSA-N 1 1 303.446 3.606 20 10 DHCDMO Oc1c(Cl)cccc1CN1CCO[C@H](c2ccsc2)C1 ZINC000180545499 337176251 /nfs/dbraw/zinc/17/62/51/337176251.db2.gz SMGUDUXGDSVSJT-AWEZNQCLSA-N 1 1 309.818 3.681 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1noc(-c2ccccc2)n1 ZINC000183562730 337192375 /nfs/dbraw/zinc/19/23/75/337192375.db2.gz VMFWGGQNAVLECS-QWHCGFSZSA-N 1 1 309.369 3.854 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CC[NH2+]C12CCC2)c1ccc(Cl)c(Cl)c1[O-] ZINC000530215826 340782701 /nfs/dbraw/zinc/78/27/01/340782701.db2.gz JLKGQSYPUOXNTL-SKDRFNHKSA-N 1 1 315.244 3.634 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000179951166 521338636 /nfs/dbraw/zinc/33/86/36/521338636.db2.gz KPYUYFDOUAJBJW-GFCCVEGCSA-N 1 1 303.324 3.565 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1cc(OC)ccc1O ZINC000179929345 521690145 /nfs/dbraw/zinc/69/01/45/521690145.db2.gz CVJLSXNLVHKYIO-UHFFFAOYSA-N 1 1 301.386 3.519 20 10 DHCDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000266194858 524050718 /nfs/dbraw/zinc/05/07/18/524050718.db2.gz ZTOPSOHJQVOMIN-INIZCTEOSA-N 1 1 320.408 3.524 20 10 DHCDMO COc1ccc(O)c(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)c1 ZINC000180231788 524734953 /nfs/dbraw/zinc/73/49/53/524734953.db2.gz DFTLZOJLEMKZNL-HNNXBMFYSA-N 1 1 318.442 3.675 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2c2csc(C)n2)c1 ZINC000189926447 524740926 /nfs/dbraw/zinc/74/09/26/524740926.db2.gz ICIAOUXVGGTKOQ-HNNXBMFYSA-N 1 1 304.415 3.503 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c1O ZINC000131578941 525916240 /nfs/dbraw/zinc/91/62/40/525916240.db2.gz CRHGXMMKYQGYER-NSHDSACASA-N 1 1 307.340 3.872 20 10 DHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc(Cl)c2[O-])C1 ZINC000287753855 534957905 /nfs/dbraw/zinc/95/79/05/534957905.db2.gz QMGBDPASPOCDSI-CZUORRHYSA-N 1 1 310.869 3.818 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]Cc2csc(COC)n2)cc1 ZINC000289587574 535765435 /nfs/dbraw/zinc/76/54/35/535765435.db2.gz BUXCFRITIHTQRB-ZDUSSCGKSA-N 1 1 319.474 3.596 20 10 DHCDMO CC[C@H]([NH2+]C1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287271561 535894179 /nfs/dbraw/zinc/89/41/79/535894179.db2.gz AXTGNWMDNPGFBC-AWEZNQCLSA-N 1 1 317.260 3.834 20 10 DHCDMO CC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(Cl)c1[O-] ZINC000287704019 535894768 /nfs/dbraw/zinc/89/47/68/535894768.db2.gz NTBLPVWONPYLMA-INIZCTEOSA-N 1 1 308.853 3.713 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccc(COC)c1)c1ccc(F)cc1O ZINC000285532674 535919876 /nfs/dbraw/zinc/91/98/76/535919876.db2.gz FMWYLWKYLCDCOO-KRWDZBQOSA-N 1 1 303.377 3.919 20 10 DHCDMO Cc1ccc(O)c([C@H](C)[NH2+]CCCN(C)Cc2ccccc2)c1 ZINC000302868060 1013475294 /nfs/dbraw/zinc/47/52/94/1013475294.db2.gz CYXVGNJHSSPPGK-KRWDZBQOSA-N 1 1 312.457 3.873 20 10 DHCDMO COC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccco1 ZINC000177576425 1013742199 /nfs/dbraw/zinc/74/21/99/1013742199.db2.gz HUICLKBYQZANJM-GOSISDBHSA-N 1 1 314.429 3.747 20 10 DHCDMO Cc1ccc(C)c(C[N@H+](CCN(C)C)Cc2ccccc2)c1O ZINC001140179220 1013788117 /nfs/dbraw/zinc/78/81/17/1013788117.db2.gz CHWOLSSNVBUJHE-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1ccc(C)c(C[N@@H+](CCN(C)C)Cc2ccccc2)c1O ZINC001140179220 1013788123 /nfs/dbraw/zinc/78/81/23/1013788123.db2.gz CHWOLSSNVBUJHE-UHFFFAOYSA-N 1 1 312.457 3.573 20 10 DHCDMO Cc1ccc(C)c(C[N@@H+](C)CCC(=O)c2cccs2)c1O ZINC001140183345 1013798506 /nfs/dbraw/zinc/79/85/06/1013798506.db2.gz COWWFXYIFCUVPA-UHFFFAOYSA-N 1 1 303.427 3.775 20 10 DHCDMO Oc1c(Br)cccc1C[NH+]1CCC(C2CC2)CC1 ZINC000814172499 1027908752 /nfs/dbraw/zinc/90/87/52/1027908752.db2.gz PQCKSSQZPNVSCR-UHFFFAOYSA-N 1 1 310.235 3.777 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001140337731 1014613377 /nfs/dbraw/zinc/61/33/77/1014613377.db2.gz BMVRDWRTIORLRY-PSASIEDQSA-N 1 1 311.706 3.625 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(F)cc(F)c1O ZINC000834883797 1014939759 /nfs/dbraw/zinc/93/97/59/1014939759.db2.gz HOSRIDXEDMUNTR-KRTXAFLBSA-N 1 1 310.171 3.905 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(OC)cc1F)c1ccc(F)cc1O ZINC000796833311 1015031547 /nfs/dbraw/zinc/03/15/47/1015031547.db2.gz ITBKDEYRVWDYPT-INIZCTEOSA-N 1 1 307.340 3.920 20 10 DHCDMO CC[N@@H+](Cc1cnn(C2CCC2)c1)Cc1ccc(N(C)C)cc1 ZINC000891435700 1015038081 /nfs/dbraw/zinc/03/80/81/1015038081.db2.gz HAVZQDBNYUGMBQ-UHFFFAOYSA-N 1 1 312.461 3.696 20 10 DHCDMO CCn1cc(C[N@H+]2Cc3cccc(O)c3C2)c(-c2ccccc2)n1 ZINC000895449204 1015157427 /nfs/dbraw/zinc/15/74/27/1015157427.db2.gz FOTLFJQTMHDWCY-UHFFFAOYSA-N 1 1 319.408 3.791 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000754742256 1015197987 /nfs/dbraw/zinc/19/79/87/1015197987.db2.gz UVTMNDATXAGEQF-GOSISDBHSA-N 1 1 303.446 3.933 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](c3nccs3)C2)c(Cl)c1 ZINC000895585452 1015213274 /nfs/dbraw/zinc/21/32/74/1015213274.db2.gz XRTRHMOJNZTHJJ-NSHDSACASA-N 1 1 308.834 3.800 20 10 DHCDMO Cc1cc(C[N@H+](C)C[C@H](C)c2nccs2)ccc1N(C)C ZINC000294685079 1032114409 /nfs/dbraw/zinc/11/44/09/1032114409.db2.gz SUBDDTHZMDAEJP-AWEZNQCLSA-N 1 1 303.475 3.753 20 10 DHCDMO Oc1ccc(F)cc1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000895788295 1015302463 /nfs/dbraw/zinc/30/24/63/1015302463.db2.gz OFHFYGXHYQYEDQ-FZMZJTMJSA-N 1 1 303.299 3.696 20 10 DHCDMO Cc1ccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c(O)c1 ZINC000896225270 1015511148 /nfs/dbraw/zinc/51/11/48/1015511148.db2.gz WYKFYYIPANBCPZ-CYBMUJFWSA-N 1 1 303.299 3.567 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c1O ZINC000896224694 1015507409 /nfs/dbraw/zinc/50/74/09/1015507409.db2.gz NEAMCNCUWXRIKX-CQSZACIVSA-N 1 1 317.326 3.821 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2c(O)cccc2F)cc1OC ZINC000896642507 1015689528 /nfs/dbraw/zinc/68/95/28/1015689528.db2.gz YLYQRRLOTWQMKG-UHFFFAOYSA-N 1 1 319.376 3.619 20 10 DHCDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c(O)c1OC ZINC000892036766 1016140489 /nfs/dbraw/zinc/14/04/89/1016140489.db2.gz QADKMFAKQUHHSP-UMVBOHGHSA-N 1 1 305.418 3.562 20 10 DHCDMO Cc1cc(Br)cc(C[N@@H+]2C[C@H](C)[C@H](C)[C@H]2C)c1O ZINC000399575832 1016167373 /nfs/dbraw/zinc/16/73/73/1016167373.db2.gz HWNRMLLLBUYZHS-SDDRHHMPSA-N 1 1 312.251 3.939 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000184880649 1016412824 /nfs/dbraw/zinc/41/28/24/1016412824.db2.gz IHFZWPDYVRQXNG-AWEZNQCLSA-N 1 1 320.483 3.756 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000184880649 1016412831 /nfs/dbraw/zinc/41/28/31/1016412831.db2.gz IHFZWPDYVRQXNG-AWEZNQCLSA-N 1 1 320.483 3.756 20 10 DHCDMO COc1ccc(CCC[NH2+][C@@H](C)c2ccc(F)cc2O)cc1 ZINC000185095004 1016547627 /nfs/dbraw/zinc/54/76/27/1016547627.db2.gz JDQOYUNZAGPFRE-ZDUSSCGKSA-N 1 1 303.377 3.823 20 10 DHCDMO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1O)c1ccco1 ZINC000185227885 1016769596 /nfs/dbraw/zinc/76/95/96/1016769596.db2.gz LAJGYRSYKBLWLK-BBRMVZONSA-N 1 1 320.408 3.858 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCSC[C@H]2C2CCC2)cc1 ZINC001171343932 1032493747 /nfs/dbraw/zinc/49/37/47/1032493747.db2.gz MOIYDVMVNUXLNH-SFHVURJKSA-N 1 1 304.503 3.860 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@H](CN[C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074817 1032548208 /nfs/dbraw/zinc/54/82/08/1032548208.db2.gz HZEDNPLVTICRFU-QZTJIDSGSA-N 1 1 317.521 3.771 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@H](CN[C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074817 1032548213 /nfs/dbraw/zinc/54/82/13/1032548213.db2.gz HZEDNPLVTICRFU-QZTJIDSGSA-N 1 1 317.521 3.771 20 10 DHCDMO CC(=O)Nc1cc[nH+]c(NCc2cc3ccccc3cc2O)c1 ZINC001171399776 1032582218 /nfs/dbraw/zinc/58/22/18/1032582218.db2.gz LJCOYJNFOJNFOD-UHFFFAOYSA-N 1 1 307.353 3.511 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@]3(CC=CCC3)C2)cc1OC ZINC000160202378 1012018554 /nfs/dbraw/zinc/01/85/54/1012018554.db2.gz MHMAILGNFQVOGL-LJQANCHMSA-N 1 1 317.429 3.732 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC[C@H](C[C@@H]3CCOC3)C1)CCC2 ZINC000773260612 1032664913 /nfs/dbraw/zinc/66/49/13/1032664913.db2.gz YLSXOGYRNSIUGQ-CVEARBPZSA-N 1 1 315.457 3.520 20 10 DHCDMO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000185743298 1017136648 /nfs/dbraw/zinc/13/66/48/1017136648.db2.gz PCVPCEIWIMBCCT-MEDUHNTESA-N 1 1 301.361 3.878 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000305740979 1017529451 /nfs/dbraw/zinc/52/94/51/1017529451.db2.gz DUGOCHXGGNAHPE-LJQANCHMSA-N 1 1 323.392 3.721 20 10 DHCDMO CC[C@H]([NH2+]CC(C)(F)F)c1cc(Br)ccc1O ZINC000700111146 1017821019 /nfs/dbraw/zinc/82/10/19/1017821019.db2.gz SVZMPSMRCGNKRJ-JTQLQIEISA-N 1 1 308.166 3.851 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1O ZINC000858016043 1032744493 /nfs/dbraw/zinc/74/44/93/1032744493.db2.gz HLHANKMBIVUUHA-GOSISDBHSA-N 1 1 324.424 3.626 20 10 DHCDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@H]1C)c1ccc(N(C)C)cc1 ZINC000764930455 1018431762 /nfs/dbraw/zinc/43/17/62/1018431762.db2.gz SQTOMHQVLNFZIZ-IKGGRYGDSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@H]1C)c1ccc(N(C)C)cc1 ZINC000764930455 1018431772 /nfs/dbraw/zinc/43/17/72/1018431772.db2.gz SQTOMHQVLNFZIZ-IKGGRYGDSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H]1OCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)[C@@H]1C ZINC000765099352 1018475619 /nfs/dbraw/zinc/47/56/19/1018475619.db2.gz PDTDAWMFSBNCHV-CHWSQXEVSA-N 1 1 315.413 3.626 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278347338 1018596673 /nfs/dbraw/zinc/59/66/73/1018596673.db2.gz YPMLDMGKNHNRPJ-ZJUUUORDSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000278367475 1018619340 /nfs/dbraw/zinc/61/93/40/1018619340.db2.gz BXDLISQLTRXBSK-UTLUCORTSA-N 1 1 304.217 3.917 20 10 DHCDMO C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000705967490 1018689710 /nfs/dbraw/zinc/68/97/10/1018689710.db2.gz MRWBAXFKTNPETK-LLVKDONJSA-N 1 1 317.260 3.521 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+]C2(c3cccc(F)c3)CC2)cc1F ZINC000858143472 1032779548 /nfs/dbraw/zinc/77/95/48/1032779548.db2.gz ZHAMFAXLXCMKTI-UHFFFAOYSA-N 1 1 320.358 3.949 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1O ZINC000278453365 1018708483 /nfs/dbraw/zinc/70/84/83/1018708483.db2.gz YHCRREFBVUCXTG-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1[O-] ZINC000278466030 1018718343 /nfs/dbraw/zinc/71/83/43/1018718343.db2.gz NCLIOJSNQSOKOP-LBPRGKRZSA-N 1 1 308.853 3.571 20 10 DHCDMO C/C=C\C[C@H](CO)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000588599823 1019284846 /nfs/dbraw/zinc/28/48/46/1019284846.db2.gz UQHNPDUNVOCJLO-RWCMCFKCSA-N 1 1 304.217 3.677 20 10 DHCDMO CN(C)c1ccc(CN(C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171643866 1032840174 /nfs/dbraw/zinc/84/01/74/1032840174.db2.gz XAZPJSSJISLBNV-UHFFFAOYSA-N 1 1 317.521 3.836 20 10 DHCDMO CO[C@H]1CCC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)C1 ZINC000728049213 1019868143 /nfs/dbraw/zinc/86/81/43/1019868143.db2.gz BMVLZAJMXIEPTK-ZDUSSCGKSA-N 1 1 315.413 3.628 20 10 DHCDMO COc1ccc(-c2cc(C[N@@H+](C)Cc3ccccc3O)on2)cc1 ZINC000732203069 1020211034 /nfs/dbraw/zinc/21/10/34/1020211034.db2.gz NQZOQEHCMUQGNS-UHFFFAOYSA-N 1 1 324.380 3.688 20 10 DHCDMO C[N@@H+](Cc1cc(-c2ccc(F)cc2)no1)Cc1ccccc1O ZINC000732202744 1020211534 /nfs/dbraw/zinc/21/15/34/1020211534.db2.gz GDTJIWMEUDLTBO-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO CC[C@@H](NCC[N@H+](C)C1CCCC1)c1ccc(N(C)C)cc1 ZINC000765799374 1020218788 /nfs/dbraw/zinc/21/87/88/1020218788.db2.gz HXGIUICQWSMAAP-LJQANCHMSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@@H](NCC[N@@H+](C)C1CCCC1)c1ccc(N(C)C)cc1 ZINC000765799374 1020218794 /nfs/dbraw/zinc/21/87/94/1020218794.db2.gz HXGIUICQWSMAAP-LJQANCHMSA-N 1 1 303.494 3.668 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCCc3cccnc32)cc1F ZINC000922874996 1020319301 /nfs/dbraw/zinc/31/93/01/1020319301.db2.gz FSEUJZNWFWGJAR-MRXNPFEDSA-N 1 1 317.383 3.593 20 10 DHCDMO Cc1nc(C2([NH2+]Cc3cc(C)c(C)cc3O)CCCCC2)no1 ZINC000264430384 1032931381 /nfs/dbraw/zinc/93/13/81/1032931381.db2.gz WCYGFROWYGFRCF-UHFFFAOYSA-N 1 1 315.417 3.650 20 10 DHCDMO COC[C@@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000739871977 1020919214 /nfs/dbraw/zinc/91/92/14/1020919214.db2.gz XFPQUWGCVZPTRV-CYBMUJFWSA-N 1 1 311.381 3.760 20 10 DHCDMO CCc1cc(C[N@H+]2CC[C@H](COC)C2)c(O)c(C(C)(C)C)c1 ZINC000739867400 1020919826 /nfs/dbraw/zinc/91/98/26/1020919826.db2.gz BUYHJEPQZDRZHS-HNNXBMFYSA-N 1 1 305.462 3.720 20 10 DHCDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2c(O)ccc3ccncc32)C1(C)C ZINC000740861867 1020956894 /nfs/dbraw/zinc/95/68/94/1020956894.db2.gz SCXPEBSMSXWPHS-ROUUACIJSA-N 1 1 314.429 3.576 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC000741753275 1021048686 /nfs/dbraw/zinc/04/86/86/1021048686.db2.gz RHFXWRZMYRBIJV-HXUWFJFHSA-N 1 1 310.441 3.716 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CC[C@H](Cc3ccccc3)C1)CCC2 ZINC000742152999 1021095804 /nfs/dbraw/zinc/09/58/04/1021095804.db2.gz PVNCFDYIYLKYBF-QGZVFWFLSA-N 1 1 307.437 3.946 20 10 DHCDMO CC(C)[C@H]1C[N@@H+](Cc2c(O)ccc3ccncc32)CCS1 ZINC000743394891 1021281784 /nfs/dbraw/zinc/28/17/84/1021281784.db2.gz DGUJDRHVFXKXRP-QGZVFWFLSA-N 1 1 302.443 3.514 20 10 DHCDMO CC(C)[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CCS1 ZINC000743394843 1021282088 /nfs/dbraw/zinc/28/20/88/1021282088.db2.gz CTQYHQBSWVUXPH-INIZCTEOSA-N 1 1 323.502 3.969 20 10 DHCDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000743398411 1021284172 /nfs/dbraw/zinc/28/41/72/1021284172.db2.gz HQSIXNKDUFTFNN-IRXDYDNUSA-N 1 1 305.487 3.987 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CC[C@@H](N(C)Cc3ccccc3)C2)cc1C ZINC000743377274 1021285416 /nfs/dbraw/zinc/28/54/16/1021285416.db2.gz PNUORPVEARVQRH-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)cc1C ZINC000743377274 1021285428 /nfs/dbraw/zinc/28/54/28/1021285428.db2.gz PNUORPVEARVQRH-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO Cc1cc(O)c(CN2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1C ZINC000743377274 1021285432 /nfs/dbraw/zinc/28/54/32/1021285432.db2.gz PNUORPVEARVQRH-HXUWFJFHSA-N 1 1 324.468 3.715 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116279486 1032982324 /nfs/dbraw/zinc/98/23/24/1032982324.db2.gz IRCWJCQJKSMLJL-UHFFFAOYSA-N 1 1 306.749 3.586 20 10 DHCDMO Cc1ncccc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000154726668 1021518135 /nfs/dbraw/zinc/51/81/35/1021518135.db2.gz SDFDTHFJKYMNIK-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Cc1ncccc1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000154726668 1021518146 /nfs/dbraw/zinc/51/81/46/1021518146.db2.gz SDFDTHFJKYMNIK-UHFFFAOYSA-N 1 1 308.381 3.891 20 10 DHCDMO Oc1cc2c(cc1C[N@@H+]1C[C@H]3CC[C@@H](C1)O3)oc1ccccc12 ZINC000744434448 1021542678 /nfs/dbraw/zinc/54/26/78/1021542678.db2.gz BZNSYMLUIPSKSU-OKILXGFUSA-N 1 1 309.365 3.655 20 10 DHCDMO CC[C@@H]([NH2+]Cc1c(OC)cccc1OC)c1ccc(F)cc1O ZINC000850504644 1021565455 /nfs/dbraw/zinc/56/54/55/1021565455.db2.gz BVGMESCDYGBDBA-OAHLLOKOSA-N 1 1 319.376 3.789 20 10 DHCDMO CC[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1ccc(F)cc1O ZINC000850524615 1021576842 /nfs/dbraw/zinc/57/68/42/1021576842.db2.gz CTKWKGRABVJHTC-XYJFISCASA-N 1 1 301.361 3.750 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](CO)CC1CC1)c1cc(Cl)c(Cl)cc1O ZINC000850546377 1021598150 /nfs/dbraw/zinc/59/81/50/1021598150.db2.gz YPUWDCNKSDMEPG-MWLCHTKSSA-N 1 1 318.244 3.758 20 10 DHCDMO C[C@H]([NH2+][C@H]1C[C@H](O)C12CCC2)c1cc(Cl)c(Cl)cc1O ZINC000850548144 1021598713 /nfs/dbraw/zinc/59/87/13/1021598713.db2.gz ZEWGTIBVUZVZSG-YZMDESFKSA-N 1 1 316.228 3.653 20 10 DHCDMO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850554082 1021599417 /nfs/dbraw/zinc/59/94/17/1021599417.db2.gz HWTJHIRUUMMKNQ-HJZMNPPUSA-N 1 1 323.408 3.746 20 10 DHCDMO CC[C@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1ccc(F)cc1O ZINC000850552320 1021600028 /nfs/dbraw/zinc/60/00/28/1021600028.db2.gz VNDRSWADWCAQCB-INIZCTEOSA-N 1 1 317.408 3.773 20 10 DHCDMO CC[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1ccc(F)cc1O ZINC000850566810 1021611000 /nfs/dbraw/zinc/61/10/00/1021611000.db2.gz RBIVCZOLTIUQRR-ZDUSSCGKSA-N 1 1 317.351 3.512 20 10 DHCDMO CC(C)[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC000919807051 1021910157 /nfs/dbraw/zinc/91/01/57/1021910157.db2.gz PTCOBLHNPLUVKJ-UHFFFAOYSA-N 1 1 320.477 3.695 20 10 DHCDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(OC)ccc2O)cc1 ZINC000183375901 1022120990 /nfs/dbraw/zinc/12/09/90/1022120990.db2.gz DAGALEUEWIEWFX-SFHVURJKSA-N 1 1 313.397 3.747 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)ccc1N(C)C ZINC000852596355 1022148488 /nfs/dbraw/zinc/14/84/88/1022148488.db2.gz LFCJBAFWWOUNDB-QUCCMNQESA-N 1 1 316.489 3.842 20 10 DHCDMO Cn1c2cc(F)ccc2[nH+]c1NCc1c(O)cccc1Cl ZINC000766521091 1022174208 /nfs/dbraw/zinc/17/42/08/1022174208.db2.gz OFRIKPULGQDIEY-UHFFFAOYSA-N 1 1 305.740 3.684 20 10 DHCDMO CCC[N@@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccccc1O ZINC000110990121 1022190463 /nfs/dbraw/zinc/19/04/63/1022190463.db2.gz MLRBDFPYWFKZDQ-UHFFFAOYSA-N 1 1 322.408 3.968 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCC3(COC3)C1)oc1ccccc12 ZINC000853595918 1022297476 /nfs/dbraw/zinc/29/74/76/1022297476.db2.gz ZZBAAYXKVPRQEZ-UHFFFAOYSA-N 1 1 309.365 3.514 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H](CC(=O)OC(C)C)C2)c1 ZINC000183804505 1022412911 /nfs/dbraw/zinc/41/29/11/1022412911.db2.gz XYJGKOQWNYUZEC-MRXNPFEDSA-N 1 1 319.445 3.563 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1ccc(F)cc1O ZINC000184834955 1022427214 /nfs/dbraw/zinc/42/72/14/1022427214.db2.gz CADGJCCHSCHTBU-SJKOYZFVSA-N 1 1 320.383 3.624 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2c(C)noc2C)cc1 ZINC000756482226 1022454754 /nfs/dbraw/zinc/45/47/54/1022454754.db2.gz PXYLJILTFMMGHT-UHFFFAOYSA-N 1 1 315.461 3.812 20 10 DHCDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccccc1O ZINC000179561521 1022470223 /nfs/dbraw/zinc/47/02/23/1022470223.db2.gz BNDKJSPBSWZDCI-UHFFFAOYSA-N 1 1 321.424 3.847 20 10 DHCDMO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2O)C1 ZINC000179578486 1022473579 /nfs/dbraw/zinc/47/35/79/1022473579.db2.gz OUPPCTRFQLFOTP-MRXNPFEDSA-N 1 1 313.372 3.626 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c([O-])ccc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206022787 1022565913 /nfs/dbraw/zinc/56/59/13/1022565913.db2.gz CTEDRHYTSAZBIT-WDEREUQCSA-N 1 1 317.260 3.506 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1 ZINC000276140505 1022621389 /nfs/dbraw/zinc/62/13/89/1022621389.db2.gz DYEKFRHSBCGETI-CYBMUJFWSA-N 1 1 303.324 3.564 20 10 DHCDMO CCOC[C@H]1CCC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000113923855 1022754271 /nfs/dbraw/zinc/75/42/71/1022754271.db2.gz YHYYIMLBVHLISV-AWEZNQCLSA-N 1 1 321.461 3.644 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C)CCCn2ccnc2)cc1C(C)C ZINC000767755974 1022798724 /nfs/dbraw/zinc/79/87/24/1022798724.db2.gz OBMCWDWZEMVVGA-UHFFFAOYSA-N 1 1 301.434 3.543 20 10 DHCDMO C[N@@H+](CCC[C@H]1CCO1)Cc1ccc(N2CCCCC2)cc1 ZINC000876512039 1033083439 /nfs/dbraw/zinc/08/34/39/1033083439.db2.gz YOPDRIIWZLQFLP-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO Cc1ccccc1C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876534396 1033084628 /nfs/dbraw/zinc/08/46/28/1033084628.db2.gz RBQBYGSOKKQCQL-UHFFFAOYSA-N 1 1 324.468 3.588 20 10 DHCDMO C[C@H]([NH2+]CCc1ccccn1)c1cccc(C(F)(F)F)c1O ZINC000798179650 1022856041 /nfs/dbraw/zinc/85/60/41/1022856041.db2.gz INYVQSRXTMOCQB-NSHDSACASA-N 1 1 310.319 3.699 20 10 DHCDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)c(OC)c1 ZINC000768168452 1022910013 /nfs/dbraw/zinc/91/00/13/1022910013.db2.gz IGSUVRHQQQEORC-UHFFFAOYSA-N 1 1 321.804 3.695 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCc3sccc3[C@H]2C)c(O)c1 ZINC000768211438 1022924125 /nfs/dbraw/zinc/92/41/25/1022924125.db2.gz YFZZYNPZHBDLRX-GFCCVEGCSA-N 1 1 303.427 3.972 20 10 DHCDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000768252978 1022934000 /nfs/dbraw/zinc/93/40/00/1022934000.db2.gz SXIJZCWVAGOZCC-NSHDSACASA-N 1 1 319.788 3.967 20 10 DHCDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cc3c(cc2O)OCO3)c(C)c1 ZINC000768269340 1022935970 /nfs/dbraw/zinc/93/59/70/1022935970.db2.gz RHTDNWAPGVZNHU-AWEZNQCLSA-N 1 1 313.397 3.931 20 10 DHCDMO C[C@H]([NH2+]C[C@]1(C)CCO[C@H]1C1CC1)c1cc(F)cc(F)c1O ZINC000768291751 1022941035 /nfs/dbraw/zinc/94/10/35/1022941035.db2.gz FPYHXXCGEKGEAM-POJUEXTFSA-N 1 1 311.372 3.526 20 10 DHCDMO CCOc1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c(O)c1 ZINC000768365178 1022952717 /nfs/dbraw/zinc/95/27/17/1022952717.db2.gz QRTFUKCKCLRKPL-KRWDZBQOSA-N 1 1 311.425 3.856 20 10 DHCDMO CCCC[N@@H+](Cc1cc2c(cc1O)OC[C@H]2O)C1CCCCC1 ZINC000768440277 1022967462 /nfs/dbraw/zinc/96/74/62/1022967462.db2.gz PZQWELGFMASQCB-GOSISDBHSA-N 1 1 319.445 3.753 20 10 DHCDMO COc1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c(O)cc1C ZINC000768450102 1022969100 /nfs/dbraw/zinc/96/91/00/1022969100.db2.gz HQZJQZYKIWEOIY-OAHLLOKOSA-N 1 1 315.388 3.838 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCOC1 ZINC000768520568 1022978023 /nfs/dbraw/zinc/97/80/23/1022978023.db2.gz BZDGKSISTRJASS-SFHVURJKSA-N 1 1 302.462 3.535 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](CC)C[C@H]2CCOC2)cc1F ZINC000768521850 1022980714 /nfs/dbraw/zinc/98/07/14/1022980714.db2.gz WNNKLUAGQBYTKM-MRXNPFEDSA-N 1 1 308.441 3.530 20 10 DHCDMO C[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000927065249 1033481272 /nfs/dbraw/zinc/48/12/72/1033481272.db2.gz GCSOEXULYYXETL-PPHDSNJXSA-N 1 1 309.837 3.901 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)cc1C ZINC000364310439 1023005705 /nfs/dbraw/zinc/00/57/05/1023005705.db2.gz UHYNZMUKJLFBFI-GHTZIAJQSA-N 1 1 324.468 3.792 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1C ZINC000364310439 1023005720 /nfs/dbraw/zinc/00/57/20/1023005720.db2.gz UHYNZMUKJLFBFI-GHTZIAJQSA-N 1 1 324.468 3.792 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000768913002 1023054746 /nfs/dbraw/zinc/05/47/46/1023054746.db2.gz PNBAOELGKURENL-INIZCTEOSA-N 1 1 315.388 3.747 20 10 DHCDMO COc1cccc(O)c1C[N@@H+](C)CCCOc1ccccc1C ZINC000768921175 1023057834 /nfs/dbraw/zinc/05/78/34/1023057834.db2.gz ZGMOKLFTZHFNBQ-UHFFFAOYSA-N 1 1 315.413 3.610 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c(O)c1 ZINC000768932003 1023060360 /nfs/dbraw/zinc/06/03/60/1023060360.db2.gz YQQFSRFZBXPYTA-AWEZNQCLSA-N 1 1 313.397 3.747 20 10 DHCDMO CC[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(OC)c1O ZINC000769005240 1023078066 /nfs/dbraw/zinc/07/80/66/1023078066.db2.gz ARXXVZVRKKWYHO-GFCCVEGCSA-N 1 1 314.223 3.538 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H](SC)C2)c1 ZINC000756589263 1023086994 /nfs/dbraw/zinc/08/69/94/1023086994.db2.gz LDPKMTXIPYDSKC-UBHSHLNASA-N 1 1 323.458 3.504 20 10 DHCDMO CC(C)n1ncc2c1C[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)CC2 ZINC000364377374 1023099369 /nfs/dbraw/zinc/09/93/69/1023099369.db2.gz OTMAETQBWSQBNO-IUODEOHRSA-N 1 1 317.408 3.517 20 10 DHCDMO CN(C)[C@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769301829 1023115879 /nfs/dbraw/zinc/11/58/79/1023115879.db2.gz GKIHPVLBROELPI-IBGZPJMESA-N 1 1 310.441 3.585 20 10 DHCDMO C[NH+](C)[C@H]1CCCN(Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769301829 1023115884 /nfs/dbraw/zinc/11/58/84/1023115884.db2.gz GKIHPVLBROELPI-IBGZPJMESA-N 1 1 310.441 3.585 20 10 DHCDMO Cc1ccc(O)c(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315688 1023119211 /nfs/dbraw/zinc/11/92/11/1023119211.db2.gz KQWRTJVWFXOBHJ-SFHVURJKSA-N 1 1 316.489 3.789 20 10 DHCDMO c1cn([C@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)cn1 ZINC000769313552 1023119619 /nfs/dbraw/zinc/11/96/19/1023119619.db2.gz UMOUOVNMKJZSMW-FQEVSTJZSA-N 1 1 324.472 3.711 20 10 DHCDMO COc1ccc(O)c(CNc2c(C)cc([NH+](C)C)cc2C)c1 ZINC000184786047 1023119855 /nfs/dbraw/zinc/11/98/55/1023119855.db2.gz LCFWGQBGRZTMFQ-UHFFFAOYSA-N 1 1 300.402 3.696 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000769340318 1023129581 /nfs/dbraw/zinc/12/95/81/1023129581.db2.gz WDXJJTYKMKTOKQ-HNNXBMFYSA-N 1 1 315.388 3.920 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000769388803 1023139236 /nfs/dbraw/zinc/13/92/36/1023139236.db2.gz HVBDZSRJDSXZLQ-NSHDSACASA-N 1 1 322.202 3.737 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)CC1CC1 ZINC000769403204 1023141663 /nfs/dbraw/zinc/14/16/63/1023141663.db2.gz APEJZKKOQYINLE-UHFFFAOYSA-N 1 1 317.433 3.817 20 10 DHCDMO CCCN(CCC)c1ccc(CN2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000769405568 1023143485 /nfs/dbraw/zinc/14/34/85/1023143485.db2.gz XTTRUGHCENSYBV-LJQANCHMSA-N 1 1 317.521 3.697 20 10 DHCDMO Oc1cc2c(cc1C[N@H+]1CCCCC[C@H]1c1ccco1)OCO2 ZINC000769428595 1023146282 /nfs/dbraw/zinc/14/62/82/1023146282.db2.gz UKCHIZFTHYAGDG-AWEZNQCLSA-N 1 1 315.369 3.831 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c(O)c1 ZINC000769425404 1023146570 /nfs/dbraw/zinc/14/65/70/1023146570.db2.gz HFWBDUXNRIGWRX-SFHVURJKSA-N 1 1 312.413 3.831 20 10 DHCDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769426329 1023146656 /nfs/dbraw/zinc/14/66/56/1023146656.db2.gz PZSBEDQFPFRWHD-IBGZPJMESA-N 1 1 302.462 3.534 20 10 DHCDMO CCC[N@@H+](CCc1cccc(F)c1)Cc1cccc(OC)c1O ZINC000769425579 1023146790 /nfs/dbraw/zinc/14/67/90/1023146790.db2.gz QTCFWPSJZCQQED-UHFFFAOYSA-N 1 1 317.404 3.995 20 10 DHCDMO CC[N@H+](Cc1cc(Cl)ccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000769481966 1023151569 /nfs/dbraw/zinc/15/15/69/1023151569.db2.gz DHSACEVCRIOZME-SFHVURJKSA-N 1 1 319.832 3.910 20 10 DHCDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CCO1 ZINC000769447600 1023156723 /nfs/dbraw/zinc/15/67/23/1023156723.db2.gz YOBPFWIPCAHIAD-HXUWFJFHSA-N 1 1 310.441 3.635 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000769493006 1023166792 /nfs/dbraw/zinc/16/67/92/1023166792.db2.gz QDTYFOYHLFZQRB-INIZCTEOSA-N 1 1 309.837 3.969 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC000769499959 1023166946 /nfs/dbraw/zinc/16/69/46/1023166946.db2.gz YAADKMRHWLUSCP-DOTOQJQBSA-N 1 1 307.459 3.651 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000769493032 1023167294 /nfs/dbraw/zinc/16/72/94/1023167294.db2.gz QYMNNYMJHFYUOI-SFHVURJKSA-N 1 1 319.445 3.715 20 10 DHCDMO CN(C)c1cccc(C[N@@H+](C)Cc2c(O)cccc2Cl)c1 ZINC000769537205 1023175617 /nfs/dbraw/zinc/17/56/17/1023175617.db2.gz IVDOOJWVWUMLPL-UHFFFAOYSA-N 1 1 304.821 3.744 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000756612823 1023188416 /nfs/dbraw/zinc/18/84/16/1023188416.db2.gz MISSSHRAQVDAKT-VWYCJHECSA-N 1 1 317.260 3.832 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000756612823 1023188420 /nfs/dbraw/zinc/18/84/20/1023188420.db2.gz MISSSHRAQVDAKT-VWYCJHECSA-N 1 1 317.260 3.832 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000876680225 1033121164 /nfs/dbraw/zinc/12/11/64/1033121164.db2.gz AWUUFGALTOYMNM-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000876680225 1033121170 /nfs/dbraw/zinc/12/11/70/1033121170.db2.gz AWUUFGALTOYMNM-GOSISDBHSA-N 1 1 319.351 3.552 20 10 DHCDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876743586 1033131102 /nfs/dbraw/zinc/13/11/02/1033131102.db2.gz JHNURRUZYHZGKW-HXUWFJFHSA-N 1 1 316.489 3.660 20 10 DHCDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000771869926 1023479464 /nfs/dbraw/zinc/47/94/64/1023479464.db2.gz XQHNFPCXKQFVIB-OAHLLOKOSA-N 1 1 319.445 3.526 20 10 DHCDMO Cc1ccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(O)c1 ZINC000876778663 1033141134 /nfs/dbraw/zinc/14/11/34/1033141134.db2.gz LKAANDZDTMGVCG-GUYCJALGSA-N 1 1 303.427 3.724 20 10 DHCDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000785990256 1023648792 /nfs/dbraw/zinc/64/87/92/1023648792.db2.gz ZYVZEUSUWVPKRL-UWVAXJGDSA-N 1 1 316.489 3.658 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]1CCSC1 ZINC000787039451 1023751528 /nfs/dbraw/zinc/75/15/28/1023751528.db2.gz JDNNUMKRVKVKPF-KRWDZBQOSA-N 1 1 304.503 3.862 20 10 DHCDMO CN(C)c1ccc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)cc1 ZINC000788500377 1023895816 /nfs/dbraw/zinc/89/58/16/1023895816.db2.gz BUERIFFDZOFRLY-QGZVFWFLSA-N 1 1 316.832 3.767 20 10 DHCDMO CCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788587271 1023910121 /nfs/dbraw/zinc/91/01/21/1023910121.db2.gz HPJQLDRWCYEQIX-NEPJUHHUSA-N 1 1 318.383 3.792 20 10 DHCDMO CO[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788607735 1023912980 /nfs/dbraw/zinc/91/29/80/1023912980.db2.gz CFRNANOFVQWBSG-ZWNOBZJWSA-N 1 1 305.340 3.733 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788629357 1023916841 /nfs/dbraw/zinc/91/68/41/1023916841.db2.gz APKRIKAKALAZFM-WOPDTQHZSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788629354 1023916964 /nfs/dbraw/zinc/91/69/64/1023916964.db2.gz APKRIKAKALAZFM-IJLUTSLNSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000788691357 1023919758 /nfs/dbraw/zinc/91/97/58/1023919758.db2.gz MPBRTUGLPONZHA-MXWKQRLJSA-N 1 1 303.324 3.629 20 10 DHCDMO CC[C@@H](O)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788663539 1023921013 /nfs/dbraw/zinc/92/10/13/1023921013.db2.gz GJQULQJHYXEBPN-WDEREUQCSA-N 1 1 305.340 3.613 20 10 DHCDMO CCOC[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000093838893 1023929691 /nfs/dbraw/zinc/92/96/91/1023929691.db2.gz OGONAHZNVUOLLK-INIZCTEOSA-N 1 1 311.425 3.918 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2CCN(c3ccccc3F)C[C@@H]2C)c1 ZINC000789589277 1024119718 /nfs/dbraw/zinc/11/97/18/1024119718.db2.gz KLYPXAUVTOHXLC-HNNXBMFYSA-N 1 1 314.404 3.550 20 10 DHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000789586078 1024119883 /nfs/dbraw/zinc/11/98/83/1024119883.db2.gz JUGKCKQWSIVSCP-IBGZPJMESA-N 1 1 313.441 3.699 20 10 DHCDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC000882880071 1024156789 /nfs/dbraw/zinc/15/67/89/1024156789.db2.gz AOBOZNTUYVGZID-JTQLQIEISA-N 1 1 323.339 3.538 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1OC ZINC000882887610 1024161346 /nfs/dbraw/zinc/16/13/46/1024161346.db2.gz AIKJQJIKEQGXPQ-OAHLLOKOSA-N 1 1 307.340 3.920 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000882958118 1024186299 /nfs/dbraw/zinc/18/62/99/1024186299.db2.gz TVPXVZCAELOCIC-UHFFFAOYSA-N 1 1 307.315 3.979 20 10 DHCDMO Cc1cccnc1[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C(C)C ZINC000883002365 1024205420 /nfs/dbraw/zinc/20/54/20/1024205420.db2.gz DSYSMKOHCNFUMA-OAHLLOKOSA-N 1 1 306.356 3.861 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000883082166 1024233502 /nfs/dbraw/zinc/23/35/02/1024233502.db2.gz YRDFZKNFPDAAKE-GUYCJALGSA-N 1 1 319.351 3.538 20 10 DHCDMO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000269096806 1024238743 /nfs/dbraw/zinc/23/87/43/1024238743.db2.gz RZFQZFHEUSCDRG-CHWSQXEVSA-N 1 1 319.474 3.767 20 10 DHCDMO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000269096816 1024239283 /nfs/dbraw/zinc/23/92/83/1024239283.db2.gz RZFQZFHEUSCDRG-QWHCGFSZSA-N 1 1 319.474 3.767 20 10 DHCDMO CC(C)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H](O)c1ccccc1 ZINC000883106561 1024242207 /nfs/dbraw/zinc/24/22/07/1024242207.db2.gz XFAQRFVEGAWSQV-FUHWJXTLSA-N 1 1 321.367 3.518 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)[C@H](C)C[S@](C)=O)cc1 ZINC000131003504 1024245896 /nfs/dbraw/zinc/24/58/96/1024245896.db2.gz PRWGOIHYRDLQNF-OPAMFIHVSA-N 1 1 324.534 3.512 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+]CCc2ccc3cn[nH]c3c2)cc1 ZINC000790617850 1024343983 /nfs/dbraw/zinc/34/39/83/1024343983.db2.gz DCLUOVIFSJPBLN-UHFFFAOYSA-N 1 1 322.456 3.741 20 10 DHCDMO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Cl)ccc1O ZINC000883312097 1024361972 /nfs/dbraw/zinc/36/19/72/1024361972.db2.gz TZZWEIIRHNLJMG-LLVKDONJSA-N 1 1 303.793 3.566 20 10 DHCDMO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1cc(Cl)ccc1O ZINC000883312098 1024364100 /nfs/dbraw/zinc/36/41/00/1024364100.db2.gz TZZWEIIRHNLJMG-NSHDSACASA-N 1 1 303.793 3.566 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1 ZINC000883312391 1024367403 /nfs/dbraw/zinc/36/74/03/1024367403.db2.gz BNCPSLYFAXYFMD-HNNXBMFYSA-N 1 1 310.445 3.663 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2cc(O)ccc2Cl)cc1F ZINC000883325109 1024377426 /nfs/dbraw/zinc/37/74/26/1024377426.db2.gz ORABERFOHCGQKG-UHFFFAOYSA-N 1 1 308.784 3.541 20 10 DHCDMO C[C@](O)(CC[NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000790988297 1024411718 /nfs/dbraw/zinc/41/17/18/1024411718.db2.gz MKLNQCBLKRGFKW-KRWDZBQOSA-N 1 1 323.795 3.572 20 10 DHCDMO CC(C)(C[NH2+]Cc1c(O)ccc(Cl)c1F)[C@@H]1CCCCO1 ZINC000790976571 1024422156 /nfs/dbraw/zinc/42/21/56/1024422156.db2.gz IGFUZXRHKGVJBG-AWEZNQCLSA-N 1 1 315.816 3.870 20 10 DHCDMO C[N@H+](Cc1c(O)ccc(Cl)c1F)C1Cc2ccccc2C1 ZINC000792166974 1024641481 /nfs/dbraw/zinc/64/14/81/1024641481.db2.gz JQQYCNXSXJCTCH-UHFFFAOYSA-N 1 1 305.780 3.784 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1Cc2ccccc2C1 ZINC000792166974 1024641486 /nfs/dbraw/zinc/64/14/86/1024641486.db2.gz JQQYCNXSXJCTCH-UHFFFAOYSA-N 1 1 305.780 3.784 20 10 DHCDMO C[N@@H+](CCOc1ccc(Cl)c(F)c1)Cc1ccccc1O ZINC000792250548 1024653136 /nfs/dbraw/zinc/65/31/36/1024653136.db2.gz UURUDSCPUOHOQT-UHFFFAOYSA-N 1 1 309.768 3.696 20 10 DHCDMO CCCC[N@H+](C)C[C@H](C)NCc1c(C)c2ccccc2n1C ZINC001202628446 1024688177 /nfs/dbraw/zinc/68/81/77/1024688177.db2.gz HCJAGINRXHORQN-HNNXBMFYSA-N 1 1 301.478 3.697 20 10 DHCDMO CCCC[N@@H+](C)C[C@H](C)NCc1c(C)c2ccccc2n1C ZINC001202628446 1024688186 /nfs/dbraw/zinc/68/81/86/1024688186.db2.gz HCJAGINRXHORQN-HNNXBMFYSA-N 1 1 301.478 3.697 20 10 DHCDMO CC[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001170225029 1024711856 /nfs/dbraw/zinc/71/18/56/1024711856.db2.gz WVWXXJBNONHNAR-RBUKOAKNSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001170225026 1024712335 /nfs/dbraw/zinc/71/23/35/1024712335.db2.gz WVWXXJBNONHNAR-MOPGFXCFSA-N 1 1 302.462 3.676 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000793232528 1024949940 /nfs/dbraw/zinc/94/99/40/1024949940.db2.gz XBIPCXPGDHDARO-LDYMZIIASA-N 1 1 323.742 3.827 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCC[C@@H](C(C)(C)C)C2)cc1OC ZINC000793369739 1025009175 /nfs/dbraw/zinc/00/91/75/1025009175.db2.gz LCVGJENQDSMYPH-CQSZACIVSA-N 1 1 307.434 3.668 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1C ZINC000793695025 1025153514 /nfs/dbraw/zinc/15/35/14/1025153514.db2.gz CYPCAZZFUHSPCW-AWEZNQCLSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1C ZINC000793695025 1025153517 /nfs/dbraw/zinc/15/35/17/1025153517.db2.gz CYPCAZZFUHSPCW-AWEZNQCLSA-N 1 1 317.351 3.551 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](CCF)C2)ccc1N1CCCCC1 ZINC000859909260 1033268471 /nfs/dbraw/zinc/26/84/71/1033268471.db2.gz UJGFNKWNVISZGI-SFHVURJKSA-N 1 1 320.452 3.546 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](CCF)C2)ccc1N1CCCCC1 ZINC000859909260 1033268476 /nfs/dbraw/zinc/26/84/76/1033268476.db2.gz UJGFNKWNVISZGI-SFHVURJKSA-N 1 1 320.452 3.546 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1c(O)cccc1F ZINC000886489438 1025649798 /nfs/dbraw/zinc/64/97/98/1025649798.db2.gz ISLKTVMXJYBGNQ-ZFWWWQNUSA-N 1 1 318.392 3.612 20 10 DHCDMO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1c(O)cccc1F ZINC000886493486 1025649865 /nfs/dbraw/zinc/64/98/65/1025649865.db2.gz NSQBKGJQVWPIBF-GFCCVEGCSA-N 1 1 313.376 3.540 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1c(O)cccc1F ZINC000886495407 1025651314 /nfs/dbraw/zinc/65/13/14/1025651314.db2.gz XANYMZVIRVWLMZ-SNVBAGLBSA-N 1 1 311.303 3.984 20 10 DHCDMO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1c(O)cccc1F ZINC000886495212 1025651731 /nfs/dbraw/zinc/65/17/31/1025651731.db2.gz NIECRVKAHZXVFZ-BONVTDFDSA-N 1 1 309.768 3.569 20 10 DHCDMO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cn1 ZINC000886505190 1025658538 /nfs/dbraw/zinc/65/85/38/1025658538.db2.gz ONEJNJXNPZMKQJ-LBPRGKRZSA-N 1 1 304.365 3.564 20 10 DHCDMO CCOCc1ccc(C[NH2+][C@@H](C)c2c(O)cccc2F)cc1 ZINC000886501427 1025658991 /nfs/dbraw/zinc/65/89/91/1025658991.db2.gz KCJNQQUPCUGTKO-ZDUSSCGKSA-N 1 1 303.377 3.919 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561874 1025705469 /nfs/dbraw/zinc/70/54/69/1025705469.db2.gz LPDUWBCMSJDSTI-MNOVXSKESA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561875 1025707852 /nfs/dbraw/zinc/70/78/52/1025707852.db2.gz LPDUWBCMSJDSTI-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1c(O)cccc1F ZINC000886577973 1025716028 /nfs/dbraw/zinc/71/60/28/1025716028.db2.gz DUUURXVRILKYRV-SONRMIBWSA-N 1 1 305.393 3.530 20 10 DHCDMO COc1cccc([C@H](C[NH2+][C@@H](C)c2c(O)cccc2F)OC)c1 ZINC000886641660 1025755200 /nfs/dbraw/zinc/75/52/00/1025755200.db2.gz OTTIDDYWEMAZHZ-SJCJKPOMSA-N 1 1 319.376 3.578 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000178849770 1026306044 /nfs/dbraw/zinc/30/60/44/1026306044.db2.gz ZOENEGHHUVIKAS-GOSISDBHSA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)s1 ZINC000808712736 1026362684 /nfs/dbraw/zinc/36/26/84/1026362684.db2.gz AYVQHWJGHVKSOK-RKDXNWHRSA-N 1 1 311.838 3.926 20 10 DHCDMO CN(CCC[N@@H+](C)Cc1c(O)cccc1Cl)Cc1ccco1 ZINC000809719331 1026603843 /nfs/dbraw/zinc/60/38/43/1026603843.db2.gz XZJDURIERUFVLK-UHFFFAOYSA-N 1 1 322.836 3.593 20 10 DHCDMO CN(CC[N@@H+](C)C1CC1)Cc1cc(-c2ccccc2)ccc1O ZINC000809754632 1026616954 /nfs/dbraw/zinc/61/69/54/1026616954.db2.gz LEUIXCHONGSEJQ-UHFFFAOYSA-N 1 1 310.441 3.585 20 10 DHCDMO CN(CC[N@H+](C)Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000809754632 1026616958 /nfs/dbraw/zinc/61/69/58/1026616958.db2.gz LEUIXCHONGSEJQ-UHFFFAOYSA-N 1 1 310.441 3.585 20 10 DHCDMO CN(CC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000809754632 1026616961 /nfs/dbraw/zinc/61/69/61/1026616961.db2.gz LEUIXCHONGSEJQ-UHFFFAOYSA-N 1 1 310.441 3.585 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000809758175 1026618024 /nfs/dbraw/zinc/61/80/24/1026618024.db2.gz FQUFZDJKFJHNDP-KBPBESRZSA-N 1 1 309.837 3.684 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000809758640 1026618780 /nfs/dbraw/zinc/61/87/80/1026618780.db2.gz SBVIQPCGXQSESQ-UONOGXRCSA-N 1 1 309.837 3.684 20 10 DHCDMO Cc1cc(Br)cc(C[NH2+][C@H]2CCCC2(F)F)c1O ZINC000809779858 1026622389 /nfs/dbraw/zinc/62/23/89/1026622389.db2.gz BNPNBPQLTXYSFV-NSHDSACASA-N 1 1 320.177 3.741 20 10 DHCDMO CCCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CCC1 ZINC000809766116 1026620768 /nfs/dbraw/zinc/62/07/68/1026620768.db2.gz VGVDCXDKIGGDQC-AWEZNQCLSA-N 1 1 322.405 3.758 20 10 DHCDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1cccc(OC)c1O ZINC000809781133 1026622287 /nfs/dbraw/zinc/62/22/87/1026622287.db2.gz PBIDYLXWZAIUJT-INIZCTEOSA-N 1 1 315.413 3.993 20 10 DHCDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cccc(OC)c1O ZINC000809781134 1026622611 /nfs/dbraw/zinc/62/26/11/1026622611.db2.gz PBIDYLXWZAIUJT-MRXNPFEDSA-N 1 1 315.413 3.993 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)c1O ZINC000811510805 1027026439 /nfs/dbraw/zinc/02/64/39/1027026439.db2.gz PICRGUAYWKSYMD-GDBMZVCRSA-N 1 1 309.837 3.743 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nccn2CC)cc1F ZINC000295262932 1027165801 /nfs/dbraw/zinc/16/58/01/1027165801.db2.gz RKDCGACPVPYGPI-CQSZACIVSA-N 1 1 318.440 3.739 20 10 DHCDMO CC[N@@H+](Cc1c2c(ccc1O)oc1c2CCCC1)[C@H]1CCOC1 ZINC000812296348 1027248001 /nfs/dbraw/zinc/24/80/01/1027248001.db2.gz PJSBBLCHGGPBPK-ZDUSSCGKSA-N 1 1 315.413 3.628 20 10 DHCDMO CCOC(=O)CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C1CC1 ZINC000747786817 1027251076 /nfs/dbraw/zinc/25/10/76/1027251076.db2.gz LOROOEBYSCFQDT-UHFFFAOYSA-N 1 1 319.445 3.742 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1 ZINC000812840111 1027440419 /nfs/dbraw/zinc/44/04/19/1027440419.db2.gz FHERIZOHDBNQJE-ZCNNSNEGSA-N 1 1 316.489 3.658 20 10 DHCDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1O ZINC000778996985 1027739158 /nfs/dbraw/zinc/73/91/58/1027739158.db2.gz YIEPCLMPDISELD-UHFFFAOYSA-N 1 1 303.377 3.952 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCO[C@H](C)C1 ZINC000778996878 1027739625 /nfs/dbraw/zinc/73/96/25/1027739625.db2.gz UYTZBWACOZJKDV-SJLPKXTDSA-N 1 1 304.478 3.778 20 10 DHCDMO COCC[N@@H+](CCCc1ccccc1)Cc1cc(F)ccc1O ZINC000779002720 1027751786 /nfs/dbraw/zinc/75/17/86/1027751786.db2.gz NLWRCPMHAYWGCG-UHFFFAOYSA-N 1 1 317.404 3.613 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc(F)cc1O ZINC000528000667 1028025641 /nfs/dbraw/zinc/02/56/41/1028025641.db2.gz KLGUUWDOGLADAT-RDJZCZTQSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1cccc(C(F)(F)F)c1O ZINC000528006715 1028032884 /nfs/dbraw/zinc/03/28/84/1028032884.db2.gz NRKYHXMRXUQDJI-TUYISWAISA-N 1 1 317.351 3.874 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000368024354 1028280944 /nfs/dbraw/zinc/28/09/44/1028280944.db2.gz TXJLJWKTFNXVMA-CVEARBPZSA-N 1 1 301.386 3.818 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000368024354 1028280959 /nfs/dbraw/zinc/28/09/59/1028280959.db2.gz TXJLJWKTFNXVMA-CVEARBPZSA-N 1 1 301.386 3.818 20 10 DHCDMO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)ccc1N(C)C ZINC000815060544 1028343269 /nfs/dbraw/zinc/34/32/69/1028343269.db2.gz ABHJXLGMXWAZDC-GOSISDBHSA-N 1 1 316.470 3.696 20 10 DHCDMO Cc1cc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)ccc1N(C)C ZINC000815060544 1028343281 /nfs/dbraw/zinc/34/32/81/1028343281.db2.gz ABHJXLGMXWAZDC-GOSISDBHSA-N 1 1 316.470 3.696 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000815120316 1028366659 /nfs/dbraw/zinc/36/66/59/1028366659.db2.gz PSKZEKFGVSAYJQ-UHFFFAOYSA-N 1 1 324.424 3.516 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)cc1 ZINC000815120008 1028366925 /nfs/dbraw/zinc/36/69/25/1028366925.db2.gz LZPTYLXJNNBRLU-QZTJIDSGSA-N 1 1 302.462 3.532 20 10 DHCDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000779149182 1028439542 /nfs/dbraw/zinc/43/95/42/1028439542.db2.gz BPTUQMSVPOUFMS-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO CC[NH+]1CCC([NH2+][C@H](C)c2cccc(C(F)(F)F)c2[O-])CC1 ZINC000815554447 1028539405 /nfs/dbraw/zinc/53/94/05/1028539405.db2.gz ZQZGVVKBDSFLKK-LLVKDONJSA-N 1 1 316.367 3.546 20 10 DHCDMO C[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815587370 1028557015 /nfs/dbraw/zinc/55/70/15/1028557015.db2.gz IFFOTXYEEIIMAT-QMTHXVAHSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000815597237 1028561050 /nfs/dbraw/zinc/56/10/50/1028561050.db2.gz QNQCWAGCODKERD-GHMZBOCLSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1cccc(C(F)(F)F)c1O ZINC000815614213 1028570044 /nfs/dbraw/zinc/57/00/44/1028570044.db2.gz JHABICMMLIQEEI-SRVKXCTJSA-N 1 1 317.351 3.877 20 10 DHCDMO CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815628194 1028576625 /nfs/dbraw/zinc/57/66/25/1028576625.db2.gz UEFAFOXAWBTVCG-NEPJUHHUSA-N 1 1 318.383 3.790 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccc(F)cc1O ZINC000815648171 1028592878 /nfs/dbraw/zinc/59/28/78/1028592878.db2.gz GHNPGQJWMQGLKR-PBHICJAKSA-N 1 1 309.425 3.761 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@H](c3cccs3)C[C@@H]2C)c1O ZINC000371397866 1028702700 /nfs/dbraw/zinc/70/27/00/1028702700.db2.gz FMGICWYLPPAPRE-GXTWGEPZSA-N 1 1 303.427 3.840 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCSC[C@H]2c2cccs2)c1 ZINC000371426422 1028710611 /nfs/dbraw/zinc/71/06/11/1028710611.db2.gz XGZGQSSZPHHGFM-AWEZNQCLSA-N 1 1 321.467 3.752 20 10 DHCDMO COc1cccc(C[N@H+]2C[C@H](c3ccsc3)C[C@H]2C)c1O ZINC000372405581 1028848255 /nfs/dbraw/zinc/84/82/55/1028848255.db2.gz WMYDBIAFEUPKJA-IUODEOHRSA-N 1 1 303.427 3.840 20 10 DHCDMO C[N@H+](Cc1ccc2c(c1)OCO2)Cc1cc(Cl)c(F)cc1O ZINC000816482734 1028892762 /nfs/dbraw/zinc/89/27/62/1028892762.db2.gz QQBWVJKMQKDVGY-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1cc(Cl)c(F)cc1O ZINC000816482734 1028892781 /nfs/dbraw/zinc/89/27/81/1028892781.db2.gz QQBWVJKMQKDVGY-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO C[N@H+](CCOCc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816520280 1028905284 /nfs/dbraw/zinc/90/52/84/1028905284.db2.gz KXSSQTGEYKFUBW-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO C[N@@H+](CCOCc1ccccc1)Cc1cc(Cl)c(F)cc1O ZINC000816520280 1028905296 /nfs/dbraw/zinc/90/52/96/1028905296.db2.gz KXSSQTGEYKFUBW-UHFFFAOYSA-N 1 1 323.795 3.833 20 10 DHCDMO CC(C)(C)[N@H+]1CCCN(Cc2ccc3ccccc3c2O)CC1 ZINC000816498181 1028905855 /nfs/dbraw/zinc/90/58/55/1028905855.db2.gz JZBKIOJRLXEQNJ-UHFFFAOYSA-N 1 1 312.457 3.852 20 10 DHCDMO CC(C)(C)N1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816498181 1028905867 /nfs/dbraw/zinc/90/58/67/1028905867.db2.gz JZBKIOJRLXEQNJ-UHFFFAOYSA-N 1 1 312.457 3.852 20 10 DHCDMO CC(C)(C)N1CCC[N@@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816498181 1028905885 /nfs/dbraw/zinc/90/58/85/1028905885.db2.gz JZBKIOJRLXEQNJ-UHFFFAOYSA-N 1 1 312.457 3.852 20 10 DHCDMO OCCC[N@@H+](Cc1ccccc1)Cc1ccc2ccccc2c1O ZINC000816504174 1028909059 /nfs/dbraw/zinc/90/90/59/1028909059.db2.gz BMMJDGCFZFTGLU-UHFFFAOYSA-N 1 1 321.420 3.930 20 10 DHCDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816519456 1028920306 /nfs/dbraw/zinc/92/03/06/1028920306.db2.gz JSERGWNJNZXBGG-GOSISDBHSA-N 1 1 321.424 3.788 20 10 DHCDMO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816589764 1028939638 /nfs/dbraw/zinc/93/96/38/1028939638.db2.gz HOZWCKBVARCPCX-MRXNPFEDSA-N 1 1 315.816 3.558 20 10 DHCDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816589764 1028939653 /nfs/dbraw/zinc/93/96/53/1028939653.db2.gz HOZWCKBVARCPCX-MRXNPFEDSA-N 1 1 315.816 3.558 20 10 DHCDMO CC1(C)C[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C(C)(C)O1 ZINC000816564352 1028945719 /nfs/dbraw/zinc/94/57/19/1028945719.db2.gz CHTXUAJPQZEAJH-CYBMUJFWSA-N 1 1 301.789 3.620 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000816601086 1028956437 /nfs/dbraw/zinc/95/64/37/1028956437.db2.gz QQAFHRNIKOVAHE-CYBMUJFWSA-N 1 1 321.779 3.668 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594753 1028956925 /nfs/dbraw/zinc/95/69/25/1028956925.db2.gz OGSDGCXSWYGKJE-APPZFPTMSA-N 1 1 311.706 3.957 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816594753 1028956937 /nfs/dbraw/zinc/95/69/37/1028956937.db2.gz OGSDGCXSWYGKJE-APPZFPTMSA-N 1 1 311.706 3.957 20 10 DHCDMO C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816610874 1028959047 /nfs/dbraw/zinc/95/90/47/1028959047.db2.gz BLUWDERIGQOXSN-GOSISDBHSA-N 1 1 324.468 3.709 20 10 DHCDMO C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc4ccccc4c3[O-])C2)CC1 ZINC000816610874 1028959061 /nfs/dbraw/zinc/95/90/61/1028959061.db2.gz BLUWDERIGQOXSN-GOSISDBHSA-N 1 1 324.468 3.709 20 10 DHCDMO CCc1nocc1C[N@@H+](C)Cc1ccc(N(CC)CC)c(F)c1 ZINC000816652827 1028980538 /nfs/dbraw/zinc/98/05/38/1028980538.db2.gz WDCCFQSNTLOLKC-UHFFFAOYSA-N 1 1 319.424 3.854 20 10 DHCDMO CCc1nocc1C[N@H+](C)Cc1ccc(N(CC)CC)c(F)c1 ZINC000816652827 1028980557 /nfs/dbraw/zinc/98/05/57/1028980557.db2.gz WDCCFQSNTLOLKC-UHFFFAOYSA-N 1 1 319.424 3.854 20 10 DHCDMO Oc1ccccc1C[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000816659552 1028981889 /nfs/dbraw/zinc/98/18/89/1028981889.db2.gz SBSVBUHWQYYKSP-INIZCTEOSA-N 1 1 303.789 3.699 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)cc1 ZINC000816665986 1028982631 /nfs/dbraw/zinc/98/26/31/1028982631.db2.gz BJSYJKAGHNZZTH-WOJBJXKFSA-N 1 1 314.473 3.676 20 10 DHCDMO Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1[O-] ZINC000817585495 1029213313 /nfs/dbraw/zinc/21/33/13/1029213313.db2.gz FILHNIVIYREHNR-LRVUVFPRSA-N 1 1 310.869 3.877 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c(O)c(C(C)(C)C)c1 ZINC000155463143 1029234953 /nfs/dbraw/zinc/23/49/53/1029234953.db2.gz PAGKWVGBABHUJP-GDBMZVCRSA-N 1 1 305.462 3.733 20 10 DHCDMO CCCC[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963934 1029301409 /nfs/dbraw/zinc/30/14/09/1029301409.db2.gz YRMBQDGTGRKKHN-ZJUUUORDSA-N 1 1 305.249 3.867 20 10 DHCDMO Cc1cc([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000817938119 1029281164 /nfs/dbraw/zinc/28/11/64/1029281164.db2.gz DUQYPXKLKKDKBE-UGSOOPFHSA-N 1 1 317.502 3.782 20 10 DHCDMO C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1cc2ccccc2o1 ZINC000817938105 1029284628 /nfs/dbraw/zinc/28/46/28/1029284628.db2.gz DQVGICRXSVAHHB-KBXCAEBGSA-N 1 1 323.440 3.849 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1F ZINC000817942950 1029288448 /nfs/dbraw/zinc/28/84/48/1029288448.db2.gz SABKXNXJRUVSRP-RTBURBONSA-N 1 1 315.436 3.632 20 10 DHCDMO CC(C)[C@H](N)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817960030 1029301270 /nfs/dbraw/zinc/30/12/70/1029301270.db2.gz WQSSDGNSTKHDKE-MOPGFXCFSA-N 1 1 312.457 3.639 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Cl)ccc1[O-] ZINC000817962823 1029301982 /nfs/dbraw/zinc/30/19/82/1029301982.db2.gz LEPRITLMQXQYNM-NWDGAFQWSA-N 1 1 304.821 3.916 20 10 DHCDMO C[C@H]([NH2+]Cc1ccnc(F)c1)c1cccc(C(F)(F)F)c1O ZINC000866473526 1030310924 /nfs/dbraw/zinc/31/09/24/1030310924.db2.gz FPUOIEURERHSBN-VIFPVBQESA-N 1 1 314.282 3.796 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)cc1[N+](=O)[O-] ZINC000866540850 1030359500 /nfs/dbraw/zinc/35/95/00/1030359500.db2.gz SEDSJQPSNSBVPB-SNVBAGLBSA-N 1 1 322.311 3.738 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(N)ccn1)c1ccc(N2CCCCC2)cc1 ZINC000925772589 1030490005 /nfs/dbraw/zinc/49/00/05/1030490005.db2.gz UTKMBAQNTSLELU-HNNXBMFYSA-N 1 1 310.445 3.505 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1 ZINC000824716442 1030618790 /nfs/dbraw/zinc/61/87/90/1030618790.db2.gz VCCGSLFWPGWNIQ-ZCNNSNEGSA-N 1 1 316.489 3.658 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@H](OC)[C@H](C)C2)cc1F ZINC000824815723 1030644719 /nfs/dbraw/zinc/64/47/19/1030644719.db2.gz XQWZCFBMHZOEKS-KDOFPFPSSA-N 1 1 308.441 3.529 20 10 DHCDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccccc3O)C2)cc1 ZINC000824820857 1030648417 /nfs/dbraw/zinc/64/84/17/1030648417.db2.gz OWVWGNQPPTVXRT-HNNXBMFYSA-N 1 1 312.369 3.680 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C3CCOCC3)C2)cc1Cl ZINC000824895340 1030660293 /nfs/dbraw/zinc/66/02/93/1030660293.db2.gz UQOYSPBLWMWVQO-CQSZACIVSA-N 1 1 309.837 3.603 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1 ZINC000246907476 1030660710 /nfs/dbraw/zinc/66/07/10/1030660710.db2.gz UOMRTWQXMMFPHH-NVXWUHKLSA-N 1 1 317.454 3.850 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@]3(CCSC3)C2)c1O ZINC000825215561 1030748745 /nfs/dbraw/zinc/74/87/45/1030748745.db2.gz QKUDXGGGRCZBIB-KRWDZBQOSA-N 1 1 307.459 3.510 20 10 DHCDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3cc(F)ccc3O)C2)c1 ZINC000825290135 1030769267 /nfs/dbraw/zinc/76/92/67/1030769267.db2.gz QMBMLRISHAIYOW-CZIWCDLHSA-N 1 1 315.388 3.918 20 10 DHCDMO COc1c(F)cc(C[N@@H+]2CCc3cccc(O)c3C2)cc1Cl ZINC001143853946 1031019916 /nfs/dbraw/zinc/01/99/16/1031019916.db2.gz MRWHFEOOWFOJHN-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1c(F)cc(C[N@H+]2CCc3cccc(O)c3C2)cc1Cl ZINC001143853946 1031019934 /nfs/dbraw/zinc/01/99/34/1031019934.db2.gz MRWHFEOOWFOJHN-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1cc(F)cc(F)c1O ZINC000927064663 1031061664 /nfs/dbraw/zinc/06/16/64/1031061664.db2.gz XIBJANXWBCCPSA-BONVTDFDSA-N 1 1 304.340 3.794 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1cc(F)cc(F)c1O ZINC000927102297 1031088086 /nfs/dbraw/zinc/08/80/86/1031088086.db2.gz RZXDPYQEQOJBDW-MNOVXSKESA-N 1 1 313.388 3.915 20 10 DHCDMO CCc1cc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(O)c(C(C)(C)C)c1 ZINC000844752476 1031314091 /nfs/dbraw/zinc/31/40/91/1031314091.db2.gz MVMMXYFTSZXJSP-GASCZTMLSA-N 1 1 309.400 3.949 20 10 DHCDMO CC[C@@H]([NH2+][C@H]1CNc2ccccc2C1)c1ccc(F)cc1O ZINC000844921742 1031401584 /nfs/dbraw/zinc/40/15/84/1031401584.db2.gz SMKLDJDMXMBPFN-GDBMZVCRSA-N 1 1 300.377 3.609 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[NH+]1CCC2(CC2)CC1 ZINC001144293931 1031432054 /nfs/dbraw/zinc/43/20/54/1031432054.db2.gz VSUPTLSKIJIBOL-UHFFFAOYSA-N 1 1 314.198 3.670 20 10 DHCDMO CCCCC[N@@H+](C)Cc1cc(Br)c(F)cc1[O-] ZINC001144298575 1031435893 /nfs/dbraw/zinc/43/58/93/1031435893.db2.gz GVYULNKCZRIXQW-UHFFFAOYSA-N 1 1 304.203 3.916 20 10 DHCDMO CCCCC[N@H+](C)Cc1cc(Br)c(F)cc1O ZINC001144298575 1031435906 /nfs/dbraw/zinc/43/59/06/1031435906.db2.gz GVYULNKCZRIXQW-UHFFFAOYSA-N 1 1 304.203 3.916 20 10 DHCDMO CCCCC[N@@H+](C)Cc1cc(Br)c(F)cc1O ZINC001144298575 1031435920 /nfs/dbraw/zinc/43/59/20/1031435920.db2.gz GVYULNKCZRIXQW-UHFFFAOYSA-N 1 1 304.203 3.916 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@@H+]1CCC[C@H](F)CC1 ZINC001144299029 1031439614 /nfs/dbraw/zinc/43/96/14/1031439614.db2.gz PESFBTHBWMEFFJ-JTQLQIEISA-N 1 1 320.177 3.618 20 10 DHCDMO Oc1cc(F)c(Br)cc1C[N@H+]1CCC[C@H](F)CC1 ZINC001144299029 1031439620 /nfs/dbraw/zinc/43/96/20/1031439620.db2.gz PESFBTHBWMEFFJ-JTQLQIEISA-N 1 1 320.177 3.618 20 10 DHCDMO CC[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144307967 1031456807 /nfs/dbraw/zinc/45/68/07/1031456807.db2.gz DPEXPLGLXOCMNX-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO CC[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144307967 1031456814 /nfs/dbraw/zinc/45/68/14/1031456814.db2.gz DPEXPLGLXOCMNX-SECBINFHSA-N 1 1 302.187 3.526 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Br)c(F)cc2[O-])C2(CC2)C1 ZINC001144308129 1031459369 /nfs/dbraw/zinc/45/93/69/1031459369.db2.gz QOZNOZJSTNWCON-VIFPVBQESA-N 1 1 314.198 3.668 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)C2(CC2)C1 ZINC001144308129 1031459383 /nfs/dbraw/zinc/45/93/83/1031459383.db2.gz QOZNOZJSTNWCON-VIFPVBQESA-N 1 1 314.198 3.668 20 10 DHCDMO CCc1ccc(NCc2cc(Br)ccc2O)[nH+]c1 ZINC001171177589 1031553287 /nfs/dbraw/zinc/55/32/87/1031553287.db2.gz CWZOMVBSBMFRIK-UHFFFAOYSA-N 1 1 307.191 3.724 20 10 DHCDMO Oc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c(O)c1 ZINC001144509537 1031663869 /nfs/dbraw/zinc/66/38/69/1031663869.db2.gz XUOZNVJBMGIFON-OAHLLOKOSA-N 1 1 319.788 3.794 20 10 DHCDMO CC(F)(F)CCC[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000929972721 1031665671 /nfs/dbraw/zinc/66/56/71/1031665671.db2.gz UBIUGIZISWCCPM-HNNXBMFYSA-N 1 1 313.388 3.809 20 10 DHCDMO Cc1cccc(C[N@@H+](Cc2c(O)cc(O)cc2O)C2CC2)c1C ZINC001144516340 1031675546 /nfs/dbraw/zinc/67/55/46/1031675546.db2.gz VPRIBSAMRNXCII-UHFFFAOYSA-N 1 1 313.397 3.585 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2nn(C)cc2C(F)F)cc1C ZINC000873152491 1031727598 /nfs/dbraw/zinc/72/75/98/1031727598.db2.gz QUEIHLPYDMQRLZ-UHFFFAOYSA-N 1 1 323.387 3.745 20 10 DHCDMO COc1ccc(O)c([C@@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)c1 ZINC000930216371 1031739185 /nfs/dbraw/zinc/73/91/85/1031739185.db2.gz GJCLXIVQQJBKHA-LLVKDONJSA-N 1 1 304.390 3.537 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@](C)(O)c1ccccc1 ZINC000846043671 1031837905 /nfs/dbraw/zinc/83/79/05/1031837905.db2.gz LPYJRDLKKKOLFZ-APPDUMDISA-N 1 1 323.795 3.571 20 10 DHCDMO COc1cccc(CCC[N@@H+](C)Cc2cc(F)c(F)cc2[O-])c1 ZINC001142527136 1031906547 /nfs/dbraw/zinc/90/65/47/1031906547.db2.gz LYHHYXKULZZCDN-UHFFFAOYSA-N 1 1 321.367 3.744 20 10 DHCDMO COc1cccc(CCC[N@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001142527136 1031906559 /nfs/dbraw/zinc/90/65/59/1031906559.db2.gz LYHHYXKULZZCDN-UHFFFAOYSA-N 1 1 321.367 3.744 20 10 DHCDMO COc1cccc(CCC[N@@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001142527136 1031906572 /nfs/dbraw/zinc/90/65/72/1031906572.db2.gz LYHHYXKULZZCDN-UHFFFAOYSA-N 1 1 321.367 3.744 20 10 DHCDMO C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000846205383 1031910208 /nfs/dbraw/zinc/91/02/08/1031910208.db2.gz PGJMRXQAGGJGKP-QWRGUYRKSA-N 1 1 317.351 3.877 20 10 DHCDMO C[C@@H]([NH2+]CCC1(CO)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000846209908 1031910601 /nfs/dbraw/zinc/91/06/01/1031910601.db2.gz ITVORHYBXIJVQB-SNVBAGLBSA-N 1 1 318.244 3.902 20 10 DHCDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)c(F)cc1O ZINC001142527586 1031911359 /nfs/dbraw/zinc/91/13/59/1031911359.db2.gz ZXMFHYMMISSGET-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)c(F)cc1O ZINC001142527586 1031911370 /nfs/dbraw/zinc/91/13/70/1031911370.db2.gz ZXMFHYMMISSGET-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO Cc1cccc(O)c1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000877469852 1033311338 /nfs/dbraw/zinc/31/13/38/1033311338.db2.gz AKQGRKZMWFMSQK-CYBMUJFWSA-N 1 1 315.417 3.982 20 10 DHCDMO Cc1cccc(O)c1C[N@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000877563267 1033357053 /nfs/dbraw/zinc/35/70/53/1033357053.db2.gz KCQYGGVRSSGISH-MRXNPFEDSA-N 1 1 305.805 3.519 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)c1O ZINC000877672698 1033407965 /nfs/dbraw/zinc/40/79/65/1033407965.db2.gz KXWDLWPCIRPNRY-RBUKOAKNSA-N 1 1 311.425 3.653 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000877698819 1033414009 /nfs/dbraw/zinc/41/40/09/1033414009.db2.gz ZQKNCLGOHUKBJX-UHFFFAOYSA-N 1 1 321.779 3.547 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000877755965 1033432343 /nfs/dbraw/zinc/43/23/43/1033432343.db2.gz UZWNTZWZAQVWAO-YQVWRLOYSA-N 1 1 324.468 3.953 20 10 DHCDMO CO[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)C1 ZINC001172921096 1033469691 /nfs/dbraw/zinc/46/96/91/1033469691.db2.gz XXAQKEGRYXMFMY-OLZOCXBDSA-N 1 1 320.820 3.641 20 10 DHCDMO CO[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001172939431 1033477584 /nfs/dbraw/zinc/47/75/84/1033477584.db2.gz POBZUQGDHVIDAI-OALUTQOASA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N(C)C)c(F)c2)n1 ZINC000127002651 1033644068 /nfs/dbraw/zinc/64/40/68/1033644068.db2.gz ICAVNUDLDFZSOS-LJQANCHMSA-N 1 1 313.420 3.932 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@@H+](C)CC2(C)COC2)cc1 ZINC000862477931 1033864134 /nfs/dbraw/zinc/86/41/34/1033864134.db2.gz VGLGXDIFRNTWFG-UHFFFAOYSA-N 1 1 304.478 3.781 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000862485494 1033867787 /nfs/dbraw/zinc/86/77/87/1033867787.db2.gz NOTJSFFSEUKLAF-ZBFHGGJFSA-N 1 1 319.445 3.500 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1nc(-c2cccs2)no1)c1ccccc1O ZINC000879649114 1034071302 /nfs/dbraw/zinc/07/13/02/1034071302.db2.gz LYOOWTZRYHKEIC-MNOVXSKESA-N 1 1 315.398 3.916 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1OC(F)F ZINC000178857266 1034269823 /nfs/dbraw/zinc/26/98/23/1034269823.db2.gz SKCSPZZMCYZBRG-UHFFFAOYSA-N 1 1 323.339 3.634 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c1 ZINC000183447308 1034387283 /nfs/dbraw/zinc/38/72/83/1034387283.db2.gz SGDNAUNMUDAWKP-GOSISDBHSA-N 1 1 312.413 3.913 20 10 DHCDMO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccc(F)cc1O ZINC000185532169 1034553596 /nfs/dbraw/zinc/55/35/96/1034553596.db2.gz RHQYLOFGXFBOPO-GUYCJALGSA-N 1 1 303.377 3.696 20 10 DHCDMO COc1cccc(CNc2c(C)cc([NH+](C)C)cc2C)c1O ZINC000186266231 1034613605 /nfs/dbraw/zinc/61/36/05/1034613605.db2.gz LSJRBEXMRGSVNQ-UHFFFAOYSA-N 1 1 300.402 3.696 20 10 DHCDMO CC1(C)CC[C@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000187243317 1034737695 /nfs/dbraw/zinc/73/76/95/1034737695.db2.gz PWLRGQGLADYAFK-QGZVFWFLSA-N 1 1 315.413 3.945 20 10 DHCDMO C[C@@H](O)C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192888572 1034821430 /nfs/dbraw/zinc/82/14/30/1034821430.db2.gz KGUOGFBVTCROHF-AEJSXWLSSA-N 1 1 306.233 3.757 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@]3(CCCOC3)C2)cc1 ZINC000773755872 1035438835 /nfs/dbraw/zinc/43/88/35/1035438835.db2.gz RSYMOSRYRMUGBA-IBGZPJMESA-N 1 1 302.462 3.535 20 10 DHCDMO Cc1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c(O)c1 ZINC001180149091 1035609816 /nfs/dbraw/zinc/60/98/16/1035609816.db2.gz UOAQEJJUAQKDJT-OXQOHEQNSA-N 1 1 311.425 3.971 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C(=O)OC)[C@H](C)CC ZINC001193840256 1035737480 /nfs/dbraw/zinc/73/74/80/1035737480.db2.gz YAEAEGWPTSHGPC-RHSMWYFYSA-N 1 1 307.434 3.582 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000773889530 1035800792 /nfs/dbraw/zinc/80/07/92/1035800792.db2.gz XCDHULMWRUXARB-CQSZACIVSA-N 1 1 300.368 3.917 20 10 DHCDMO CCC[N@H+](CCN1CCCCCC1)Cc1cc(F)ccc1O ZINC001182127671 1036101798 /nfs/dbraw/zinc/10/17/98/1036101798.db2.gz OHAMPIFCQSPQGK-UHFFFAOYSA-N 1 1 308.441 3.619 20 10 DHCDMO CCC[N@@H+](CCN1CCCCCC1)Cc1cc(F)ccc1O ZINC001182127671 1036101801 /nfs/dbraw/zinc/10/18/01/1036101801.db2.gz OHAMPIFCQSPQGK-UHFFFAOYSA-N 1 1 308.441 3.619 20 10 DHCDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cccc(C)c1O ZINC000775644925 1036183449 /nfs/dbraw/zinc/18/34/49/1036183449.db2.gz XXDTUMGGLBVVRK-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO Cc1cccc(C[N@@H+](C)CCOc2ccccc2Cl)c1O ZINC000775646982 1036192437 /nfs/dbraw/zinc/19/24/37/1036192437.db2.gz OVZNWUPKGFZXNN-UHFFFAOYSA-N 1 1 305.805 3.865 20 10 DHCDMO Cc1ccccc1CN1CCC[N@@H+](Cc2cccc(C)c2O)CC1 ZINC000775649374 1036212166 /nfs/dbraw/zinc/21/21/66/1036212166.db2.gz PGLZJEYYAAOUCL-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO Cc1ccccc1C[N@@H+]1CCCN(Cc2cccc(C)c2O)CC1 ZINC000775649374 1036212183 /nfs/dbraw/zinc/21/21/83/1036212183.db2.gz PGLZJEYYAAOUCL-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO Cc1ccccc1C[N@H+]1CCCN(Cc2cccc(C)c2O)CC1 ZINC000775649374 1036212194 /nfs/dbraw/zinc/21/21/94/1036212194.db2.gz PGLZJEYYAAOUCL-UHFFFAOYSA-N 1 1 324.468 3.717 20 10 DHCDMO C[C@H]([NH2+]C[C@@]1(C)CCOC1)c1cc(Cl)c(Cl)cc1O ZINC000774189352 1036216832 /nfs/dbraw/zinc/21/68/32/1036216832.db2.gz WPRQZPCUPGCLKM-LKFCYVNXSA-N 1 1 304.217 3.776 20 10 DHCDMO C[C@H]([NH2+][C@@H](CCO)C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000774252176 1036255962 /nfs/dbraw/zinc/25/59/62/1036255962.db2.gz JRUMSMCPQXROKI-SDBXPKJASA-N 1 1 304.217 3.511 20 10 DHCDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(OC)ccc2O)C1(CC)CC ZINC001204335841 1036250297 /nfs/dbraw/zinc/25/02/97/1036250297.db2.gz XMDUBUCTRAMKHR-ZWKOTPCHSA-N 1 1 321.461 3.816 20 10 DHCDMO Cc1cccc(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1O ZINC000775659299 1036265366 /nfs/dbraw/zinc/26/53/66/1036265366.db2.gz VHYPLTLUUOWFGU-JZXOWHBKSA-N 1 1 302.462 3.538 20 10 DHCDMO C[C@H]([NH2+][C@H]1CC[C@H](O)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774264276 1036266580 /nfs/dbraw/zinc/26/65/80/1036266580.db2.gz AJCAGISTPHTEGQ-GUBZILKMSA-N 1 1 304.217 3.653 20 10 DHCDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 ZINC000775658749 1036267719 /nfs/dbraw/zinc/26/77/19/1036267719.db2.gz PZXLBKVNTOTDCG-FMKPAKJESA-N 1 1 322.880 3.883 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c1 ZINC000775664560 1036283079 /nfs/dbraw/zinc/28/30/79/1036283079.db2.gz YBYWADATJONXMY-QGZVFWFLSA-N 1 1 315.388 3.747 20 10 DHCDMO C[C@H]([NH2+]CC1(N(C)C)CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774366191 1036300258 /nfs/dbraw/zinc/30/02/58/1036300258.db2.gz BVCFQIBRYISPIK-JTQLQIEISA-N 1 1 317.260 3.834 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000774365304 1036301032 /nfs/dbraw/zinc/30/10/32/1036301032.db2.gz XMJAHRBYHJXNDL-BZHVJNSISA-N 1 1 304.217 3.653 20 10 DHCDMO C[C@@H]([NH2+]CCC1CC(O)C1)c1cc(Cl)c(Cl)cc1O ZINC000774382861 1036310766 /nfs/dbraw/zinc/31/07/66/1036310766.db2.gz VNQDCJMTYOSGEP-XNWIYYODSA-N 1 1 304.217 3.511 20 10 DHCDMO CCc1cccc(C[N@@H+](CC2CC2)[C@@](C)(CC)C(=O)OC)c1O ZINC001182480999 1036368472 /nfs/dbraw/zinc/36/84/72/1036368472.db2.gz YDLNMTZKYHRHSI-IBGZPJMESA-N 1 1 319.445 3.508 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+](CCCO)Cc2ccccc2)c1O ZINC000775681912 1036413270 /nfs/dbraw/zinc/41/32/70/1036413270.db2.gz UQELJHFHRVHULN-UHFFFAOYSA-N 1 1 319.832 3.739 20 10 DHCDMO CCC1(CC)CCC[N@@H+](Cc2ccc(OC)c(OC)c2O)C1 ZINC001182883486 1036473746 /nfs/dbraw/zinc/47/37/46/1036473746.db2.gz ZFGPFJAMHIQYMD-UHFFFAOYSA-N 1 1 307.434 3.812 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1 ZINC000775697773 1036473980 /nfs/dbraw/zinc/47/39/80/1036473980.db2.gz GHCUUKPWUDYXKH-OAHLLOKOSA-N 1 1 315.388 3.605 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182968712 1036489851 /nfs/dbraw/zinc/48/98/51/1036489851.db2.gz DWPXPQLQMHVDQX-SJKOYZFVSA-N 1 1 313.388 3.760 20 10 DHCDMO COc1cc(O)c(C[N@@H+](C)C2CCC(C)(C)CC2)cc1OC ZINC000775707243 1036497311 /nfs/dbraw/zinc/49/73/11/1036497311.db2.gz FJXANLHNIJBHHO-UHFFFAOYSA-N 1 1 307.434 3.810 20 10 DHCDMO Cc1cccc(C[N@@H+]2CC[C@@H](C)N(Cc3ccccc3)CC2)c1O ZINC000775727007 1036570949 /nfs/dbraw/zinc/57/09/49/1036570949.db2.gz DXVNSHQNEURCTN-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)c1O ZINC000775727007 1036570960 /nfs/dbraw/zinc/57/09/60/1036570960.db2.gz DXVNSHQNEURCTN-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cccc(CN2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)c1O ZINC000775727007 1036570969 /nfs/dbraw/zinc/57/09/69/1036570969.db2.gz DXVNSHQNEURCTN-GOSISDBHSA-N 1 1 324.468 3.797 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC001183671412 1036644496 /nfs/dbraw/zinc/64/44/96/1036644496.db2.gz HTWYYCVIPPXIFA-OAHLLOKOSA-N 1 1 300.368 3.835 20 10 DHCDMO Oc1ccc2ccncc2c1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000774669331 1036654565 /nfs/dbraw/zinc/65/45/65/1036654565.db2.gz AMMLDJIEUFEDRS-UHFFFAOYSA-N 1 1 316.404 3.988 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2C[C@@H]3C[C@H]2CN3c2ccccc2)c1 ZINC001183908878 1036704618 /nfs/dbraw/zinc/70/46/18/1036704618.db2.gz FLRRRBKTKJYNDQ-PMACEKPBSA-N 1 1 322.452 3.979 20 10 DHCDMO C[C@]12C[N@@H+](Cc3c([O-])ccc(Cl)c3F)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001184054658 1036735252 /nfs/dbraw/zinc/73/52/52/1036735252.db2.gz INYABYLCXFXLNT-IANATYFASA-N 1 1 307.796 3.829 20 10 DHCDMO C[C@]12C[N@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001184054658 1036735269 /nfs/dbraw/zinc/73/52/69/1036735269.db2.gz INYABYLCXFXLNT-IANATYFASA-N 1 1 307.796 3.829 20 10 DHCDMO C[C@]12C[N@@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001184054658 1036735287 /nfs/dbraw/zinc/73/52/87/1036735287.db2.gz INYABYLCXFXLNT-IANATYFASA-N 1 1 307.796 3.829 20 10 DHCDMO CSCC1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001184097844 1036743059 /nfs/dbraw/zinc/74/30/59/1036743059.db2.gz ONFPPRSDYNIWHT-UHFFFAOYSA-N 1 1 303.830 3.760 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](Cc3nccs3)C2)cc1Cl ZINC001184265032 1036791632 /nfs/dbraw/zinc/79/16/32/1036791632.db2.gz OEQCRICOTNAGST-GFCCVEGCSA-N 1 1 322.861 3.875 20 10 DHCDMO COc1c(O)c(C[N@H+](C2CC2)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774834386 1037036733 /nfs/dbraw/zinc/03/67/33/1037036733.db2.gz UXNBPKFGBZTXDN-UHFFFAOYSA-N 1 1 320.389 3.606 20 10 DHCDMO COc1c(O)c(C[N@@H+](C2CC2)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000774834386 1037036753 /nfs/dbraw/zinc/03/67/53/1037036753.db2.gz UXNBPKFGBZTXDN-UHFFFAOYSA-N 1 1 320.389 3.606 20 10 DHCDMO COc1c([O-])c(C[N@@H+](CC(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000774837864 1037058696 /nfs/dbraw/zinc/05/86/96/1037058696.db2.gz FLUJSOAHCNUUAU-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@H+](CC(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000774837864 1037058717 /nfs/dbraw/zinc/05/87/17/1037058717.db2.gz FLUJSOAHCNUUAU-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[N@@H+](CC(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000774837864 1037058738 /nfs/dbraw/zinc/05/87/38/1037058738.db2.gz FLUJSOAHCNUUAU-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO COc1c(O)c(C[NH+]2CCC(C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000774868708 1037128174 /nfs/dbraw/zinc/12/81/74/1037128174.db2.gz HKLIWHYBKPIBSZ-UHFFFAOYSA-N 1 1 322.405 3.567 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]Cc2ccccc2)c1 ZINC001198943039 1037168139 /nfs/dbraw/zinc/16/81/39/1037168139.db2.gz PYKKBUMSXMHVTL-UHFFFAOYSA-N 1 1 306.203 3.753 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2cc(C)cc(OC)c2O)cc1 ZINC000915808644 1037189879 /nfs/dbraw/zinc/18/98/79/1037189879.db2.gz VFWIBMNNLLWOOC-UHFFFAOYSA-N 1 1 315.413 3.740 20 10 DHCDMO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902196 1037192940 /nfs/dbraw/zinc/19/29/40/1037192940.db2.gz HLSYJRPCVFOZKF-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774902196 1037192952 /nfs/dbraw/zinc/19/29/52/1037192952.db2.gz HLSYJRPCVFOZKF-GXTWGEPZSA-N 1 1 322.405 3.710 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@H](C(C)C)N2CCCC2)c(Cl)c1 ZINC001199161221 1037209351 /nfs/dbraw/zinc/20/93/51/1037209351.db2.gz IMGHFDHRGGAUHW-MRXNPFEDSA-N 1 1 310.869 3.564 20 10 DHCDMO CCCC[C@@H](CC)C[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000774942105 1037247574 /nfs/dbraw/zinc/24/75/74/1037247574.db2.gz HJECMXAIYPDJJV-GFCCVEGCSA-N 1 1 310.394 3.615 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000774975059 1037320683 /nfs/dbraw/zinc/32/06/83/1037320683.db2.gz NZXKISTUAGUJNC-SNVBAGLBSA-N 1 1 322.386 3.530 20 10 DHCDMO COc1ccccc1C1(C[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC001199972440 1037392884 /nfs/dbraw/zinc/39/28/84/1037392884.db2.gz RITWSXUJCPVSPD-UHFFFAOYSA-N 1 1 319.351 3.500 20 10 DHCDMO CCCC[C@@H](CCC)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775035341 1037455318 /nfs/dbraw/zinc/45/53/18/1037455318.db2.gz YWVZZQDLRYHBEE-CYBMUJFWSA-N 1 1 310.394 3.758 20 10 DHCDMO CO[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC[C@@H]1C ZINC000784668952 1037461073 /nfs/dbraw/zinc/46/10/73/1037461073.db2.gz WXZRFDARWQCJJI-QFBILLFUSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1ccc(F)cc1C[NH2+]Cc1cccc(Br)c1O ZINC000775152160 1037748995 /nfs/dbraw/zinc/74/89/95/1037748995.db2.gz LRSLQNYWEJNBRF-UHFFFAOYSA-N 1 1 324.193 3.892 20 10 DHCDMO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)CC1CC1 ZINC000763398474 1037816248 /nfs/dbraw/zinc/81/62/48/1037816248.db2.gz RFEXZTCTTPMVBE-UHFFFAOYSA-N 1 1 302.462 3.534 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCOc2ccccc2)C2CC2)cc1 ZINC000917074044 1038160606 /nfs/dbraw/zinc/16/06/06/1038160606.db2.gz NXCULXUDELTWGX-UHFFFAOYSA-N 1 1 310.441 3.796 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](C/C=C\c3ccccc3)CC2)cc1 ZINC000917089671 1038186647 /nfs/dbraw/zinc/18/66/47/1038186647.db2.gz CSHXDVJSIFQIHR-UITAMQMPSA-N 1 1 322.452 3.921 20 10 DHCDMO CCOC[C@@H]1CC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000164449211 1038191326 /nfs/dbraw/zinc/19/13/26/1038191326.db2.gz XHAVONWXRNRGLJ-CQSZACIVSA-N 1 1 321.461 3.557 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](CCc2nccs2)C(C)C)c1O ZINC000164609080 1038225282 /nfs/dbraw/zinc/22/52/82/1038225282.db2.gz LHEQMXNRIDQBIH-UHFFFAOYSA-N 1 1 320.458 3.619 20 10 DHCDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(N(C)C)cc1 ZINC000056493259 1038454349 /nfs/dbraw/zinc/45/43/49/1038454349.db2.gz JODUFGYKKLEJHU-UHFFFAOYSA-N 1 1 319.430 3.744 20 10 DHCDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(N(C)C)cc1 ZINC000056493259 1038454360 /nfs/dbraw/zinc/45/43/60/1038454360.db2.gz JODUFGYKKLEJHU-UHFFFAOYSA-N 1 1 319.430 3.744 20 10 DHCDMO COC[C@H](C[N@@H+](Cc1ccco1)Cc1ccccc1O)C(C)C ZINC001192014508 1038579588 /nfs/dbraw/zinc/57/95/88/1038579588.db2.gz SSVLPYVFYMPIMY-KRWDZBQOSA-N 1 1 317.429 3.906 20 10 DHCDMO CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1cc(Cl)ccc1[O-] ZINC000775500209 1038582928 /nfs/dbraw/zinc/58/29/28/1038582928.db2.gz ZSJQCPQIIOMGRH-INIZCTEOSA-N 1 1 310.869 3.818 20 10 DHCDMO C[N@@H+](CCC[NH2+]Cc1cccc(Cl)c1[O-])C1CCCCC1 ZINC000158078815 1039937945 /nfs/dbraw/zinc/93/79/45/1039937945.db2.gz HUPKFPVASMJXJZ-UHFFFAOYSA-N 1 1 310.869 3.790 20 10 DHCDMO C[C@@H](CC(F)(F)F)[NH2+]Cc1cccc(Br)c1O ZINC000231750480 1040394589 /nfs/dbraw/zinc/39/45/89/1040394589.db2.gz PRDVTWFDCFFNLY-ZETCQYMHSA-N 1 1 312.129 3.585 20 10 DHCDMO C[C@H]([NH2+]Cc1ccccc1O)c1nc(C2CCCCC2)no1 ZINC000173867706 1040435880 /nfs/dbraw/zinc/43/58/80/1040435880.db2.gz YUXKCQSJZKTWIR-LBPRGKRZSA-N 1 1 301.390 3.674 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2cccc(OCC)c2O)CC1 ZINC000093317107 193230510 /nfs/dbraw/zinc/23/05/10/193230510.db2.gz GJTXSHMVFQLNHP-MRXNPFEDSA-N 1 1 307.434 3.572 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc2c(cc1O)CCCC2 ZINC000273527093 130131966 /nfs/dbraw/zinc/13/19/66/130131966.db2.gz VNHPKJGONPXUMW-SJKOYZFVSA-N 1 1 311.429 3.722 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc2c(cc1O)CCCC2 ZINC000273527099 130132024 /nfs/dbraw/zinc/13/20/24/130132024.db2.gz VNHPKJGONPXUMW-YVEFUNNKSA-N 1 1 311.429 3.722 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1O ZINC000273533393 130134229 /nfs/dbraw/zinc/13/42/29/130134229.db2.gz WVRSSGFZYVQJJB-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000273599663 130141670 /nfs/dbraw/zinc/14/16/70/130141670.db2.gz RQUVYXOVTQVOHB-SECBINFHSA-N 1 1 314.216 3.555 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c1 ZINC000284407304 131078224 /nfs/dbraw/zinc/07/82/24/131078224.db2.gz QDXAZPPHFBMPGX-KGLIPLIRSA-N 1 1 300.229 3.716 20 10 DHCDMO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(N(C)C)cc1 ZINC000285747630 131198634 /nfs/dbraw/zinc/19/86/34/131198634.db2.gz RSROIYQGANZOCZ-VXGBXAGGSA-N 1 1 305.372 3.838 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1O ZINC000286100614 131219391 /nfs/dbraw/zinc/21/93/91/131219391.db2.gz NGJZTQXPNPOTBZ-AWEZNQCLSA-N 1 1 304.321 3.680 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc(F)cc1O ZINC000286220635 131224939 /nfs/dbraw/zinc/22/49/39/131224939.db2.gz SHYJBNYAJZLTLJ-DIECFANBSA-N 1 1 305.393 3.530 20 10 DHCDMO Oc1ccccc1C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000289141961 131361466 /nfs/dbraw/zinc/36/14/66/131361466.db2.gz AJTUYIUBOOCYGV-HNNXBMFYSA-N 1 1 313.401 3.770 20 10 DHCDMO Oc1ccccc1C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000289141961 131361467 /nfs/dbraw/zinc/36/14/67/131361467.db2.gz AJTUYIUBOOCYGV-HNNXBMFYSA-N 1 1 313.401 3.770 20 10 DHCDMO CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000297581088 132023996 /nfs/dbraw/zinc/02/39/96/132023996.db2.gz HDAMJPXCSCCIBR-SFHVURJKSA-N 1 1 310.441 3.621 20 10 DHCDMO CN(c1ccc(C[NH2+][C@H]2CCn3ccnc32)cc1)C1CCCCC1 ZINC000297864392 132037702 /nfs/dbraw/zinc/03/77/02/132037702.db2.gz UHVDETBJIXGKKE-IBGZPJMESA-N 1 1 324.472 3.887 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1O ZINC000297255476 335152221 /nfs/dbraw/zinc/15/22/21/335152221.db2.gz JOSHWXUHRQEIQQ-WDEREUQCSA-N 1 1 304.321 3.851 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000278402160 334095788 /nfs/dbraw/zinc/09/57/88/334095788.db2.gz OITFTJNGZFLTBG-LLVKDONJSA-N 1 1 303.324 3.565 20 10 DHCDMO C[C@@H](Nc1cc[nH+]cc1Cl)c1ccc(N2CCOCC2)cc1 ZINC000301522112 336312205 /nfs/dbraw/zinc/31/22/05/336312205.db2.gz NXOQGZSTBIQZDV-CYBMUJFWSA-N 1 1 317.820 3.745 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000376412992 337032965 /nfs/dbraw/zinc/03/29/65/337032965.db2.gz IVWSWILPJHOWKG-CQSZACIVSA-N 1 1 313.800 3.624 20 10 DHCDMO Cc1[nH+]ccn1-c1ccc(NCc2cc(C)c(C)cc2O)cn1 ZINC000376548191 337036585 /nfs/dbraw/zinc/03/65/85/337036585.db2.gz NWFVDOUMZHHJGT-UHFFFAOYSA-N 1 1 308.385 3.510 20 10 DHCDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000378443603 337072862 /nfs/dbraw/zinc/07/28/62/337072862.db2.gz NDUQRTAZSCOCDA-MRXNPFEDSA-N 1 1 319.836 3.733 20 10 DHCDMO CO[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000378631565 337077034 /nfs/dbraw/zinc/07/70/34/337077034.db2.gz JKOCPMOGUKXISX-IBGZPJMESA-N 1 1 302.462 3.678 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1O ZINC000180021083 337173212 /nfs/dbraw/zinc/17/32/12/337173212.db2.gz RQIQLKADFHDSEI-KRWDZBQOSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1O ZINC000180021083 337173213 /nfs/dbraw/zinc/17/32/13/337173213.db2.gz RQIQLKADFHDSEI-KRWDZBQOSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccco3)C2)c1O ZINC000180629045 337176816 /nfs/dbraw/zinc/17/68/16/337176816.db2.gz ZJPREEKHMBVWND-HNNXBMFYSA-N 1 1 307.777 3.521 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccco3)C2)c1O ZINC000180629045 337176817 /nfs/dbraw/zinc/17/68/17/337176817.db2.gz ZJPREEKHMBVWND-HNNXBMFYSA-N 1 1 307.777 3.521 20 10 DHCDMO Cc1nnc([C@H]([NH2+][C@@H](C)c2ccc(C)cc2O)c2ccccc2)[nH]1 ZINC000185324728 337205097 /nfs/dbraw/zinc/20/50/97/337205097.db2.gz UHBWPGWCFSEEQQ-SCLBCKFNSA-N 1 1 322.412 3.567 20 10 DHCDMO C[C@@H]([NH2+]C1CCN(c2cccs2)CC1)c1ccc(F)cc1O ZINC000185692343 337250184 /nfs/dbraw/zinc/25/01/84/337250184.db2.gz WSRQQVPAUGQYAL-GFCCVEGCSA-N 1 1 320.433 3.912 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H]1COc2ccccc21 ZINC000248533478 337564317 /nfs/dbraw/zinc/56/43/17/337564317.db2.gz ZEQJXJZMLBHJRW-HWWQOWPSSA-N 1 1 301.361 3.747 20 10 DHCDMO CC(C)n1ccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000265413858 519996768 /nfs/dbraw/zinc/99/67/68/519996768.db2.gz HUBBELHPORLWOT-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CC(C)n1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000265413858 519996779 /nfs/dbraw/zinc/99/67/79/519996779.db2.gz HUBBELHPORLWOT-UHFFFAOYSA-N 1 1 312.461 3.695 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1ccccc1O ZINC000155852777 522646550 /nfs/dbraw/zinc/64/65/50/522646550.db2.gz DNMWHZFDGHAVTR-SFHVURJKSA-N 1 1 316.420 3.834 20 10 DHCDMO C[C@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccc(F)cc1O ZINC000186159359 525320377 /nfs/dbraw/zinc/32/03/77/525320377.db2.gz WDEDUJARXHCCPT-SCLBCKFNSA-N 1 1 315.388 3.696 20 10 DHCDMO Cc1cccnc1C1(C[NH2+][C@H](C)c2ccc(F)cc2O)CC1 ZINC000366039360 525507880 /nfs/dbraw/zinc/50/78/80/525507880.db2.gz JMENHUWXWFETNG-CYBMUJFWSA-N 1 1 300.377 3.617 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c(O)c1 ZINC000186809358 525730902 /nfs/dbraw/zinc/73/09/02/525730902.db2.gz ZMIRIJONFDMAEY-CYBMUJFWSA-N 1 1 318.417 3.855 20 10 DHCDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc(C)c1O)CCC2 ZINC000180231660 527110500 /nfs/dbraw/zinc/11/05/00/527110500.db2.gz VUBDZXVKPVYMHS-OAHLLOKOSA-N 1 1 302.443 3.975 20 10 DHCDMO CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(F)cc1[O-] ZINC000286251334 535803775 /nfs/dbraw/zinc/80/37/75/535803775.db2.gz UKZUGAHAUFFCIU-MRXNPFEDSA-N 1 1 305.397 3.557 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](O)c1ccccc1C)c1ccc(F)cc1O ZINC000286234945 535907175 /nfs/dbraw/zinc/90/71/75/535907175.db2.gz SZDDIFDFQOMKLV-FUHWJXTLSA-N 1 1 303.377 3.614 20 10 DHCDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1O ZINC000285541658 535918244 /nfs/dbraw/zinc/91/82/44/535918244.db2.gz CECXZJPFTROHQS-HNNXBMFYSA-N 1 1 304.321 3.680 20 10 DHCDMO COc1cc(C[N@H+]2CCO[C@H](C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000777968490 1032066445 /nfs/dbraw/zinc/06/64/45/1032066445.db2.gz LBLZWGYOYNWJJU-KRWDZBQOSA-N 1 1 321.461 3.555 20 10 DHCDMO C[N@H+](Cc1cncs1)Cc1ccc(N2CCCCC2)cc1 ZINC000155242496 1013321893 /nfs/dbraw/zinc/32/18/93/1013321893.db2.gz BTGYBGIJOZAWKU-UHFFFAOYSA-N 1 1 301.459 3.765 20 10 DHCDMO C[N@@H+](Cc1cncs1)Cc1ccc(N2CCCCC2)cc1 ZINC000155242496 1013321901 /nfs/dbraw/zinc/32/19/01/1013321901.db2.gz BTGYBGIJOZAWKU-UHFFFAOYSA-N 1 1 301.459 3.765 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)c2cccs2)c1O ZINC000050143597 1014088424 /nfs/dbraw/zinc/08/84/24/1014088424.db2.gz MLRHAYSFJKVDDK-JTQLQIEISA-N 1 1 307.390 3.988 20 10 DHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000388930191 1014911042 /nfs/dbraw/zinc/91/10/42/1014911042.db2.gz FASJNLKUJIWVIN-AWEZNQCLSA-N 1 1 305.418 3.769 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](c3nccs3)C2)cc1Cl ZINC000895580313 1015215774 /nfs/dbraw/zinc/21/57/74/1015215774.db2.gz AEOJMLHLICBGQI-NSHDSACASA-N 1 1 308.834 3.800 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896229464 1015513327 /nfs/dbraw/zinc/51/33/27/1015513327.db2.gz ZBIYRWZYFIZXHC-GFCCVEGCSA-N 1 1 323.717 3.912 20 10 DHCDMO Oc1cccc(F)c1C[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000896638633 1015693696 /nfs/dbraw/zinc/69/36/96/1015693696.db2.gz WXSVQIOBICBWGH-UHFFFAOYSA-N 1 1 301.361 3.610 20 10 DHCDMO C[C@@H]1CCC[N@@H+]1C1CCN(Cc2c(O)ccc3ccccc32)CC1 ZINC000151633436 1016085723 /nfs/dbraw/zinc/08/57/23/1016085723.db2.gz APMWWKBVWJQILU-MRXNPFEDSA-N 1 1 324.468 3.994 20 10 DHCDMO C[C@@H]1CCC[N@H+]1C1CCN(Cc2c(O)ccc3ccccc32)CC1 ZINC000151633436 1016085730 /nfs/dbraw/zinc/08/57/30/1016085730.db2.gz APMWWKBVWJQILU-MRXNPFEDSA-N 1 1 324.468 3.994 20 10 DHCDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c(O)c1OC ZINC000892036762 1016140457 /nfs/dbraw/zinc/14/04/57/1016140457.db2.gz QADKMFAKQUHHSP-IPYPFGDCSA-N 1 1 305.418 3.562 20 10 DHCDMO CCC[N@@H+](Cc1csc(NCC)n1)Cc1ccccc1O ZINC001167521433 1016293367 /nfs/dbraw/zinc/29/33/67/1016293367.db2.gz BXMCDGREKADJOF-UHFFFAOYSA-N 1 1 305.447 3.693 20 10 DHCDMO C[C@@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc(F)cc1O ZINC000184962278 1016472702 /nfs/dbraw/zinc/47/27/02/1016472702.db2.gz BEWAGQCXLGHLTO-CYBMUJFWSA-N 1 1 311.360 3.568 20 10 DHCDMO Cc1cc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)n1-c1ccccc1 ZINC000322834605 1032240562 /nfs/dbraw/zinc/24/05/62/1032240562.db2.gz HTRYXVJNGPVRGB-VCSGRIEYSA-N 1 1 323.484 3.809 20 10 DHCDMO Cc1cc(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)n1-c1ccccc1 ZINC000322834605 1032240573 /nfs/dbraw/zinc/24/05/73/1032240573.db2.gz HTRYXVJNGPVRGB-VCSGRIEYSA-N 1 1 323.484 3.809 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cc1C ZINC000729852088 1032656903 /nfs/dbraw/zinc/65/69/03/1032656903.db2.gz NSVUJDNWLIWGRF-FQEVSTJZSA-N 1 1 311.425 3.973 20 10 DHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000773264113 1032666123 /nfs/dbraw/zinc/66/61/23/1032666123.db2.gz QPXKMCLAXPCERU-IRXDYDNUSA-N 1 1 303.446 3.648 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccnc1Cl ZINC000122434147 1017986207 /nfs/dbraw/zinc/98/62/07/1017986207.db2.gz HVKVFJNSXVQWOY-LLVKDONJSA-N 1 1 307.800 3.791 20 10 DHCDMO CCN(C)c1ccc([C@H](C)NCC2([NH+](C)C)CCCC2)cc1 ZINC000764652926 1018337110 /nfs/dbraw/zinc/33/71/10/1018337110.db2.gz BKWZJZNLKORMHS-INIZCTEOSA-N 1 1 303.494 3.668 20 10 DHCDMO C[NH+](C)CCCC1CC[NH+](Cc2c([O-])cccc2Cl)CC1 ZINC000131286201 1018369410 /nfs/dbraw/zinc/36/94/10/1018369410.db2.gz CXEIAFUIMURBQY-UHFFFAOYSA-N 1 1 310.869 3.599 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](CCCc2ccncc2)C2CC2)cc1 ZINC000764954578 1018435774 /nfs/dbraw/zinc/43/57/74/1018435774.db2.gz TWURGVKRIISGBA-UHFFFAOYSA-N 1 1 309.457 3.745 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccc(F)cc1O ZINC000926918958 1032767287 /nfs/dbraw/zinc/76/72/87/1032767287.db2.gz KMVSBAZAVPBOJS-RYUDHWBXSA-N 1 1 301.361 3.706 20 10 DHCDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2F)cc1 ZINC001137837917 1018661389 /nfs/dbraw/zinc/66/13/89/1018661389.db2.gz YYIWONJYLWZTSJ-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO COc1ccc([C@H]2CCC[N@H+]2Cc2c(O)cccc2F)cc1 ZINC001137837917 1018661391 /nfs/dbraw/zinc/66/13/91/1018661391.db2.gz YYIWONJYLWZTSJ-QGZVFWFLSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000765449467 1018790838 /nfs/dbraw/zinc/79/08/38/1018790838.db2.gz KZEMOCOPFMSKCY-SJORKVTESA-N 1 1 303.494 3.668 20 10 DHCDMO CCCOc1ccc(C[NH2+]Cc2cc(C3CC3)n(C)n2)cc1C ZINC000922956492 1018940456 /nfs/dbraw/zinc/94/04/56/1018940456.db2.gz ULSVHHUGSZKRIG-UHFFFAOYSA-N 1 1 313.445 3.685 20 10 DHCDMO CN(C)c1ccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)cc1 ZINC000278639501 1018975570 /nfs/dbraw/zinc/97/55/70/1018975570.db2.gz LGTNCOOKHGVYBQ-UHFFFAOYSA-N 1 1 315.364 3.518 20 10 DHCDMO CC(C)[N@@H+](C)[C@@H]1CCN(Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112297 1019402409 /nfs/dbraw/zinc/40/24/09/1019402409.db2.gz PEFHDGZWPTTYLT-MRXNPFEDSA-N 1 1 304.478 3.604 20 10 DHCDMO CC(C)N(C)[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112297 1019402413 /nfs/dbraw/zinc/40/24/13/1019402413.db2.gz PEFHDGZWPTTYLT-MRXNPFEDSA-N 1 1 304.478 3.604 20 10 DHCDMO CC(C)N(C)[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143112297 1019402430 /nfs/dbraw/zinc/40/24/30/1019402430.db2.gz PEFHDGZWPTTYLT-MRXNPFEDSA-N 1 1 304.478 3.604 20 10 DHCDMO Cc1c[nH]c(C[NH2+]Cc2cc(C)n(-c3cccc(C)c3)c2C)n1 ZINC000858293093 1032831391 /nfs/dbraw/zinc/83/13/91/1032831391.db2.gz JMASMCKLUKRLDO-UHFFFAOYSA-N 1 1 308.429 3.724 20 10 DHCDMO CC[C@H](C)[N@H+](C)CCNCc1cc(-c2ccccc2)ccc1O ZINC000727161319 1019661781 /nfs/dbraw/zinc/66/17/81/1019661781.db2.gz HAOFNEJTJCQJKZ-INIZCTEOSA-N 1 1 312.457 3.879 20 10 DHCDMO CC[C@H](C)[N@@H+](C)CCNCc1cc(-c2ccccc2)ccc1O ZINC000727161319 1019661789 /nfs/dbraw/zinc/66/17/89/1019661789.db2.gz HAOFNEJTJCQJKZ-INIZCTEOSA-N 1 1 312.457 3.879 20 10 DHCDMO CCC[N@@H+](CCOc1ccc(OC)cc1)Cc1ccccc1O ZINC000727831229 1019819449 /nfs/dbraw/zinc/81/94/49/1019819449.db2.gz PMDUUPRIMMVTQC-UHFFFAOYSA-N 1 1 315.413 3.692 20 10 DHCDMO Cc1cc(O)c(C[NH2+]Cc2nc3c(s2)CCC3)c(Cl)c1 ZINC000922473857 1020092149 /nfs/dbraw/zinc/09/21/49/1020092149.db2.gz ZJXUJEAQMUYUMU-UHFFFAOYSA-N 1 1 308.834 3.589 20 10 DHCDMO CCCOc1ccc(C[NH2+][C@@H](c2ncccn2)C2CC2)cc1C ZINC000922576649 1020137457 /nfs/dbraw/zinc/13/74/57/1020137457.db2.gz CLEPFZBGLMPENQ-GOSISDBHSA-N 1 1 311.429 3.815 20 10 DHCDMO CN(C)c1cc(F)c(C[NH2+][C@H](c2ccccn2)C2CC2)cc1F ZINC000922582715 1020141105 /nfs/dbraw/zinc/14/11/05/1020141105.db2.gz QGBFHJCWFCDMEO-SFHVURJKSA-N 1 1 317.383 3.667 20 10 DHCDMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C[C@@H](C)O1 ZINC000732184565 1020207883 /nfs/dbraw/zinc/20/78/83/1020207883.db2.gz CVYLSJNXLGARSK-GDBMZVCRSA-N 1 1 305.462 3.997 20 10 DHCDMO COC(=O)CC[N@@H+](Cc1cc(C)cc(C(C)(C)C)c1O)C(C)C ZINC000733183222 1020346363 /nfs/dbraw/zinc/34/63/63/1020346363.db2.gz HTSIKWNQGJYYKH-UHFFFAOYSA-N 1 1 321.461 3.772 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000733324760 1020372091 /nfs/dbraw/zinc/37/20/91/1020372091.db2.gz BANLDJLDXDWDOY-JTQLQIEISA-N 1 1 323.742 3.589 20 10 DHCDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CCN1Cc1ccccc1 ZINC000179573365 1020410078 /nfs/dbraw/zinc/41/00/78/1020410078.db2.gz BUTSHQBQXOJHAN-XLIONFOSSA-N 1 1 324.468 3.877 20 10 DHCDMO CCn1cc(C[N@@H+](C)Cc2cc(C(C)C)c(C)cc2O)cn1 ZINC000733790397 1020445935 /nfs/dbraw/zinc/44/59/35/1020445935.db2.gz KRXKSSJKYXAIIM-UHFFFAOYSA-N 1 1 301.434 3.672 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@H](C)c1nc(CC)no1 ZINC000282574181 1020463538 /nfs/dbraw/zinc/46/35/38/1020463538.db2.gz ZXOPNIUSIJJGTM-CYBMUJFWSA-N 1 1 303.406 3.701 20 10 DHCDMO C[C@H](NCC[N@H+]1[C@H](C)CCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000765855162 1020519991 /nfs/dbraw/zinc/51/99/91/1020519991.db2.gz UWONQNWBCMMYRX-BBWFWOEESA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000765855162 1020519994 /nfs/dbraw/zinc/51/99/94/1020519994.db2.gz UWONQNWBCMMYRX-BBWFWOEESA-N 1 1 303.494 3.666 20 10 DHCDMO CCc1ccc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)cc1 ZINC000735308862 1020721545 /nfs/dbraw/zinc/72/15/45/1020721545.db2.gz WNZWBRDDCOCLFN-UHFFFAOYSA-N 1 1 324.468 3.970 20 10 DHCDMO CCC[N@@H+](CCc1nc2ccccc2n1C)Cc1ccccc1O ZINC000736309917 1020806727 /nfs/dbraw/zinc/80/67/27/1020806727.db2.gz HWDLDLWEKDOGRS-UHFFFAOYSA-N 1 1 323.440 3.734 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C)CCc2scnc2C)cc1 ZINC000738300473 1020871729 /nfs/dbraw/zinc/87/17/29/1020871729.db2.gz XVFGRWAOCDNDJW-UHFFFAOYSA-N 1 1 317.502 3.972 20 10 DHCDMO Brc1sccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000282208060 1020881784 /nfs/dbraw/zinc/88/17/84/1020881784.db2.gz IXFZDAJBKBZFBQ-UHFFFAOYSA-N 1 1 324.243 3.735 20 10 DHCDMO Cc1cc(C[NH2+][C@H]2CCCn3ccnc32)c(C)n1-c1ccccc1 ZINC000858543643 1032941131 /nfs/dbraw/zinc/94/11/31/1032941131.db2.gz VBLHQOCQOVEVTE-IBGZPJMESA-N 1 1 320.440 3.915 20 10 DHCDMO CC1(C)C[C@@H]([NH2+]Cc2ccccc2O)CCN1Cc1ccccc1 ZINC001171970056 1032953330 /nfs/dbraw/zinc/95/33/30/1032953330.db2.gz XTFHNCXZMRPHSV-IBGZPJMESA-N 1 1 324.468 3.925 20 10 DHCDMO Cc1cc(O)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1C ZINC000742166485 1021093526 /nfs/dbraw/zinc/09/35/26/1021093526.db2.gz OISDSDYGBYYOKL-GOSISDBHSA-N 1 1 303.446 3.933 20 10 DHCDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000742160240 1021095955 /nfs/dbraw/zinc/09/59/55/1021095955.db2.gz VVZCEHHJBDXBEN-AWEZNQCLSA-N 1 1 304.393 3.887 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]C2CCN(C(C)C)CC2)cc1 ZINC000180406439 1021110441 /nfs/dbraw/zinc/11/04/41/1021110441.db2.gz AGOAWNWUMMTFIR-MRXNPFEDSA-N 1 1 303.494 3.666 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cc1C ZINC000743408857 1021290367 /nfs/dbraw/zinc/29/03/67/1021290367.db2.gz OZLQBUBXEKDNAR-QFBILLFUSA-N 1 1 311.425 3.971 20 10 DHCDMO C[N@H+](Cc1ccc(F)cc1Cl)Cc1cc2c(cc1O)OCO2 ZINC000107093594 1021296913 /nfs/dbraw/zinc/29/69/13/1021296913.db2.gz UOHHESIJZXTNPX-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO C[N@@H+](Cc1ccc(F)cc1Cl)Cc1cc2c(cc1O)OCO2 ZINC000107093594 1021296922 /nfs/dbraw/zinc/29/69/22/1021296922.db2.gz UOHHESIJZXTNPX-UHFFFAOYSA-N 1 1 323.751 3.545 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)C[C@@H](O)c1cc(C)cc(C)c1 ZINC000743870572 1021397355 /nfs/dbraw/zinc/39/73/55/1021397355.db2.gz XXEKJHHCVHTDTD-HXUWFJFHSA-N 1 1 313.441 3.955 20 10 DHCDMO CCOCc1cc(C[NH2+][C@@H](C)c2cscn2)ccc1OC ZINC000850359867 1021486852 /nfs/dbraw/zinc/48/68/52/1021486852.db2.gz UUROWIPIVSBOLN-LBPRGKRZSA-N 1 1 306.431 3.539 20 10 DHCDMO Cc1cc(Br)c(O)c(C[NH2+]C[C@@]2(C)CC2(F)F)c1 ZINC000850379712 1021499597 /nfs/dbraw/zinc/49/95/97/1021499597.db2.gz WDTBBCXJIGHQRM-GFCCVEGCSA-N 1 1 320.177 3.598 20 10 DHCDMO C[C@@H]([NH2+][C@@H](CO)C1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000850487311 1021561877 /nfs/dbraw/zinc/56/18/77/1021561877.db2.gz HJXGGKKARLAYEJ-OQPBUACISA-N 1 1 304.217 3.511 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1ccc(F)cc1O ZINC000850537907 1021593165 /nfs/dbraw/zinc/59/31/65/1021593165.db2.gz AZSMZHHTPDEYRF-DZGCQCFKSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@H](N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537870 1021593558 /nfs/dbraw/zinc/59/35/58/1021593558.db2.gz ASYDIFTXLGSBTN-DZGCQCFKSA-N 1 1 306.425 3.589 20 10 DHCDMO C[C@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)ccc1O ZINC000850537870 1021593564 /nfs/dbraw/zinc/59/35/64/1021593564.db2.gz ASYDIFTXLGSBTN-DZGCQCFKSA-N 1 1 306.425 3.589 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)N[C@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC000850538567 1021593712 /nfs/dbraw/zinc/59/37/12/1021593712.db2.gz IBQHCBHLEAAMGO-CVEARBPZSA-N 1 1 302.462 3.758 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)N[C@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC000850538567 1021593726 /nfs/dbraw/zinc/59/37/26/1021593726.db2.gz IBQHCBHLEAAMGO-CVEARBPZSA-N 1 1 302.462 3.758 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850554081 1021600081 /nfs/dbraw/zinc/60/00/81/1021600081.db2.gz HWTJHIRUUMMKNQ-ATAKMUTHSA-N 1 1 323.408 3.746 20 10 DHCDMO CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccccc1 ZINC000850554359 1021600185 /nfs/dbraw/zinc/60/01/85/1021600185.db2.gz JCKJGFZKXHXASW-FASAQXTFSA-N 1 1 317.404 3.940 20 10 DHCDMO CCCN1CC[C@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000850557161 1021603662 /nfs/dbraw/zinc/60/36/62/1021603662.db2.gz UURPKTDMPDLDLL-RYUDHWBXSA-N 1 1 316.367 3.546 20 10 DHCDMO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000182418757 1021648796 /nfs/dbraw/zinc/64/87/96/1021648796.db2.gz WYRMCKYTPKFHPN-LBPRGKRZSA-N 1 1 323.396 3.503 20 10 DHCDMO C[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccccc1O ZINC000109771379 1021747899 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C[C@H](NCC[N@@H+]1CC[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766383998 1022085028 /nfs/dbraw/zinc/08/50/28/1022085028.db2.gz VDZKUCNJXYFNOQ-MSOLQXFVSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@H](NCC[N@H+]1CC[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766383998 1022085049 /nfs/dbraw/zinc/08/50/49/1022085049.db2.gz VDZKUCNJXYFNOQ-MSOLQXFVSA-N 1 1 315.505 3.669 20 10 DHCDMO Cn1c2cc(F)ccc2[nH+]c1NCc1ccc(N2CCCC2)cc1 ZINC000766521792 1022173654 /nfs/dbraw/zinc/17/36/54/1022173654.db2.gz VAFXVIKRRPODFI-UHFFFAOYSA-N 1 1 324.403 3.925 20 10 DHCDMO COc1cc(C[N@H+]2CC3(CCC3)[C@H]2c2ccncc2)c(O)cc1C ZINC000853632402 1022302815 /nfs/dbraw/zinc/30/28/15/1022302815.db2.gz FSJSZZHPMBNKFD-LJQANCHMSA-N 1 1 324.424 3.831 20 10 DHCDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185143620 1022461574 /nfs/dbraw/zinc/46/15/74/1022461574.db2.gz PBNWOWYBPFIIIK-CYBMUJFWSA-N 1 1 318.392 3.956 20 10 DHCDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc(Br)ccc1O ZINC000763645455 1022656397 /nfs/dbraw/zinc/65/63/97/1022656397.db2.gz GQFIDQSCGQVUSQ-LLVKDONJSA-N 1 1 310.235 3.919 20 10 DHCDMO C[N@@H+](CCOC(C)(C)C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000767771992 1022806258 /nfs/dbraw/zinc/80/62/58/1022806258.db2.gz MZFAXEWMRZXIIB-UHFFFAOYSA-N 1 1 309.450 3.642 20 10 DHCDMO CCCC[N@@H+](CC)Cc1cc(Br)cc(OC)c1O ZINC000768143842 1022892445 /nfs/dbraw/zinc/89/24/45/1022892445.db2.gz PQAXTVXPITXTDY-UHFFFAOYSA-N 1 1 316.239 3.785 20 10 DHCDMO OCC[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C1CCCC1 ZINC000768137311 1022903588 /nfs/dbraw/zinc/90/35/88/1022903588.db2.gz JKGLDLYIHJDFFP-UHFFFAOYSA-N 1 1 311.425 3.796 20 10 DHCDMO CCN(Cc1ccccc1)c1ccc(C[N@H+]2CCC[C@@H](O)C2)cc1 ZINC000768140054 1022903737 /nfs/dbraw/zinc/90/37/37/1022903737.db2.gz ABUNVSUZUQPEIX-OAQYLSRUSA-N 1 1 324.468 3.670 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)CC1CCC2(CC1)OCCO2 ZINC000190257726 1022910311 /nfs/dbraw/zinc/91/03/11/1022910311.db2.gz KYGLNQPRFQXACY-UHFFFAOYSA-N 1 1 319.445 3.538 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCc3sccc3[C@H]2C)c1 ZINC000768206733 1022915317 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ZINC000768334229 1022947502 /nfs/dbraw/zinc/94/75/02/1022947502.db2.gz NXWMOERDXAXHHJ-UHFFFAOYSA-N 1 1 303.377 3.951 20 10 DHCDMO CCc1nc(C[N@H+](C)Cc2cc3c(cc2O)CCCC3)cs1 ZINC000768444408 1022967392 /nfs/dbraw/zinc/96/73/92/1022967392.db2.gz YDYASQFIFPEAEJ-UHFFFAOYSA-N 1 1 316.470 3.922 20 10 DHCDMO CCc1nc(C[N@@H+](C)Cc2cc3c(cc2O)CCCC3)cs1 ZINC000768444408 1022967399 /nfs/dbraw/zinc/96/73/99/1022967399.db2.gz YDYASQFIFPEAEJ-UHFFFAOYSA-N 1 1 316.470 3.922 20 10 DHCDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000768462953 1022972851 /nfs/dbraw/zinc/97/28/51/1022972851.db2.gz PGKWZPVSURMDFA-DZGCQCFKSA-N 1 1 307.434 3.810 20 10 DHCDMO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2cc(F)cc(F)c2O)cn1 ZINC000756575150 1023034116 /nfs/dbraw/zinc/03/41/16/1023034116.db2.gz NKXRLMOCJMOURR-WDEREUQCSA-N 1 1 309.360 3.860 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+](Cc2ccccn2)C(C)C)c1 ZINC000768925375 1023057975 /nfs/dbraw/zinc/05/79/75/1023057975.db2.gz HJIQMARLLITAET-UHFFFAOYSA-N 1 1 300.402 3.597 20 10 DHCDMO Cc1cc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000123777739 1023068147 /nfs/dbraw/zinc/06/81/47/1023068147.db2.gz PTRUGEBVYXQUFX-OAHLLOKOSA-N 1 1 317.473 3.999 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](CC)CCc2ccccn2)cc1 ZINC000769038195 1023074085 /nfs/dbraw/zinc/07/40/85/1023074085.db2.gz TVAPXJVEEQFPOA-UHFFFAOYSA-N 1 1 311.473 3.992 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC(C)(C)O1 ZINC000769100718 1023080498 /nfs/dbraw/zinc/08/04/98/1023080498.db2.gz OWKMUBPMBFWDNT-MRXNPFEDSA-N 1 1 302.462 3.676 20 10 DHCDMO CC(C)n1ncc2c1C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)CC2 ZINC000364377376 1023099202 /nfs/dbraw/zinc/09/92/02/1023099202.db2.gz OTMAETQBWSQBNO-WFASDCNBSA-N 1 1 317.408 3.517 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c1 ZINC000769244764 1023107832 /nfs/dbraw/zinc/10/78/32/1023107832.db2.gz ORGZKVYQURJIIV-UYAOXDASSA-N 1 1 311.425 3.789 20 10 DHCDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769319693 1023121099 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CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769426685 1023147198 /nfs/dbraw/zinc/14/71/98/1023147198.db2.gz VPYAXSHZGCCXFF-GOSISDBHSA-N 1 1 320.452 3.673 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c(O)c1 ZINC000769425402 1023147488 /nfs/dbraw/zinc/14/74/88/1023147488.db2.gz HFWBDUXNRIGWRX-GOSISDBHSA-N 1 1 312.413 3.831 20 10 DHCDMO CC1=CC[N@@H+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 ZINC000769447602 1023155502 /nfs/dbraw/zinc/15/55/02/1023155502.db2.gz SVKIEQKBRZCKTF-UHFFFAOYSA-N 1 1 315.417 3.737 20 10 DHCDMO CCC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000769469730 1023162003 /nfs/dbraw/zinc/16/20/03/1023162003.db2.gz DMSSHEGBQUAJHI-IPMKNSEASA-N 1 1 316.489 3.778 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)[C@@H](C)C(C)C ZINC000876644048 1033112764 /nfs/dbraw/zinc/11/27/64/1033112764.db2.gz UXTSMHASGCRFGQ-INIZCTEOSA-N 1 1 304.478 3.514 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)cc1 ZINC000770293496 1023293014 /nfs/dbraw/zinc/29/30/14/1023293014.db2.gz PFFJIZAJANLCMR-IEBWSBKVSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3ccccc3O)C2)cc1 ZINC000770511036 1023316264 /nfs/dbraw/zinc/31/62/64/1023316264.db2.gz WBAXNYAFLRAFNU-QGZVFWFLSA-N 1 1 311.425 3.856 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc4c(c3)CC(C)(C)O4)ccc21 ZINC000770587489 1023327357 /nfs/dbraw/zinc/32/73/57/1023327357.db2.gz DAAJTITTZDPQAX-UHFFFAOYSA-N 1 1 307.397 3.899 20 10 DHCDMO CCC1(CC)CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876725933 1033127584 /nfs/dbraw/zinc/12/75/84/1033127584.db2.gz QPXZZUHJUIWDOF-UHFFFAOYSA-N 1 1 316.489 3.660 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)cc1 ZINC000771933454 1023489963 /nfs/dbraw/zinc/48/99/63/1023489963.db2.gz JHWGCBRTGZJBOS-UHFFFAOYSA-N 1 1 308.347 3.802 20 10 DHCDMO CCCCN(C)CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788592234 1023910346 /nfs/dbraw/zinc/91/03/46/1023910346.db2.gz KWUYMPNRNMWLBR-GFCCVEGCSA-N 1 1 318.383 3.794 20 10 DHCDMO CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000788589857 1023910671 /nfs/dbraw/zinc/91/06/71/1023910671.db2.gz DFHSIDUTVSIUBB-RWSFTLGLSA-N 1 1 319.367 3.859 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cccc(C(F)(F)F)c1O ZINC000788600896 1023911113 /nfs/dbraw/zinc/91/11/13/1023911113.db2.gz FHQYPHYBACQHPH-GHMZBOCLSA-N 1 1 319.367 3.859 20 10 DHCDMO COC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)C ZINC000788612504 1023914060 /nfs/dbraw/zinc/91/40/60/1023914060.db2.gz MPHNKFTYKPMJPV-MFKMUULPSA-N 1 1 305.340 3.733 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccnc1F)c1cccc(C(F)(F)F)c1O ZINC000788805946 1023936659 /nfs/dbraw/zinc/93/66/59/1023936659.db2.gz MMTJPIXOYADRDO-SECBINFHSA-N 1 1 314.282 3.796 20 10 DHCDMO CC(C)[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C(C)(C)O ZINC000788773611 1023937755 /nfs/dbraw/zinc/93/77/55/1023937755.db2.gz CALPBKFBUIQTGH-YGRLFVJLSA-N 1 1 319.367 3.857 20 10 DHCDMO CC[C@@H]([NH2+]CCc1cccc(OC)c1)c1ccc(F)cc1O ZINC000796693007 1024003569 /nfs/dbraw/zinc/00/35/69/1024003569.db2.gz COIVBWQQWHITHF-QGZVFWFLSA-N 1 1 303.377 3.823 20 10 DHCDMO CC(C)(C)c1cc(O)c(O)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000789511426 1024106443 /nfs/dbraw/zinc/10/64/43/1024106443.db2.gz ZYLJHFPHQDIIAI-WBVHZDCISA-N 1 1 319.445 3.539 20 10 DHCDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000789586343 1024119818 /nfs/dbraw/zinc/11/98/18/1024119818.db2.gz LQASWJYMSUOMMS-KRWDZBQOSA-N 1 1 319.832 3.735 20 10 DHCDMO C[N@@H+](Cc1cc(Br)cs1)Cc1ccccc1O ZINC000116879162 1033190449 /nfs/dbraw/zinc/19/04/49/1033190449.db2.gz SXWRCJJKEJKXGC-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO CC(C)Oc1ccccc1C[NH2+]Cc1cc(F)cc(F)c1O ZINC000882910376 1024170545 /nfs/dbraw/zinc/17/05/45/1024170545.db2.gz QYBDYSYMPWKHCD-UHFFFAOYSA-N 1 1 307.340 3.747 20 10 DHCDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(N3CCOCC3)cc2)C1 ZINC000130657482 1024196222 /nfs/dbraw/zinc/19/62/22/1024196222.db2.gz VDBSDUXLOLOVBK-VQIMIIECSA-N 1 1 302.462 3.534 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccccc1OCC1CC1 ZINC000883015944 1024212820 /nfs/dbraw/zinc/21/28/20/1024212820.db2.gz JLBYZSOQYQGIMB-UHFFFAOYSA-N 1 1 319.351 3.749 20 10 DHCDMO C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000790748195 1024367645 /nfs/dbraw/zinc/36/76/45/1024367645.db2.gz KZPZEZUHXVWSQF-CYBMUJFWSA-N 1 1 310.869 3.818 20 10 DHCDMO CC1(C)C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C(C)(C)O1 ZINC000790988847 1024411029 /nfs/dbraw/zinc/41/10/29/1024411029.db2.gz CVENEKUGWMMXKV-GFCCVEGCSA-N 1 1 301.789 3.620 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCC[C@H]1CCCC[C@H]1O ZINC000790976992 1024421523 /nfs/dbraw/zinc/42/15/23/1024421523.db2.gz DHYYVWNCFAQZKP-BXUZGUMPSA-N 1 1 315.816 3.606 20 10 DHCDMO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000790980675 1024423821 /nfs/dbraw/zinc/42/38/21/1024423821.db2.gz PQZVJCMYTRVPND-IINYFYTJSA-N 1 1 315.816 3.868 20 10 DHCDMO CC(C)CC[N@@H+](Cc1cc2c(cc1O)OCO2)C1CCCC1 ZINC000317427847 1024540391 /nfs/dbraw/zinc/54/03/91/1024540391.db2.gz RLEJXQZICGHSJV-UHFFFAOYSA-N 1 1 305.418 3.912 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(N(C)C)cc1 ZINC000271599144 1024547697 /nfs/dbraw/zinc/54/76/97/1024547697.db2.gz ZKZBJDZLZCVTCV-CJNGLKHVSA-N 1 1 315.465 3.796 20 10 DHCDMO CC(C)[C@@H]([NH3+])CC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000133400049 1024633544 /nfs/dbraw/zinc/63/35/44/1024633544.db2.gz BHBQZBYYCICOPA-ZDUSSCGKSA-N 1 1 305.249 3.504 20 10 DHCDMO CC[C@H]1C[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CCO1 ZINC001170170545 1024680211 /nfs/dbraw/zinc/68/02/11/1024680211.db2.gz UAYNPDFKYFIEJC-OLZOCXBDSA-N 1 1 320.820 3.641 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2ccoc2)c(C(F)(F)F)c1 ZINC000792794418 1024791962 /nfs/dbraw/zinc/79/19/62/1024791962.db2.gz ZZSZDDLYJCAZPM-UHFFFAOYSA-N 1 1 312.335 3.996 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)[C@H]2CCSC2)c(C(F)(F)F)c1 ZINC000792782146 1024796397 /nfs/dbraw/zinc/79/63/97/1024796397.db2.gz ZMIDCVARPUEFRU-ZDUSSCGKSA-N 1 1 318.408 3.709 20 10 DHCDMO CCC[N@@H+](Cc1ccc(C(=O)OC)s1)Cc1ccccc1O ZINC000163378310 1024799819 /nfs/dbraw/zinc/79/98/19/1024799819.db2.gz CNDJBDLHYJVSQC-UHFFFAOYSA-N 1 1 319.426 3.653 20 10 DHCDMO C[C@@]12CC[N@@H+](Cc3cc4c(cc3O)CCCC4)C[C@@H]1C2(F)F ZINC000793517212 1025068508 /nfs/dbraw/zinc/06/85/08/1025068508.db2.gz FIWHCEJRASWKRX-DLBZAZTESA-N 1 1 307.384 3.748 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)cc1F ZINC000793620457 1025135810 /nfs/dbraw/zinc/13/58/10/1025135810.db2.gz PGFQZDGDPKHFMY-LJQANCHMSA-N 1 1 320.452 3.674 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1Cl ZINC000825949537 1033276339 /nfs/dbraw/zinc/27/63/39/1033276339.db2.gz WSVPFVLDYMQIAW-IAGOWNOFSA-N 1 1 321.848 3.888 20 10 DHCDMO CCn1cc(C[N@@H+](C)Cc2ccccc2O)c(-c2ccccc2)n1 ZINC000893962098 1025616037 /nfs/dbraw/zinc/61/60/37/1025616037.db2.gz KZTXGJOZEHVBDW-UHFFFAOYSA-N 1 1 321.424 3.908 20 10 DHCDMO C[C@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1c(O)cccc1F ZINC000886513197 1025667400 /nfs/dbraw/zinc/66/74/00/1025667400.db2.gz WJIQUVSMEACDPU-LBPRGKRZSA-N 1 1 313.376 3.691 20 10 DHCDMO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1c(O)cccc1F ZINC000886521393 1025674166 /nfs/dbraw/zinc/67/41/66/1025674166.db2.gz ZYJXPVFKBMFHFL-GFCCVEGCSA-N 1 1 317.360 3.543 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1c(O)cccc1F ZINC000886547310 1025697014 /nfs/dbraw/zinc/69/70/14/1025697014.db2.gz IZXKZPNGMAHXOM-IINYFYTJSA-N 1 1 305.324 3.845 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)c1c(O)cccc1F ZINC000886558233 1025704821 /nfs/dbraw/zinc/70/48/21/1025704821.db2.gz FCESFVUBDYCWDO-XKFJNSEWSA-N 1 1 313.463 3.562 20 10 DHCDMO CC(C)n1ncc2c1C[C@H]([NH2+][C@H](C)c1c(O)cccc1F)CC2 ZINC000886598521 1025731283 /nfs/dbraw/zinc/73/12/83/1025731283.db2.gz CKVKCNIQKVFJEU-TZMCWYRMSA-N 1 1 317.408 3.517 20 10 DHCDMO CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1c(O)cccc1F)c1ccccc1 ZINC000886637759 1025752972 /nfs/dbraw/zinc/75/29/72/1025752972.db2.gz DXFNIPMXLFHXOH-MJXNMMHHSA-N 1 1 317.404 3.940 20 10 DHCDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccccc1O ZINC000075829213 1025853073 /nfs/dbraw/zinc/85/30/73/1025853073.db2.gz HIYUSCBEOTWVKC-UHFFFAOYSA-N 1 1 312.413 3.551 20 10 DHCDMO CCCOc1ccc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c(O)c1 ZINC000289660345 1026115996 /nfs/dbraw/zinc/11/59/96/1026115996.db2.gz YNONHPFYWRPZDV-KRWDZBQOSA-N 1 1 315.417 3.631 20 10 DHCDMO CCCOc1ccc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c(O)c1 ZINC000289660345 1026116007 /nfs/dbraw/zinc/11/60/07/1026116007.db2.gz YNONHPFYWRPZDV-KRWDZBQOSA-N 1 1 315.417 3.631 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2ccco2)Cc2ccccn2)cc1 ZINC000289715554 1026144289 /nfs/dbraw/zinc/14/42/89/1026144289.db2.gz GXTZTUVIUABTKL-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2ccco2)Cc2ccccn2)cc1 ZINC000289715554 1026144295 /nfs/dbraw/zinc/14/42/95/1026144295.db2.gz GXTZTUVIUABTKL-UHFFFAOYSA-N 1 1 321.424 3.943 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000245717931 1026159339 /nfs/dbraw/zinc/15/93/39/1026159339.db2.gz HJIQAJRQSCZMRF-CXAGYDPISA-N 1 1 303.427 3.724 20 10 DHCDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700202 1026587512 /nfs/dbraw/zinc/58/75/12/1026587512.db2.gz ACNVTONEKXUGKH-NWDGAFQWSA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000809700202 1026587504 /nfs/dbraw/zinc/58/75/04/1026587504.db2.gz ACNVTONEKXUGKH-NWDGAFQWSA-N 1 1 315.816 3.700 20 10 DHCDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc(OCC)cc1O ZINC000809734925 1026597728 /nfs/dbraw/zinc/59/77/28/1026597728.db2.gz SOEZUMMPISQUGK-UHFFFAOYSA-N 1 1 314.429 3.641 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](N3CCCC3)[C@@H]2C)cc1 ZINC000809724582 1026604222 /nfs/dbraw/zinc/60/42/22/1026604222.db2.gz QJSQAQMGIPDYHX-FXAWDEMLSA-N 1 1 315.505 3.591 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](N3CCCC3)[C@@H]2C)cc1 ZINC000809724582 1026604251 /nfs/dbraw/zinc/60/42/51/1026604251.db2.gz QJSQAQMGIPDYHX-FXAWDEMLSA-N 1 1 315.505 3.591 20 10 DHCDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000809766977 1026605062 /nfs/dbraw/zinc/60/50/62/1026605062.db2.gz CTFBHLKHHQHSHH-GFCCVEGCSA-N 1 1 303.855 3.628 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c1O ZINC000809767876 1026606052 /nfs/dbraw/zinc/60/60/52/1026606052.db2.gz WRLGACXUUMUURG-QGZVFWFLSA-N 1 1 321.424 3.715 20 10 DHCDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000809755623 1026615616 /nfs/dbraw/zinc/61/56/16/1026615616.db2.gz AHVUSBVSJAODEF-FQEVSTJZSA-N 1 1 316.489 3.804 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)[C@H](CC)c2ccncc2)c(O)c1 ZINC000809765538 1026620796 /nfs/dbraw/zinc/62/07/96/1026620796.db2.gz NZXNUEHUZIASQG-QGZVFWFLSA-N 1 1 300.402 3.769 20 10 DHCDMO C[C@H]([NH2+][C@@H](CO)C1CCCC1)c1cc(Cl)c(Cl)cc1O ZINC000810259412 1026721471 /nfs/dbraw/zinc/72/14/71/1026721471.db2.gz IPLDMJMFDKFUGD-XPTSAGLGSA-N 1 1 318.244 3.901 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)c1O ZINC000811510808 1027026138 /nfs/dbraw/zinc/02/61/38/1027026138.db2.gz PICRGUAYWKSYMD-ZBFHGGJFSA-N 1 1 309.837 3.743 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)c1O ZINC000811510806 1027026815 /nfs/dbraw/zinc/02/68/15/1027026815.db2.gz PICRGUAYWKSYMD-GOEBONIOSA-N 1 1 309.837 3.743 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c1O ZINC000811510807 1027027551 /nfs/dbraw/zinc/02/75/51/1027027551.db2.gz PICRGUAYWKSYMD-HOCLYGCPSA-N 1 1 309.837 3.743 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1C ZINC000811513364 1027029271 /nfs/dbraw/zinc/02/92/71/1027029271.db2.gz UUCMVDWTGWPXAJ-IBGZPJMESA-N 1 1 322.452 3.646 20 10 DHCDMO Cc1ccc2c(C)cc(NCCc3ccc(O)c(O)c3)[nH+]c2c1 ZINC000811811089 1027090858 /nfs/dbraw/zinc/09/08/58/1027090858.db2.gz LHJZKHHVTJBHOR-UHFFFAOYSA-N 1 1 308.381 3.917 20 10 DHCDMO Cc1cc(C[N@H+](C(C)C)[C@@H]2CCOC2)c(O)c(C(C)(C)C)c1 ZINC000812293763 1027249271 /nfs/dbraw/zinc/24/92/71/1027249271.db2.gz XSQHTBYJAHNGHR-MRXNPFEDSA-N 1 1 305.462 3.997 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](C(C)C)[C@@H]2CCOC2)cc1F ZINC000812777190 1027400223 /nfs/dbraw/zinc/40/02/23/1027400223.db2.gz YVKLSWOXNYLRIF-MRXNPFEDSA-N 1 1 308.441 3.671 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N2CCCCCC2)cc1)C[NH+](C)C ZINC000813877527 1027746476 /nfs/dbraw/zinc/74/64/76/1027746476.db2.gz YSYGEIZFKKYOMK-MSOLQXFVSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)CN(C)C ZINC000813877527 1027746494 /nfs/dbraw/zinc/74/64/94/1027746494.db2.gz YSYGEIZFKKYOMK-MSOLQXFVSA-N 1 1 317.521 3.915 20 10 DHCDMO C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(N2CCCCC2)cc1 ZINC000813877963 1027746650 /nfs/dbraw/zinc/74/66/50/1027746650.db2.gz IVQLBKQOOSNYLP-DLBZAZTESA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(N2CCCCC2)cc1 ZINC000813877963 1027746660 /nfs/dbraw/zinc/74/66/60/1027746660.db2.gz IVQLBKQOOSNYLP-DLBZAZTESA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@H](CN[C@@H](C)c1ccc(N2CCCCC2)cc1)C[NH+](C)C ZINC000813877966 1027748637 /nfs/dbraw/zinc/74/86/37/1027748637.db2.gz IVQLBKQOOSNYLP-SJORKVTESA-N 1 1 303.494 3.525 20 10 DHCDMO C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)CN(C)C ZINC000813877966 1027748654 /nfs/dbraw/zinc/74/86/54/1027748654.db2.gz IVQLBKQOOSNYLP-SJORKVTESA-N 1 1 303.494 3.525 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2ccc(C)o2)C1 ZINC000364621023 1027855424 /nfs/dbraw/zinc/85/54/24/1027855424.db2.gz GIDXNIKYJMJJQV-MAUKXSAKSA-N 1 1 301.386 3.818 20 10 DHCDMO Cc1ccoc1C[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000814174319 1027912029 /nfs/dbraw/zinc/91/20/29/1027912029.db2.gz DCCCGIFXHLRXFX-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO Cc1ccoc1C[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000814174319 1027912041 /nfs/dbraw/zinc/91/20/41/1027912041.db2.gz DCCCGIFXHLRXFX-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO CC1(C)C[N@@H+](Cc2cc3c(cc2O)CCC3)[C@H]1c1ccncc1 ZINC000814227917 1027963130 /nfs/dbraw/zinc/96/31/30/1027963130.db2.gz PVLHDEFMXOASEA-IBGZPJMESA-N 1 1 308.425 3.859 20 10 DHCDMO CCCC[N@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccccc1O ZINC000814635549 1028130829 /nfs/dbraw/zinc/13/08/29/1028130829.db2.gz FGMYMQYXHGSFFT-UHFFFAOYSA-N 1 1 316.449 3.610 20 10 DHCDMO CCCC[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccccc1O ZINC000814635549 1028130835 /nfs/dbraw/zinc/13/08/35/1028130835.db2.gz FGMYMQYXHGSFFT-UHFFFAOYSA-N 1 1 316.449 3.610 20 10 DHCDMO CC(C)[C@@H](O)C[N@@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000814630837 1028131575 /nfs/dbraw/zinc/13/15/75/1028131575.db2.gz ZESAXOBYEOKLPF-JXFKEZNVSA-N 1 1 313.441 3.972 20 10 DHCDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000780793968 1028183623 /nfs/dbraw/zinc/18/36/23/1028183623.db2.gz ZWXZOGOGVQBXGR-TZMCWYRMSA-N 1 1 300.368 3.915 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1[O-] ZINC000367491331 1028192870 /nfs/dbraw/zinc/19/28/70/1028192870.db2.gz SPUKUXVGBICYMC-IOASZLSFSA-N 1 1 308.853 3.713 20 10 DHCDMO CCc1nc([C@H]2CCC[N@H+]2[C@@H](CC)c2ccccc2O)no1 ZINC000368030911 1028284019 /nfs/dbraw/zinc/28/40/19/1028284019.db2.gz QKHWLAOHRMXLAH-UONOGXRCSA-N 1 1 301.390 3.626 20 10 DHCDMO CCc1nc([C@H]2CCC[N@@H+]2[C@@H](CC)c2ccccc2O)no1 ZINC000368030911 1028284033 /nfs/dbraw/zinc/28/40/33/1028284033.db2.gz QKHWLAOHRMXLAH-UONOGXRCSA-N 1 1 301.390 3.626 20 10 DHCDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000815042432 1028343049 /nfs/dbraw/zinc/34/30/49/1028343049.db2.gz PQFOAMGKOFHWMB-GOSISDBHSA-N 1 1 304.478 3.842 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2ccc(N(C)C)c(C)c2)s1 ZINC000815075513 1028353234 /nfs/dbraw/zinc/35/32/34/1028353234.db2.gz FOVJKOWQKPPQKK-UHFFFAOYSA-N 1 1 303.475 3.500 20 10 DHCDMO Cc1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc1N(C)C ZINC000815118970 1028365707 /nfs/dbraw/zinc/36/57/07/1028365707.db2.gz NWROIWXOJDAMLI-RTBURBONSA-N 1 1 314.473 3.595 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)cc1 ZINC000815117456 1028365886 /nfs/dbraw/zinc/36/58/86/1028365886.db2.gz NITSSIQXFSECEP-QFBILLFUSA-N 1 1 304.478 3.658 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1 ZINC000815119414 1028367659 /nfs/dbraw/zinc/36/76/59/1028367659.db2.gz WYGAYCAXEHEWLK-RBUKOAKNSA-N 1 1 314.473 3.676 20 10 DHCDMO C[C@@H]([NH2+]C[C@]1(C)CCCO1)c1cccc(C(F)(F)F)c1O ZINC000815587371 1028555934 /nfs/dbraw/zinc/55/59/34/1028555934.db2.gz IFFOTXYEEIIMAT-YGRLFVJLSA-N 1 1 303.324 3.631 20 10 DHCDMO CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1(C)C ZINC000815587473 1028556597 /nfs/dbraw/zinc/55/65/97/1028556597.db2.gz KUBTYQCMBCDWKV-ZWKOPEQDSA-N 1 1 317.351 3.875 20 10 DHCDMO C[C@@H]([NH2+]CC1(CCO)CCC1)c1cccc(C(F)(F)F)c1O ZINC000815597056 1028562294 /nfs/dbraw/zinc/56/22/94/1028562294.db2.gz LKLXZLOQAOHKGO-LLVKDONJSA-N 1 1 317.351 3.614 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1O ZINC000779188670 1028666965 /nfs/dbraw/zinc/66/69/65/1028666965.db2.gz WQYBXFAFCINOMA-MRXNPFEDSA-N 1 1 309.837 3.745 20 10 DHCDMO CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](C)C2)cc1 ZINC000190051624 1028745747 /nfs/dbraw/zinc/74/57/47/1028745747.db2.gz XGPZJTXLFIADGR-VQIMIIECSA-N 1 1 304.478 3.516 20 10 DHCDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000190223612 1028842662 /nfs/dbraw/zinc/84/26/62/1028842662.db2.gz CHILPFHWJNXJHM-FQEVSTJZSA-N 1 1 316.489 3.661 20 10 DHCDMO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c1O ZINC000372433062 1028853160 /nfs/dbraw/zinc/85/31/60/1028853160.db2.gz ADHOQCBGLFILGW-CYBMUJFWSA-N 1 1 304.415 3.585 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2nccs2)c1O ZINC000372433062 1028853177 /nfs/dbraw/zinc/85/31/77/1028853177.db2.gz ADHOQCBGLFILGW-CYBMUJFWSA-N 1 1 304.415 3.585 20 10 DHCDMO COCC[C@H]1CCCC[N@H+]([C@H](C)c2cc(OC)ccc2O)C1 ZINC000372718253 1028888373 /nfs/dbraw/zinc/88/83/73/1028888373.db2.gz PQAQSQAHBVPDIE-HUUCEWRRSA-N 1 1 307.434 3.600 20 10 DHCDMO CCOC(=O)C[N@H+](Cc1ccc2ccccc2c1O)CC(C)C ZINC000816491800 1028900073 /nfs/dbraw/zinc/90/00/73/1028900073.db2.gz ZAWOCYQFVWJYNX-UHFFFAOYSA-N 1 1 315.413 3.567 20 10 DHCDMO CCC[N@H+](Cc1ccccc1O)Cc1c(F)ccc(O)c1F ZINC000816499024 1028906909 /nfs/dbraw/zinc/90/69/09/1028906909.db2.gz BJHJMWCZNPARIZ-UHFFFAOYSA-N 1 1 307.340 3.788 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1c(F)ccc(O)c1F ZINC000816499024 1028906924 /nfs/dbraw/zinc/90/69/24/1028906924.db2.gz BJHJMWCZNPARIZ-UHFFFAOYSA-N 1 1 307.340 3.788 20 10 DHCDMO C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816529931 1028923087 /nfs/dbraw/zinc/92/30/87/1028923087.db2.gz MPPNUVAPCMCGBU-MRXNPFEDSA-N 1 1 312.457 3.900 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816529931 1028923099 /nfs/dbraw/zinc/92/30/99/1028923099.db2.gz MPPNUVAPCMCGBU-MRXNPFEDSA-N 1 1 312.457 3.900 20 10 DHCDMO CC(C)n1cc([C@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cn1 ZINC000816549478 1028929618 /nfs/dbraw/zinc/92/96/18/1028929618.db2.gz PBBDKZNBMVNSKF-JTQLQIEISA-N 1 1 311.788 3.813 20 10 DHCDMO CS[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816549961 1028930560 /nfs/dbraw/zinc/93/05/60/1028930560.db2.gz DGSWWTAEBKUFJK-WDEREUQCSA-N 1 1 303.830 3.949 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000816528314 1028935889 /nfs/dbraw/zinc/93/58/89/1028935889.db2.gz WDUZIZJFRDWUBF-LLVKDONJSA-N 1 1 321.779 3.526 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000816592283 1028939454 /nfs/dbraw/zinc/93/94/54/1028939454.db2.gz FSEPNJLCLDLTJS-QMMMGPOBSA-N 1 1 311.706 3.959 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000816592283 1028939464 /nfs/dbraw/zinc/93/94/64/1028939464.db2.gz FSEPNJLCLDLTJS-QMMMGPOBSA-N 1 1 311.706 3.959 20 10 DHCDMO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816574151 1028951809 /nfs/dbraw/zinc/95/18/09/1028951809.db2.gz YORPMDPGPMNIPZ-ZBFHGGJFSA-N 1 1 315.816 3.868 20 10 DHCDMO CC(C)[C@H]1[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C ZINC000816624717 1028953887 /nfs/dbraw/zinc/95/38/87/1028953887.db2.gz FLVUOPLHJXCWGB-GOSISDBHSA-N 1 1 320.452 3.529 20 10 DHCDMO Cc1ccc([C@H](O)[C@@H](C)[NH2+]Cc2cc(Cl)c(F)cc2O)cc1 ZINC000816608508 1028960279 /nfs/dbraw/zinc/96/02/79/1028960279.db2.gz BERJNVGVXXIQRX-PIGZYNQJSA-N 1 1 323.795 3.705 20 10 DHCDMO Cc1cccc(C[N@H+]2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c1O ZINC000816643151 1028967279 /nfs/dbraw/zinc/96/72/79/1028967279.db2.gz WMROTGBFODFQJI-OAHLLOKOSA-N 1 1 317.351 3.632 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000817366748 1029145552 /nfs/dbraw/zinc/14/55/52/1029145552.db2.gz YWVCTXBZCRZLBL-LBPRGKRZSA-N 1 1 317.351 3.874 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@@H]1CC12CCSCC2 ZINC000817411758 1029152170 /nfs/dbraw/zinc/15/21/70/1029152170.db2.gz VRBIRTOKQJHVMN-NSHDSACASA-N 1 1 315.841 3.808 20 10 DHCDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000817413274 1029153314 /nfs/dbraw/zinc/15/33/14/1029153314.db2.gz VNFLLCQQTPOTMC-CVEARBPZSA-N 1 1 311.425 3.510 20 10 DHCDMO CCc1ccc([C@H](C)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938941 1029281467 /nfs/dbraw/zinc/28/14/67/1029281467.db2.gz WAVHMPKXKBICCD-MGPUTAFESA-N 1 1 311.473 3.666 20 10 DHCDMO C[C@@H](NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)cc1 ZINC000817937988 1029281952 /nfs/dbraw/zinc/28/19/52/1029281952.db2.gz AXJVOYQKTMBSSQ-FZKQIMNGSA-N 1 1 317.864 3.757 20 10 DHCDMO CC[NH2+]CCCN[C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817943627 1029285910 /nfs/dbraw/zinc/28/59/10/1029285910.db2.gz PZGCYLJAOIVSQW-KRWDZBQOSA-N 1 1 303.494 3.717 20 10 DHCDMO CC(C)[NH2+]CCCN[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952936 1029293952 /nfs/dbraw/zinc/29/39/52/1029293952.db2.gz JJVDBROVQHACFG-MRXNPFEDSA-N 1 1 321.484 3.855 20 10 DHCDMO CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817958936 1029298555 /nfs/dbraw/zinc/29/85/55/1029298555.db2.gz NCALJSHJHWZNGY-UWVGGRQHSA-N 1 1 305.249 3.723 20 10 DHCDMO CCC[NH2+]CC[NH2+][C@H](CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000817963925 1029300776 /nfs/dbraw/zinc/30/07/76/1029300776.db2.gz YLUMCELBKBNGHA-GFCCVEGCSA-N 1 1 305.249 3.739 20 10 DHCDMO CC(C)C[C@H](C[NH3+])N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960484 1029302653 /nfs/dbraw/zinc/30/26/53/1029302653.db2.gz ZQMUFGBUBNACAH-FUHWJXTLSA-N 1 1 303.494 3.701 20 10 DHCDMO CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817969024 1029308394 /nfs/dbraw/zinc/30/83/94/1029308394.db2.gz POQLSNCHMKFIMQ-TZMCWYRMSA-N 1 1 316.367 3.594 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817971570 1029310157 /nfs/dbraw/zinc/31/01/57/1029310157.db2.gz OHHYYTLNBYVAGP-OSMZGAPFSA-N 1 1 316.367 3.592 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817971574 1029310540 /nfs/dbraw/zinc/31/05/40/1029310540.db2.gz OHHYYTLNBYVAGP-SUHUHFCYSA-N 1 1 316.367 3.592 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1C[NH2+]CC[C@H]1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817969042 1029310581 /nfs/dbraw/zinc/31/05/81/1029310581.db2.gz QHHWXTFLGUGIIW-JIMOISOXSA-N 1 1 317.260 3.738 20 10 DHCDMO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817969045 1029310781 /nfs/dbraw/zinc/31/07/81/1029310781.db2.gz QHXUZPXVTLJCTR-DOTOQJQBSA-N 1 1 319.468 3.609 20 10 DHCDMO CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970184 1029311245 /nfs/dbraw/zinc/31/12/45/1029311245.db2.gz NNUYGKQKUGTAFG-DYEKYZERSA-N 1 1 316.367 3.722 20 10 DHCDMO CC[NH2+][C@H](C)C[NH2+][C@H](CC)c1ccc(Cl)c(Cl)c1[O-] ZINC000817972491 1029312397 /nfs/dbraw/zinc/31/23/97/1029312397.db2.gz LZGBNDOFEOQUHY-BXKDBHETSA-N 1 1 305.249 3.738 20 10 DHCDMO C[C@H]([NH2+][C@@H](C[NH3+])C1CCCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817982907 1029320525 /nfs/dbraw/zinc/32/05/25/1029320525.db2.gz WCEHCHUCHZPCBM-HZMBPMFUSA-N 1 1 316.367 3.579 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC000817985163 1029322672 /nfs/dbraw/zinc/32/26/72/1029322672.db2.gz BJYTZJALLSMJDD-PQEBFOHHSA-N 1 1 310.441 3.584 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1O ZINC000245873367 1030167321 /nfs/dbraw/zinc/16/73/21/1030167321.db2.gz SDUUSYYHSNGAAM-JKSUJKDBSA-N 1 1 317.454 3.850 20 10 DHCDMO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(Cl)c1F ZINC000823375236 1030272469 /nfs/dbraw/zinc/27/24/69/1030272469.db2.gz FBBHXKQXXCMIAD-UHFFFAOYSA-N 1 1 321.827 3.962 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)Cc1ccnc(Cl)c1F ZINC000823375236 1030272476 /nfs/dbraw/zinc/27/24/76/1030272476.db2.gz FBBHXKQXXCMIAD-UHFFFAOYSA-N 1 1 321.827 3.962 20 10 DHCDMO Cc1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)cs1 ZINC000823387356 1030274000 /nfs/dbraw/zinc/27/40/00/1030274000.db2.gz YJGZSHMPCZVZPO-QGZVFWFLSA-N 1 1 317.454 3.943 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)ncc1F ZINC000823404914 1030281794 /nfs/dbraw/zinc/28/17/94/1030281794.db2.gz YOXLVYOPZDBPOT-UHFFFAOYSA-N 1 1 319.399 3.836 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cc(F)ncc1F ZINC000823404914 1030281803 /nfs/dbraw/zinc/28/18/03/1030281803.db2.gz YOXLVYOPZDBPOT-UHFFFAOYSA-N 1 1 319.399 3.836 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccc(Cl)cc1O ZINC000866530902 1030349806 /nfs/dbraw/zinc/34/98/06/1030349806.db2.gz NRWNOSHSOGBYAC-OLZOCXBDSA-N 1 1 309.837 3.903 20 10 DHCDMO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291157355 1030369558 /nfs/dbraw/zinc/36/95/58/1030369558.db2.gz CACLYOMXLGRDMD-IBGZPJMESA-N 1 1 319.408 3.703 20 10 DHCDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1OCC ZINC000121148163 1030399960 /nfs/dbraw/zinc/39/99/60/1030399960.db2.gz GGWOWYYGKXPDAW-UHFFFAOYSA-N 1 1 315.413 3.822 20 10 DHCDMO CC[C@H](c1ccc(C)cc1O)[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925755200 1030481920 /nfs/dbraw/zinc/48/19/20/1030481920.db2.gz UTRBQJZBEGONOZ-QGZVFWFLSA-N 1 1 312.413 3.629 20 10 DHCDMO Oc1cccc2c1C[N@H+]([C@@H]1CCc3c(Cl)cccc3C1)CC2 ZINC001171057125 1030569402 /nfs/dbraw/zinc/56/94/02/1030569402.db2.gz UTSXLAUCBQWLBB-OAHLLOKOSA-N 1 1 313.828 3.961 20 10 DHCDMO COc1c(O)c(C[NH2+][C@@H](C)CCC=C(C)C)ccc1[N+](=O)[O-] ZINC000824677916 1030611448 /nfs/dbraw/zinc/61/14/48/1030611448.db2.gz LACWIULZROMRPX-LBPRGKRZSA-N 1 1 308.378 3.534 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1C ZINC000824695934 1030614851 /nfs/dbraw/zinc/61/48/51/1030614851.db2.gz DXJZDXYLDFRYAP-KSZLIROESA-N 1 1 303.446 3.525 20 10 DHCDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccccc3O)C2)cc1 ZINC000824820858 1030647743 /nfs/dbraw/zinc/64/77/43/1030647743.db2.gz OWVWGNQPPTVXRT-OAHLLOKOSA-N 1 1 312.369 3.680 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)cc1 ZINC000825091066 1030725480 /nfs/dbraw/zinc/72/54/80/1030725480.db2.gz TWQYOCJUOHSYAJ-GOSISDBHSA-N 1 1 304.478 3.516 20 10 DHCDMO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(F)cc1O ZINC000248526592 1030734994 /nfs/dbraw/zinc/73/49/94/1030734994.db2.gz VAVJYOITHPVARW-WQFMGJDKSA-N 1 1 305.393 3.530 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)cc1F ZINC000825215434 1030747502 /nfs/dbraw/zinc/74/75/02/1030747502.db2.gz OWMWQCGKXWVYRK-KRWDZBQOSA-N 1 1 308.466 3.611 20 10 DHCDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825502127 1030827794 /nfs/dbraw/zinc/82/77/94/1030827794.db2.gz ULNRMMSRCXPATG-NSHDSACASA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1c(O)cccc1F ZINC000926918972 1030991972 /nfs/dbraw/zinc/99/19/72/1030991972.db2.gz KPPHJTPELFKICE-RYUDHWBXSA-N 1 1 301.361 3.706 20 10 DHCDMO C[C@@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1ccc(Cl)cc1O ZINC000926961262 1031019052 /nfs/dbraw/zinc/01/90/52/1031019052.db2.gz XUSUQPUKYPQRKA-RNCFNFMXSA-N 1 1 324.774 3.579 20 10 DHCDMO Cc1nc2c(cccc2CC[NH2+][C@H](C)c2c(O)cccc2F)o1 ZINC000926970376 1031022029 /nfs/dbraw/zinc/02/20/29/1031022029.db2.gz RDSPDTNBNVVZMU-LLVKDONJSA-N 1 1 314.360 3.874 20 10 DHCDMO CC[C@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(F)cc1O ZINC000927089798 1031081221 /nfs/dbraw/zinc/08/12/21/1031081221.db2.gz FRJLGHSBZPTQEO-INIZCTEOSA-N 1 1 301.361 3.707 20 10 DHCDMO C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(Cl)ccc1[O-] ZINC000844926408 1031404855 /nfs/dbraw/zinc/40/48/55/1031404855.db2.gz ZRXXUCOXVHWBMC-GFCCVEGCSA-N 1 1 304.821 3.616 20 10 DHCDMO CC1CC([N@H+](C)Cc2cc(Br)c(F)cc2O)C1 ZINC001144298417 1031437363 /nfs/dbraw/zinc/43/73/63/1031437363.db2.gz DCUUNXDPGLJSKS-UHFFFAOYSA-N 1 1 302.187 3.524 20 10 DHCDMO CC1CC([N@@H+](C)Cc2cc(Br)c(F)cc2O)C1 ZINC001144298417 1031437370 /nfs/dbraw/zinc/43/73/70/1031437370.db2.gz DCUUNXDPGLJSKS-UHFFFAOYSA-N 1 1 302.187 3.524 20 10 DHCDMO CC1CC([N@@H+](C)Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144298417 1031437355 /nfs/dbraw/zinc/43/73/55/1031437355.db2.gz DCUUNXDPGLJSKS-UHFFFAOYSA-N 1 1 302.187 3.524 20 10 DHCDMO C[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)[C@H](C)C1 ZINC001144306476 1031452149 /nfs/dbraw/zinc/45/21/49/1031452149.db2.gz DARJJORCHWHBQL-NXEZZACHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@H](C)C1 ZINC001144306476 1031452167 /nfs/dbraw/zinc/45/21/67/1031452167.db2.gz DARJJORCHWHBQL-NXEZZACHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306478 1031452846 /nfs/dbraw/zinc/45/28/46/1031452846.db2.gz DARJJORCHWHBQL-VHSXEESVSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144306478 1031452847 /nfs/dbraw/zinc/45/28/47/1031452847.db2.gz DARJJORCHWHBQL-VHSXEESVSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)[C@@H](C)C1 ZINC001144306477 1031453045 /nfs/dbraw/zinc/45/30/45/1031453045.db2.gz DARJJORCHWHBQL-UWVGGRQHSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@@H](C)C1 ZINC001144306477 1031453052 /nfs/dbraw/zinc/45/30/52/1031453052.db2.gz DARJJORCHWHBQL-UWVGGRQHSA-N 1 1 316.214 3.914 20 10 DHCDMO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCCCC3)cc2)c(C)nn1 ZINC000929185765 1031460132 /nfs/dbraw/zinc/46/01/32/1031460132.db2.gz YWXNKRNEJONYRI-UHFFFAOYSA-N 1 1 324.472 3.716 20 10 DHCDMO Oc1ccc(C[N@H+]2CCc3cccc(O)c3C2)c(C(F)(F)F)c1 ZINC001144391616 1031513992 /nfs/dbraw/zinc/51/39/92/1031513992.db2.gz RUAWUBMNGXUKJN-UHFFFAOYSA-N 1 1 323.314 3.675 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@H](O)c1ccccc1 ZINC000872134451 1031527999 /nfs/dbraw/zinc/52/79/99/1031527999.db2.gz WFWYLNNCBMDPDY-ULFGMLNVSA-N 1 1 303.377 3.694 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1O)[C@H](O)c1ccccc1 ZINC000872134449 1031528650 /nfs/dbraw/zinc/52/86/50/1031528650.db2.gz WFWYLNNCBMDPDY-PZPSRYQVSA-N 1 1 303.377 3.694 20 10 DHCDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000123991231 1031555446 /nfs/dbraw/zinc/55/54/46/1031555446.db2.gz IXIWVKMWRWYGJY-CYBMUJFWSA-N 1 1 302.393 3.790 20 10 DHCDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000872803883 1031665199 /nfs/dbraw/zinc/66/51/99/1031665199.db2.gz DTZPOGJFNBKTLE-OAHLLOKOSA-N 1 1 310.319 3.715 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H](c3ncc(C)s3)C2)c1 ZINC000361048228 1031695401 /nfs/dbraw/zinc/69/54/01/1031695401.db2.gz KODCJZTUPBZMLH-CYBMUJFWSA-N 1 1 318.442 3.545 20 10 DHCDMO CCC[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccccc1O ZINC000873205202 1031756742 /nfs/dbraw/zinc/75/67/42/1031756742.db2.gz KXHFLHXQHNWVIE-UHFFFAOYSA-N 1 1 316.470 3.512 20 10 DHCDMO C[N@H+](Cc1ncn2ccccc12)Cc1ccc(N2CCCC2)cc1 ZINC001144623158 1031771073 /nfs/dbraw/zinc/77/10/73/1031771073.db2.gz RJPYEOIVWDEFMC-UHFFFAOYSA-N 1 1 320.440 3.567 20 10 DHCDMO C[N@@H+](Cc1ncn2ccccc12)Cc1ccc(N2CCCC2)cc1 ZINC001144623158 1031771086 /nfs/dbraw/zinc/77/10/86/1031771086.db2.gz RJPYEOIVWDEFMC-UHFFFAOYSA-N 1 1 320.440 3.567 20 10 DHCDMO CN(Cc1[nH+]cn2ccccc12)Cc1ccc(N2CCCC2)cc1 ZINC001144623158 1031771099 /nfs/dbraw/zinc/77/10/99/1031771099.db2.gz RJPYEOIVWDEFMC-UHFFFAOYSA-N 1 1 320.440 3.567 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCCC2)o1)Cc1ccccc1O ZINC001137069925 1031781815 /nfs/dbraw/zinc/78/18/15/1031781815.db2.gz SFWBXCADJXIUMC-UHFFFAOYSA-N 1 1 300.402 3.608 20 10 DHCDMO CCCC[N@@H+](Cc1ccccc1O)[C@@H](C)c1snnc1C ZINC000930350966 1031789095 /nfs/dbraw/zinc/78/90/95/1031789095.db2.gz KWDIHLKHYDYDNY-ZDUSSCGKSA-N 1 1 305.447 3.915 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCCOC1 ZINC000846053606 1031844837 /nfs/dbraw/zinc/84/48/37/1031844837.db2.gz VCFUAKUBTVWMIY-LJQANCHMSA-N 1 1 302.462 3.678 20 10 DHCDMO COc1cccc([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1O ZINC000846144693 1031907759 /nfs/dbraw/zinc/90/77/59/1031907759.db2.gz JTRGJTZIERVCHU-GFCCVEGCSA-N 1 1 323.396 3.503 20 10 DHCDMO CC[C@H]([NH2+][C@@H](c1ccccc1F)[C@H](C)O)c1ccc(F)cc1O ZINC000846181886 1031913445 /nfs/dbraw/zinc/91/34/45/1031913445.db2.gz FOVZEUCZNWCNEG-SDDDUWNISA-N 1 1 321.367 3.833 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccc(F)cc1O ZINC000846188889 1031921452 /nfs/dbraw/zinc/92/14/52/1031921452.db2.gz QSJHFCPTSIASQC-WMZOPIPTSA-N 1 1 307.409 3.777 20 10 DHCDMO C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1cnn(CC2CCC2)c1 ZINC000898184701 1031985061 /nfs/dbraw/zinc/98/50/61/1031985061.db2.gz VPFCTIUTDOPGID-NSHDSACASA-N 1 1 321.371 3.518 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)CC(C)(C)C ZINC000877543863 1033346171 /nfs/dbraw/zinc/34/61/71/1033346171.db2.gz IPJDRMKESNYUNJ-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO CCCN(CCC)c1ccc(C[NH2+]Cc2cc(OC)no2)cc1 ZINC000877635128 1033391757 /nfs/dbraw/zinc/39/17/57/1033391757.db2.gz DCWDMAKFDDLIAN-UHFFFAOYSA-N 1 1 317.433 3.599 20 10 DHCDMO CCc1cccc(C[N@H+]2CC[C@@H](c3nc(C)cs3)C2)c1O ZINC000877814634 1033468037 /nfs/dbraw/zinc/46/80/37/1033468037.db2.gz VQZHTIZBBSLBNL-OAHLLOKOSA-N 1 1 302.443 3.709 20 10 DHCDMO C[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000927065247 1033481123 /nfs/dbraw/zinc/48/11/23/1033481123.db2.gz GCSOEXULYYXETL-BNLOLNQZSA-N 1 1 309.837 3.901 20 10 DHCDMO C[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCOC1)c1ccc(Cl)cc1O ZINC000927065250 1033481375 /nfs/dbraw/zinc/48/13/75/1033481375.db2.gz GCSOEXULYYXETL-XTQGRXLLSA-N 1 1 309.837 3.901 20 10 DHCDMO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]1CCCOC1 ZINC000151899688 1033489813 /nfs/dbraw/zinc/48/98/13/1033489813.db2.gz PJISMMQFTQWHRC-GOSISDBHSA-N 1 1 302.462 3.535 20 10 DHCDMO CCCOC1CCC([N@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001173101284 1033540955 /nfs/dbraw/zinc/54/09/55/1033540955.db2.gz LRUMUOWLQYNDAJ-UHFFFAOYSA-N 1 1 319.445 3.584 20 10 DHCDMO CSCC[C@H](C)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862246742 1033794725 /nfs/dbraw/zinc/79/47/25/1033794725.db2.gz BZRLLPAGWQFHHH-JTQLQIEISA-N 1 1 318.280 3.728 20 10 DHCDMO C[C@H](c1ccncc1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862323070 1033817735 /nfs/dbraw/zinc/81/77/35/1033817735.db2.gz RTHGGEBBOPLIOW-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1c(O)cccc1Br ZINC000862323070 1033817746 /nfs/dbraw/zinc/81/77/46/1033817746.db2.gz RTHGGEBBOPLIOW-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO COc1ccc(O)c(C[NH2+][C@H](CCc2ccccc2)C(F)F)c1 ZINC000862482469 1033867096 /nfs/dbraw/zinc/86/70/96/1033867096.db2.gz ISGANICBOPOMNM-MRXNPFEDSA-N 1 1 321.367 3.757 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1nnc(-c2cccs2)o1 ZINC000879652382 1034075614 /nfs/dbraw/zinc/07/56/14/1034075614.db2.gz ZSYMABIJUHPJDO-QWRGUYRKSA-N 1 1 315.398 3.916 20 10 DHCDMO CC(C)OCCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000119484460 1034112001 /nfs/dbraw/zinc/11/20/01/1034112001.db2.gz HPXAPQIWPHAEOB-UHFFFAOYSA-N 1 1 303.402 3.803 20 10 DHCDMO CC[N@@H+](Cc1cnn(C(C)C)c1)Cc1ccc(N(C)C)cc1 ZINC000179491314 1034312778 /nfs/dbraw/zinc/31/27/78/1034312778.db2.gz KFRVPQNBBAMJCG-UHFFFAOYSA-N 1 1 300.450 3.552 20 10 DHCDMO COc1cc(C)c(C[N@@H+](C)Cc2cc(C)ccc2O)cc1OC ZINC000120105578 1034383962 /nfs/dbraw/zinc/38/39/62/1034383962.db2.gz UZFPSGXSGPHRQJ-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000183679084 1034411111 /nfs/dbraw/zinc/41/11/11/1034411111.db2.gz JAULPZIXBVQXNG-LLVKDONJSA-N 1 1 321.218 3.743 20 10 DHCDMO CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000185112413 1034527790 /nfs/dbraw/zinc/52/77/90/1034527790.db2.gz LOOQDGHEZIVXNN-JKSUJKDBSA-N 1 1 312.457 3.928 20 10 DHCDMO CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000185112413 1034527798 /nfs/dbraw/zinc/52/77/98/1034527798.db2.gz LOOQDGHEZIVXNN-JKSUJKDBSA-N 1 1 312.457 3.928 20 10 DHCDMO CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000185112429 1034530285 /nfs/dbraw/zinc/53/02/85/1034530285.db2.gz LOOQDGHEZIVXNN-HOTGVXAUSA-N 1 1 312.457 3.928 20 10 DHCDMO CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])C1 ZINC000185112429 1034530292 /nfs/dbraw/zinc/53/02/92/1034530292.db2.gz LOOQDGHEZIVXNN-HOTGVXAUSA-N 1 1 312.457 3.928 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccc(F)cc1O ZINC000185232390 1034536003 /nfs/dbraw/zinc/53/60/03/1034536003.db2.gz ZAKLXSSSHMULOE-NSHDSACASA-N 1 1 306.356 3.587 20 10 DHCDMO CCOc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2O)cc1F ZINC000185382998 1034545461 /nfs/dbraw/zinc/54/54/61/1034545461.db2.gz SFLHOUWKKGVXMJ-LLVKDONJSA-N 1 1 307.340 3.920 20 10 DHCDMO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCN(C3CCCC3)CC2)c1 ZINC000185648891 1034562550 /nfs/dbraw/zinc/56/25/50/1034562550.db2.gz LKULHSMGRKBENO-OAHLLOKOSA-N 1 1 302.462 3.758 20 10 DHCDMO C[C@@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccc(F)cc1O ZINC000186159377 1034604417 /nfs/dbraw/zinc/60/44/17/1034604417.db2.gz WDEDUJARXHCCPT-FZKQIMNGSA-N 1 1 315.388 3.696 20 10 DHCDMO C[N@@H+](Cc1ccc2c(c1)COC(C)(C)O2)Cc1ccccc1O ZINC000186284804 1034616818 /nfs/dbraw/zinc/61/68/18/1034616818.db2.gz XMBZCQGGOKZXGK-UHFFFAOYSA-N 1 1 313.397 3.669 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc(OC(C)(C)C)nc1)c1ccc(F)cc1O ZINC000186507547 1034637864 /nfs/dbraw/zinc/63/78/64/1034637864.db2.gz QVBYGQWESSMMMP-LBPRGKRZSA-N 1 1 318.392 3.954 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccccc1O ZINC000186829423 1034663086 /nfs/dbraw/zinc/66/30/86/1034663086.db2.gz UIDYQAFHMKGMMS-GFCCVEGCSA-N 1 1 304.390 3.546 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193071728 1034830114 /nfs/dbraw/zinc/83/01/14/1034830114.db2.gz NJJILHPMGIPEPN-ZJUUUORDSA-N 1 1 304.217 3.919 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCOCC1)c1cc(Cl)c(Cl)cc1O ZINC000193071699 1034830330 /nfs/dbraw/zinc/83/03/30/1034830330.db2.gz NJJILHPMGIPEPN-NXEZZACHSA-N 1 1 304.217 3.919 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CC[C@H](O)C1)c1cc(Cl)c(Cl)cc1O ZINC000193348932 1034841859 /nfs/dbraw/zinc/84/18/59/1034841859.db2.gz OSGNWHIEIXSHPE-GUBZILKMSA-N 1 1 304.217 3.511 20 10 DHCDMO COc1ccc(C(=O)c2ccccc2NC2=CCC[N@H+](C)C2)cc1 ZINC001175578099 1035051014 /nfs/dbraw/zinc/05/10/14/1035051014.db2.gz HNSZALGDSWINOA-UHFFFAOYSA-N 1 1 322.408 3.558 20 10 DHCDMO COc1ccc(C(=O)c2ccccc2NC2=CCC[N@@H+](C)C2)cc1 ZINC001175578099 1035051021 /nfs/dbraw/zinc/05/10/21/1035051021.db2.gz HNSZALGDSWINOA-UHFFFAOYSA-N 1 1 322.408 3.558 20 10 DHCDMO Cc1ccccc1[C@H](CO)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC001176176045 1035212638 /nfs/dbraw/zinc/21/26/38/1035212638.db2.gz OPFBXWOWTXRQJQ-FQEVSTJZSA-N 1 1 312.457 3.535 20 10 DHCDMO CCCOc1ccc(CN[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1C ZINC001177476189 1035371867 /nfs/dbraw/zinc/37/18/67/1035371867.db2.gz YXAQIHRHEYPHBL-AEFFLSMTSA-N 1 1 318.505 3.994 20 10 DHCDMO CCCOc1ccc(CN[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1C ZINC001177476189 1035371872 /nfs/dbraw/zinc/37/18/72/1035371872.db2.gz YXAQIHRHEYPHBL-AEFFLSMTSA-N 1 1 318.505 3.994 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000195134676 1035415015 /nfs/dbraw/zinc/41/50/15/1035415015.db2.gz XPGHJKOOTMZXDK-FUHWJXTLSA-N 1 1 310.441 3.565 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H]2c2cn(C)nc2C)cc1 ZINC000773766727 1035442603 /nfs/dbraw/zinc/44/26/03/1035442603.db2.gz UXHKTCCFZNNQKD-IBGZPJMESA-N 1 1 312.461 3.522 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000773766606 1035442816 /nfs/dbraw/zinc/44/28/16/1035442816.db2.gz UBIIFMBNWVQOPB-KRWDZBQOSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000773766606 1035442813 /nfs/dbraw/zinc/44/28/13/1035442813.db2.gz UBIIFMBNWVQOPB-KRWDZBQOSA-N 1 1 316.470 3.778 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)cc1 ZINC000773837049 1035520262 /nfs/dbraw/zinc/52/02/62/1035520262.db2.gz XXNANYVLFXIWCJ-LJQANCHMSA-N 1 1 302.462 3.534 20 10 DHCDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(C)cc1O ZINC001179862757 1035521385 /nfs/dbraw/zinc/52/13/85/1035521385.db2.gz COROHNCETTYHJJ-UHFFFAOYSA-N 1 1 305.805 3.995 20 10 DHCDMO CO[C@]1(C)C[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958401 1035561770 /nfs/dbraw/zinc/56/17/70/1035561770.db2.gz ZNGPGHSFFAXTKP-GOEBONIOSA-N 1 1 315.816 3.820 20 10 DHCDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C1(C)C ZINC001179958401 1035561789 /nfs/dbraw/zinc/56/17/89/1035561789.db2.gz ZNGPGHSFFAXTKP-GOEBONIOSA-N 1 1 315.816 3.820 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c1 ZINC001179965892 1035562265 /nfs/dbraw/zinc/56/22/65/1035562265.db2.gz BYSHJKRWPUMKIZ-MRXNPFEDSA-N 1 1 313.445 3.629 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@H]2CCC(C)(C)O2)C2CC2)cc1 ZINC000775572908 1035571031 /nfs/dbraw/zinc/57/10/31/1035571031.db2.gz UXVFTQGEWKKSQN-GOSISDBHSA-N 1 1 302.462 3.675 20 10 DHCDMO COc1cc(C)c(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001180077782 1035587351 /nfs/dbraw/zinc/58/73/51/1035587351.db2.gz VJAISQNBKQOBMC-KRWDZBQOSA-N 1 1 311.425 3.774 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@@H+](CCCO)Cc2ccccc2)cc1 ZINC001180185184 1035608060 /nfs/dbraw/zinc/60/80/60/1035608060.db2.gz XSWXMOJUVSOHJD-POHAHGRESA-N 1 1 324.468 3.650 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](C)C[C@H](C)c2nccs2)cc1 ZINC000773842114 1035624919 /nfs/dbraw/zinc/62/49/19/1035624919.db2.gz UWLUSEOLEKJJMS-AWEZNQCLSA-N 1 1 303.475 3.835 20 10 DHCDMO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001180359947 1035655050 /nfs/dbraw/zinc/65/50/50/1035655050.db2.gz ZFCFBQARCLSLGW-PKOBYXMFSA-N 1 1 316.489 3.781 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)o1 ZINC001180480090 1035682034 /nfs/dbraw/zinc/68/20/34/1035682034.db2.gz WSRABNDIKXPLBX-UHFFFAOYSA-N 1 1 302.418 3.766 20 10 DHCDMO CNc1ccccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC001180558913 1035718503 /nfs/dbraw/zinc/71/85/03/1035718503.db2.gz ZNXIDWBAUBSLIB-UHFFFAOYSA-N 1 1 309.457 3.959 20 10 DHCDMO CC(C)c1ccc(O)c(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c1 ZINC001182109122 1036097264 /nfs/dbraw/zinc/09/72/64/1036097264.db2.gz JDNZUQFWVCNVLM-LJQANCHMSA-N 1 1 313.441 3.551 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCCO1)c1cc(Cl)c(Cl)cc1O ZINC000774148873 1036196690 /nfs/dbraw/zinc/19/66/90/1036196690.db2.gz UHSVCXVULWIVLF-VHSXEESVSA-N 1 1 304.217 3.919 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCN(C2CC2)C1)c1cc(Cl)c(Cl)cc1O ZINC000774168267 1036209973 /nfs/dbraw/zinc/20/99/73/1036209973.db2.gz ZOKAZCUQMFGYHC-UWVGGRQHSA-N 1 1 315.244 3.586 20 10 DHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)Cc1cccc2nccn21 ZINC000775650915 1036227019 /nfs/dbraw/zinc/22/70/19/1036227019.db2.gz HSWQIWFIEVQSFV-UHFFFAOYSA-N 1 1 322.456 3.811 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H]2CCc2ccccc2)c1 ZINC000775652947 1036244557 /nfs/dbraw/zinc/24/45/57/1036244557.db2.gz WPNQEDDSQXVXLP-SFHVURJKSA-N 1 1 311.425 3.998 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cc(Cl)c(Cl)cc1O ZINC000774266925 1036265963 /nfs/dbraw/zinc/26/59/63/1036265963.db2.gz SKJDMZFGFXVMSL-JGVFFNPUSA-N 1 1 300.189 3.834 20 10 DHCDMO C[C@@H]([NH2+]CCOC1CCC1)c1cc(Cl)c(Cl)cc1O ZINC000774300566 1036276292 /nfs/dbraw/zinc/27/62/92/1036276292.db2.gz MYGVGYQQMRZDBO-SECBINFHSA-N 1 1 304.217 3.919 20 10 DHCDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cccc(C)c1O ZINC000775665548 1036294062 /nfs/dbraw/zinc/29/40/62/1036294062.db2.gz FZANJDZFZJWRSG-GOSISDBHSA-N 1 1 311.425 3.916 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1O)c1cc(Cl)c(Cl)cc1O ZINC000774372293 1036303765 /nfs/dbraw/zinc/30/37/65/1036303765.db2.gz XMJAHRBYHJXNDL-JCOFBHIZSA-N 1 1 304.217 3.653 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c1O ZINC000775669106 1036321461 /nfs/dbraw/zinc/32/14/61/1036321461.db2.gz FIIGROWJQVICEZ-UYAOXDASSA-N 1 1 311.425 3.789 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2c1c(F)ccc2[O-] ZINC000774497378 1036361232 /nfs/dbraw/zinc/36/12/32/1036361232.db2.gz OFTLJKNLRNCVMS-BLLLJJGKSA-N 1 1 318.436 3.544 20 10 DHCDMO Cc1cccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1O ZINC000775678730 1036409843 /nfs/dbraw/zinc/40/98/43/1036409843.db2.gz JCMDBENDIZPCST-SFHVURJKSA-N 1 1 316.489 3.789 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c1O ZINC000775717002 1036535749 /nfs/dbraw/zinc/53/57/49/1036535749.db2.gz LBJURYQRKNPXIJ-QGZVFWFLSA-N 1 1 309.837 3.747 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC001183239328 1036553675 /nfs/dbraw/zinc/55/36/75/1036553675.db2.gz VKWIGSXKLURYMZ-UHFFFAOYSA-N 1 1 324.396 3.582 20 10 DHCDMO COc1cc(O)c(C[N@H+]2CCCC23CCCCC3)cc1OC ZINC000775726424 1036567750 /nfs/dbraw/zinc/56/77/50/1036567750.db2.gz UMNDKISELRUAHF-UHFFFAOYSA-N 1 1 305.418 3.708 20 10 DHCDMO Oc1cc(F)c(F)cc1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001184106518 1036740620 /nfs/dbraw/zinc/74/06/20/1036740620.db2.gz RVGJHFBZUVVILC-OAHLLOKOSA-N 1 1 303.352 3.708 20 10 DHCDMO CCc1ccc2c(c1)C[N@H+](Cc1c(C)cc(OC)cc1O)CC2 ZINC001184417369 1036841383 /nfs/dbraw/zinc/84/13/83/1036841383.db2.gz CBGJXEIANIYHDP-UHFFFAOYSA-N 1 1 311.425 3.830 20 10 DHCDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000776013174 1037298550 /nfs/dbraw/zinc/29/85/50/1037298550.db2.gz LAINGGNPSGNZGW-DOMZBBRYSA-N 1 1 300.368 3.915 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCOCC3(CCCC3)C2)c1O ZINC000776008587 1037306298 /nfs/dbraw/zinc/30/62/98/1037306298.db2.gz MUWRKORTOGCBFC-UHFFFAOYSA-N 1 1 309.837 3.747 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c(O)c1 ZINC000776011839 1037307774 /nfs/dbraw/zinc/30/77/74/1037307774.db2.gz BQKUTLYUACEXBR-RISCZKNCSA-N 1 1 317.351 3.954 20 10 DHCDMO COc1c(O)c(C[NH2+][C@H]2CCCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775025124 1037427404 /nfs/dbraw/zinc/42/74/04/1037427404.db2.gz BZOSKJMTLPBWSV-KGLIPLIRSA-N 1 1 322.405 3.613 20 10 DHCDMO CCC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775028989 1037436375 /nfs/dbraw/zinc/43/63/75/1037436375.db2.gz JHWCYLOVINXQFS-GXTWGEPZSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1c(O)c(C[NH+]2CC(C)(C)CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000775071901 1037550855 /nfs/dbraw/zinc/55/08/55/1037550855.db2.gz RJYAZSMNAABYJI-UHFFFAOYSA-N 1 1 322.405 3.567 20 10 DHCDMO COc1ccc2c(c1)c1c(n2C)CC[N@H+](CCc2ccccc2)C1 ZINC001201603775 1037806672 /nfs/dbraw/zinc/80/66/72/1037806672.db2.gz RIORNIUYDOVZPS-UHFFFAOYSA-N 1 1 320.436 3.788 20 10 DHCDMO COc1cc(C)cc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c1O ZINC000164519511 1038204555 /nfs/dbraw/zinc/20/45/55/1038204555.db2.gz NNGGTWXODICKPM-KRWDZBQOSA-N 1 1 312.413 3.750 20 10 DHCDMO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCC[C@H]1O ZINC001190436888 1038315876 /nfs/dbraw/zinc/31/58/76/1038315876.db2.gz NIQOAEUWZRVWCP-PKOBYXMFSA-N 1 1 304.478 3.514 20 10 DHCDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC001191908509 1038560652 /nfs/dbraw/zinc/56/06/52/1038560652.db2.gz CAVOVQBBAICMGV-FQEVSTJZSA-N 1 1 316.489 3.924 20 10 DHCDMO C[C@@H](Nc1cc[nH+]cc1Br)c1ccc(N(C)C)cc1 ZINC000775540476 1038690157 /nfs/dbraw/zinc/69/01/57/1038690157.db2.gz MGCOWHRDTLJENT-LLVKDONJSA-N 1 1 320.234 3.505 20 10 DHCDMO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000170789459 1038965428 /nfs/dbraw/zinc/96/54/28/1038965428.db2.gz LMKJLRWJZBWQHU-CHWSQXEVSA-N 1 1 303.377 3.909 20 10 DHCDMO CC[N@H+](C)C[C@@H]1CCN(Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489697 1040308901 /nfs/dbraw/zinc/30/89/01/1040308901.db2.gz ICGHEBOFQPNRSB-INIZCTEOSA-N 1 1 318.505 3.772 20 10 DHCDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489697 1040308919 /nfs/dbraw/zinc/30/89/19/1040308919.db2.gz ICGHEBOFQPNRSB-INIZCTEOSA-N 1 1 318.505 3.772 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000091891420 193123698 /nfs/dbraw/zinc/12/36/98/193123698.db2.gz UOMRTWQXMMFPHH-WBVHZDCISA-N 1 1 317.454 3.850 20 10 DHCDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000092223781 193176739 /nfs/dbraw/zinc/17/67/39/193176739.db2.gz PYFDGRWIGYGCLD-QGZVFWFLSA-N 1 1 316.376 3.712 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)c1O ZINC000093275462 193224026 /nfs/dbraw/zinc/22/40/26/193224026.db2.gz HLMUOKKSPWRYDT-NSHDSACASA-N 1 1 306.431 3.667 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccc(F)cc1O ZINC000273347958 130110208 /nfs/dbraw/zinc/11/02/08/130110208.db2.gz BCRLCEOJUVJQRR-GFCCVEGCSA-N 1 1 317.360 3.543 20 10 DHCDMO Cc1cccc2oc(CC[NH2+][C@@H](C)c3ccc(F)cc3O)nc21 ZINC000273599563 130141792 /nfs/dbraw/zinc/14/17/92/130141792.db2.gz ROVHMMHMACAVAO-LBPRGKRZSA-N 1 1 314.360 3.874 20 10 DHCDMO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(N(C)C)cc1 ZINC000274226798 130219955 /nfs/dbraw/zinc/21/99/55/130219955.db2.gz OXESCFHYWKBOGW-ABAIWWIYSA-N 1 1 304.463 3.714 20 10 DHCDMO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(N(C)C)cc1 ZINC000274226812 130220133 /nfs/dbraw/zinc/22/01/33/130220133.db2.gz OXESCFHYWKBOGW-XHDPSFHLSA-N 1 1 304.463 3.714 20 10 DHCDMO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc(F)cc1O)CCO2 ZINC000274359294 130228466 /nfs/dbraw/zinc/22/84/66/130228466.db2.gz IAGJGQDODYDHAC-BZNIZROVSA-N 1 1 317.360 3.714 20 10 DHCDMO CCc1nn(C)c(CC)c1C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000285942518 131211043 /nfs/dbraw/zinc/21/10/43/131211043.db2.gz DNAOTEOGAJAWTO-HNNXBMFYSA-N 1 1 319.424 3.631 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1ccc(F)cc1O ZINC000286220639 131224839 /nfs/dbraw/zinc/22/48/39/131224839.db2.gz SHYJBNYAJZLTLJ-YALNPMBYSA-N 1 1 305.393 3.530 20 10 DHCDMO CC[C@H]([NH2+]Cc1cn2c(cccc2C)n1)c1ccc(F)cc1O ZINC000286273078 131227247 /nfs/dbraw/zinc/22/72/47/131227247.db2.gz VLUZVNAGRDUBEE-INIZCTEOSA-N 1 1 313.376 3.728 20 10 DHCDMO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(F)cc1O ZINC000286327557 131230519 /nfs/dbraw/zinc/23/05/19/131230519.db2.gz YGIVMCRBQFFDJF-ZUZCIYMTSA-N 1 1 306.381 3.981 20 10 DHCDMO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1nccn1-c1ccccc1 ZINC000287210686 131269317 /nfs/dbraw/zinc/26/93/17/131269317.db2.gz MKCFYTVUGXWWBY-HNNXBMFYSA-N 1 1 319.408 3.658 20 10 DHCDMO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2csc(COC)n2)cc1 ZINC000289587572 131398622 /nfs/dbraw/zinc/39/86/22/131398622.db2.gz BUXCFRITIHTQRB-CYBMUJFWSA-N 1 1 319.474 3.596 20 10 DHCDMO OCCC[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000293671555 335114769 /nfs/dbraw/zinc/11/47/69/335114769.db2.gz QPAIDYBVVIPZPS-INIZCTEOSA-N 1 1 323.795 3.788 20 10 DHCDMO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cs1 ZINC000273460897 334047226 /nfs/dbraw/zinc/04/72/26/334047226.db2.gz CQDIWLMCQHGBMN-VHSXEESVSA-N 1 1 310.394 3.546 20 10 DHCDMO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)[nH]1 ZINC000277405175 334088204 /nfs/dbraw/zinc/08/82/04/334088204.db2.gz ZDZLYPVFKYSHNM-ONGXEEELSA-N 1 1 322.840 3.836 20 10 DHCDMO CC[C@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccc(F)cc1O ZINC000286207566 334151745 /nfs/dbraw/zinc/15/17/45/334151745.db2.gz RWPTZLULYMKNFJ-QFYYESIMSA-N 1 1 306.381 3.808 20 10 DHCDMO CC[C@@H]([NH2+]C[C@@](C)(O)c1ccsc1)c1ccc(F)cc1O ZINC000286244403 334152115 /nfs/dbraw/zinc/15/21/15/334152115.db2.gz UCTZUHMYANZRCD-GDBMZVCRSA-N 1 1 309.406 3.541 20 10 DHCDMO COCCCCc1ccc[nH+]c1NCc1cccc(F)c1O ZINC000291108981 334176634 /nfs/dbraw/zinc/17/66/34/334176634.db2.gz SMRHJCSSAAREDY-UHFFFAOYSA-N 1 1 304.365 3.508 20 10 DHCDMO Clc1c[nH+]ccc1N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000350285756 335742585 /nfs/dbraw/zinc/74/25/85/335742585.db2.gz ILFAYJLRKDJTME-UHFFFAOYSA-N 1 1 310.788 3.905 20 10 DHCDMO COc1cccc(CNc2c(C)c[nH+]c3c(OC)cccc23)c1O ZINC000302672808 336364243 /nfs/dbraw/zinc/36/42/43/336364243.db2.gz SDYACMXXMLNOOG-UHFFFAOYSA-N 1 1 324.380 3.878 20 10 DHCDMO Brc1c[nH+]ccc1N1CC=C(c2cccnc2)CC1 ZINC000373842355 336974337 /nfs/dbraw/zinc/97/43/37/336974337.db2.gz AYLMJZWZXBULKP-UHFFFAOYSA-N 1 1 316.202 3.533 20 10 DHCDMO O=C(c1cccs1)C1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000374882498 336998803 /nfs/dbraw/zinc/99/88/03/336998803.db2.gz QJHBEDANTLNFRT-UHFFFAOYSA-N 1 1 319.401 3.688 20 10 DHCDMO Cc1c([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)c2O)cnn1C ZINC000378446478 337072914 /nfs/dbraw/zinc/07/29/14/337072914.db2.gz YXVYRYVFVYJQTP-INIZCTEOSA-N 1 1 319.836 3.733 20 10 DHCDMO COc1cccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c1O ZINC000360078042 337085159 /nfs/dbraw/zinc/08/51/59/337085159.db2.gz FVFAENXZIHATOS-QGZVFWFLSA-N 1 1 315.438 3.691 20 10 DHCDMO C[N@@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1ccccc1O ZINC000177676300 337158408 /nfs/dbraw/zinc/15/84/08/337158408.db2.gz HCPKFJBGNKLTEB-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)c1 ZINC000189939068 521142208 /nfs/dbraw/zinc/14/22/08/521142208.db2.gz PCABWHQFVFTGBI-MRXNPFEDSA-N 1 1 318.442 3.893 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c1 ZINC000189939068 521142215 /nfs/dbraw/zinc/14/22/15/521142215.db2.gz PCABWHQFVFTGBI-MRXNPFEDSA-N 1 1 318.442 3.893 20 10 DHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1O ZINC000180695801 524398051 /nfs/dbraw/zinc/39/80/51/524398051.db2.gz SDUUSYYHSNGAAM-HOTGVXAUSA-N 1 1 317.454 3.850 20 10 DHCDMO Cc1ccc(O)c(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000191595534 525351212 /nfs/dbraw/zinc/35/12/12/525351212.db2.gz MXLGBPWXHXVPBQ-AWEZNQCLSA-N 1 1 323.396 3.525 20 10 DHCDMO Cc1csc(C2([NH2+]Cc3ccc(N(C)C)c(F)c3)CCC2)n1 ZINC000264947772 526326222 /nfs/dbraw/zinc/32/62/22/526326222.db2.gz JLXOFNOIEZZKCR-UHFFFAOYSA-N 1 1 319.449 3.826 20 10 DHCDMO Oc1ccccc1C[N@H+](Cc1csnn1)C1CCCCC1 ZINC000156782048 526372394 /nfs/dbraw/zinc/37/23/94/526372394.db2.gz VYYNNNNMHUCRQG-UHFFFAOYSA-N 1 1 303.431 3.579 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1csnn1)C1CCCCC1 ZINC000156782048 526372395 /nfs/dbraw/zinc/37/23/95/526372395.db2.gz VYYNNNNMHUCRQG-UHFFFAOYSA-N 1 1 303.431 3.579 20 10 DHCDMO CC[C@@H]([NH2+]C1CC[NH+](C)CC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287271563 535802779 /nfs/dbraw/zinc/80/27/79/535802779.db2.gz AXTGNWMDNPGFBC-CQSZACIVSA-N 1 1 317.260 3.834 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2[O-])o1 ZINC000894474724 1013382290 /nfs/dbraw/zinc/38/22/90/1013382290.db2.gz DZZCZIVRVZJTNF-HNNXBMFYSA-N 1 1 323.339 3.747 20 10 DHCDMO Cc1cnc(CC[N@H+](C)Cc2cc3c(cc2O)CCCC3)s1 ZINC000160495689 1014127974 /nfs/dbraw/zinc/12/79/74/1014127974.db2.gz GQARFUNVPWNXQM-UHFFFAOYSA-N 1 1 316.470 3.710 20 10 DHCDMO Cc1noc(C)c1C[N@@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000046478226 1014440258 /nfs/dbraw/zinc/44/02/58/1014440258.db2.gz DGKNFERPIYZYBG-UHFFFAOYSA-N 1 1 318.417 3.632 20 10 DHCDMO Cc1noc(C)c1C[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000046478226 1014440265 /nfs/dbraw/zinc/44/02/65/1014440265.db2.gz DGKNFERPIYZYBG-UHFFFAOYSA-N 1 1 318.417 3.632 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cc1 ZINC000121281501 1014984768 /nfs/dbraw/zinc/98/47/68/1014984768.db2.gz PTNZHDNHHPNLOE-QGZVFWFLSA-N 1 1 312.461 3.636 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000121281501 1014984773 /nfs/dbraw/zinc/98/47/73/1014984773.db2.gz PTNZHDNHHPNLOE-QGZVFWFLSA-N 1 1 312.461 3.636 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000121281501 1014984781 /nfs/dbraw/zinc/98/47/81/1014984781.db2.gz PTNZHDNHHPNLOE-QGZVFWFLSA-N 1 1 312.461 3.636 20 10 DHCDMO [O-]c1c(F)cc(F)cc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000895455314 1015168950 /nfs/dbraw/zinc/16/89/50/1015168950.db2.gz VIMKMSALVJMLKJ-OAHLLOKOSA-N 1 1 311.372 3.594 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000895455314 1015168953 /nfs/dbraw/zinc/16/89/53/1015168953.db2.gz VIMKMSALVJMLKJ-OAHLLOKOSA-N 1 1 311.372 3.594 20 10 DHCDMO Oc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000895455314 1015168956 /nfs/dbraw/zinc/16/89/56/1015168956.db2.gz VIMKMSALVJMLKJ-OAHLLOKOSA-N 1 1 311.372 3.594 20 10 DHCDMO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895584949 1015211328 /nfs/dbraw/zinc/21/13/28/1015211328.db2.gz VZRKZDLZIAXIKL-HNNXBMFYSA-N 1 1 301.459 3.507 20 10 DHCDMO CN(C)c1ccc(/C=C/C[N@H+]2CC[C@@H](c3nccs3)C2)cc1 ZINC000895580523 1015216598 /nfs/dbraw/zinc/21/65/98/1015216598.db2.gz BLOKHZOLUPQEBV-QDLOVBKTSA-N 1 1 313.470 3.712 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895846534 1015332090 /nfs/dbraw/zinc/33/20/90/1015332090.db2.gz PWGMHKZRQGFHDH-ICSRJNTNSA-N 1 1 314.473 3.678 20 10 DHCDMO CCC[N@@H+](Cc1cn2ccnc2s1)Cc1ccccc1O ZINC000891853343 1015685147 /nfs/dbraw/zinc/68/51/47/1015685147.db2.gz JLRYKEGQSWPVST-UHFFFAOYSA-N 1 1 301.415 3.514 20 10 DHCDMO Cc1cc(C[N@H+]2CCC=C(c3ccccn3)C2)ccc1N(C)C ZINC000846923613 1032138350 /nfs/dbraw/zinc/13/83/50/1032138350.db2.gz RHVUKSKLFXUCFN-UHFFFAOYSA-N 1 1 307.441 3.745 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087643 1016324827 /nfs/dbraw/zinc/32/48/27/1016324827.db2.gz KRVCDDOOMYTJJU-QZTJIDSGSA-N 1 1 315.505 3.669 20 10 DHCDMO C[C@@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1ccc(F)cc1O ZINC000184834915 1016390003 /nfs/dbraw/zinc/39/00/03/1016390003.db2.gz CADGJCCHSCHTBU-PXAZEXFGSA-N 1 1 320.383 3.624 20 10 DHCDMO Cn1nccc1[C@@H]1CCCCN1Cc1cccc(Cl)c1[O-] ZINC000281223236 1016403862 /nfs/dbraw/zinc/40/38/62/1016403862.db2.gz KLQKCTHNPRECFY-HNNXBMFYSA-N 1 1 305.809 3.506 20 10 DHCDMO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000185457145 1016935360 /nfs/dbraw/zinc/93/53/60/1016935360.db2.gz JUIRPHPCWBHHFZ-ZBFHGGJFSA-N 1 1 314.404 3.851 20 10 DHCDMO C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1O ZINC000185457110 1016935726 /nfs/dbraw/zinc/93/57/26/1016935726.db2.gz JUIRPHPCWBHHFZ-GDBMZVCRSA-N 1 1 314.404 3.851 20 10 DHCDMO C[N@@H+](Cc1c[nH]nc1-c1ccc(F)cc1)Cc1ccccc1O ZINC000091974435 1032465407 /nfs/dbraw/zinc/46/54/07/1032465407.db2.gz NUKVZCAFTMTJNF-UHFFFAOYSA-N 1 1 311.360 3.553 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000093505174 1032543127 /nfs/dbraw/zinc/54/31/27/1032543127.db2.gz GDUHADOYZBSRBI-UYAOXDASSA-N 1 1 314.473 3.678 20 10 DHCDMO c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000093505176 1032543381 /nfs/dbraw/zinc/54/33/81/1032543381.db2.gz GDUHADOYZBSRBI-QUCCMNQESA-N 1 1 314.473 3.678 20 10 DHCDMO CC(C)C[N@@H+]1CCC[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074821 1032548564 /nfs/dbraw/zinc/54/85/64/1032548564.db2.gz HZEDNPLVTICRFU-ZWKOTPCHSA-N 1 1 317.521 3.771 20 10 DHCDMO CC(C)C[N@H+]1CCC[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074821 1032548567 /nfs/dbraw/zinc/54/85/67/1032548567.db2.gz HZEDNPLVTICRFU-ZWKOTPCHSA-N 1 1 317.521 3.771 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](OC)C[C@H]2C)cc1F ZINC000799736359 1012490700 /nfs/dbraw/zinc/49/07/00/1012490700.db2.gz OZELKHKMNBIDPZ-GDBMZVCRSA-N 1 1 308.441 3.671 20 10 DHCDMO CCn1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)n1 ZINC000840836763 1017131284 /nfs/dbraw/zinc/13/12/84/1017131284.db2.gz FGWTVRTUNIYKIA-MRXNPFEDSA-N 1 1 312.461 3.744 20 10 DHCDMO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(F)cc1O ZINC000185743315 1017136694 /nfs/dbraw/zinc/13/66/94/1017136694.db2.gz PCVPCEIWIMBCCT-BDJLRTHQSA-N 1 1 301.361 3.878 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n[nH]1 ZINC000186131272 1017875678 /nfs/dbraw/zinc/87/56/78/1017875678.db2.gz XZFFJDCSJUVHCI-GXTWGEPZSA-N 1 1 313.445 3.584 20 10 DHCDMO CCCN1CCC([NH2+][C@H](C)c2ccc(N(C)CC)cc2)CC1 ZINC000161601389 1018216651 /nfs/dbraw/zinc/21/66/51/1018216651.db2.gz HDGDTZIIPRHGCI-MRXNPFEDSA-N 1 1 303.494 3.668 20 10 DHCDMO CC[C@@H]([NH2+]CCCN1CCCCC1)c1ccc(N(C)C)cc1 ZINC000764663346 1018342853 /nfs/dbraw/zinc/34/28/53/1018342853.db2.gz VRIZXEOQJKZVGM-LJQANCHMSA-N 1 1 303.494 3.669 20 10 DHCDMO C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1c([O-])cccc1Cl ZINC000113322553 1018389022 /nfs/dbraw/zinc/38/90/22/1018389022.db2.gz LVHIVVHEQAVLCH-CQSZACIVSA-N 1 1 310.869 3.790 20 10 DHCDMO C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1c([O-])cccc1Cl ZINC000113322553 1018389033 /nfs/dbraw/zinc/38/90/33/1018389033.db2.gz LVHIVVHEQAVLCH-CQSZACIVSA-N 1 1 310.869 3.790 20 10 DHCDMO CC[C@@H]([NH2+]CCCCCC[NH3+])c1ccc(C(F)(F)F)cc1[O-] ZINC000843341195 1018465990 /nfs/dbraw/zinc/46/59/90/1018465990.db2.gz HHVMQLVEYNTHJT-CQSZACIVSA-N 1 1 318.383 3.971 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CCCOC1)c1cc(Cl)c(Cl)cc1O ZINC000278347335 1018596422 /nfs/dbraw/zinc/59/64/22/1018596422.db2.gz YPMLDMGKNHNRPJ-VHSXEESVSA-N 1 1 304.217 3.776 20 10 DHCDMO Oc1cccc(F)c1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001137837413 1018649933 /nfs/dbraw/zinc/64/99/33/1018649933.db2.gz FZWVIXYAKHFKTC-INIZCTEOSA-N 1 1 303.402 3.821 20 10 DHCDMO Oc1cccc(F)c1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001137837413 1018649938 /nfs/dbraw/zinc/64/99/38/1018649938.db2.gz FZWVIXYAKHFKTC-INIZCTEOSA-N 1 1 303.402 3.821 20 10 DHCDMO COc1ccc(CNc2ccc3c(c2)[nH+]cn3C)cc1OC1CC1 ZINC000858152046 1032783770 /nfs/dbraw/zinc/78/37/70/1032783770.db2.gz AXXZECOHAHHYAC-UHFFFAOYSA-N 1 1 323.396 3.735 20 10 DHCDMO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765303381 1018750086 /nfs/dbraw/zinc/75/00/86/1018750086.db2.gz ZZTICWCCMSQGKH-IKGGRYGDSA-N 1 1 303.494 3.524 20 10 DHCDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000765303381 1018750097 /nfs/dbraw/zinc/75/00/97/1018750097.db2.gz ZZTICWCCMSQGKH-IKGGRYGDSA-N 1 1 303.494 3.524 20 10 DHCDMO Cc1cccc2c1CC[C@H]([N@H+]1CCCc3cc(O)c(O)cc3C1)C2 ZINC001171572246 1032788566 /nfs/dbraw/zinc/78/85/66/1032788566.db2.gz BIMCLTVMALGUKZ-SFHVURJKSA-N 1 1 323.436 3.712 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCC[C@H]1CCO)c1cc(Cl)c(Cl)cc1O ZINC000278725749 1019095991 /nfs/dbraw/zinc/09/59/91/1019095991.db2.gz MMKCVQRVSCUGSF-BHDSKKPTSA-N 1 1 318.244 3.901 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCCO2 ZINC000170789223 1019434504 /nfs/dbraw/zinc/43/45/04/1019434504.db2.gz RNPVKFWRNYJRAZ-NEPJUHHUSA-N 1 1 317.360 3.714 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)CC2(CCCCC2)O1 ZINC001171636109 1032834587 /nfs/dbraw/zinc/83/45/87/1032834587.db2.gz LGBXUDMUEPHMHR-INIZCTEOSA-N 1 1 302.462 3.676 20 10 DHCDMO CC[C@@H](C)[N@H+](C)CCNCc1cc(-c2ccccc2)ccc1O ZINC000727161321 1019661883 /nfs/dbraw/zinc/66/18/83/1019661883.db2.gz HAOFNEJTJCQJKZ-MRXNPFEDSA-N 1 1 312.457 3.879 20 10 DHCDMO CC[C@@H](C)[N@@H+](C)CCNCc1cc(-c2ccccc2)ccc1O ZINC000727161321 1019661892 /nfs/dbraw/zinc/66/18/92/1019661892.db2.gz HAOFNEJTJCQJKZ-MRXNPFEDSA-N 1 1 312.457 3.879 20 10 DHCDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H](C)C1 ZINC000282222725 1019696823 /nfs/dbraw/zinc/69/68/23/1019696823.db2.gz IBXQLRBZXXBETG-QFBILLFUSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cc(CO)cc(C)c1C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000922560020 1020123821 /nfs/dbraw/zinc/12/38/21/1020123821.db2.gz HREYMAVWYSMBEI-UHFFFAOYSA-N 1 1 323.795 3.584 20 10 DHCDMO CCc1cc(C[N@H+](C)Cc2cc[nH]n2)c(O)c(C(C)(C)C)c1 ZINC000732669838 1020268065 /nfs/dbraw/zinc/26/80/65/1020268065.db2.gz MTVKWCFEUHHHSV-UHFFFAOYSA-N 1 1 301.434 3.607 20 10 DHCDMO CCc1cc(C[N@@H+](C)Cc2cc[nH]n2)c(O)c(C(C)(C)C)c1 ZINC000732669838 1020268071 /nfs/dbraw/zinc/26/80/71/1020268071.db2.gz MTVKWCFEUHHHSV-UHFFFAOYSA-N 1 1 301.434 3.607 20 10 DHCDMO COC(=O)CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C(C)C ZINC000733182787 1020345328 /nfs/dbraw/zinc/34/53/28/1020345328.db2.gz BPEWIVACYVLNJX-UHFFFAOYSA-N 1 1 307.434 3.598 20 10 DHCDMO Cc1cc(C[NH+]2CCN(C3CCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000733296976 1020368548 /nfs/dbraw/zinc/36/85/48/1020368548.db2.gz HEDJPMQFONNJGS-UHFFFAOYSA-N 1 1 316.489 3.668 20 10 DHCDMO CN(C)c1ccc(CNCCC[N@@H+](C)C2CCCCC2)cc1F ZINC000733322617 1020370211 /nfs/dbraw/zinc/37/02/11/1020370211.db2.gz QIXBQVMOPVKBRX-UHFFFAOYSA-N 1 1 321.484 3.636 20 10 DHCDMO C[C@@H]1C[C@@H](C)CN(C(C)(C)C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000733325214 1020371162 /nfs/dbraw/zinc/37/11/62/1020371162.db2.gz FBAZKUDDOHLFPV-ZIAGYGMSSA-N 1 1 324.896 3.892 20 10 DHCDMO CC(C)n1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000735167906 1020700107 /nfs/dbraw/zinc/70/01/07/1020700107.db2.gz BIEQFJSKODRPHY-UHFFFAOYSA-N 1 1 314.477 3.941 20 10 DHCDMO Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000738158583 1020863358 /nfs/dbraw/zinc/86/33/58/1020863358.db2.gz MTZFEZFPCKJUJX-INIZCTEOSA-N 1 1 307.397 3.579 20 10 DHCDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738244044 1020868348 /nfs/dbraw/zinc/86/83/48/1020868348.db2.gz ULQCKVOMLQTEDX-INIZCTEOSA-N 1 1 311.381 3.630 20 10 DHCDMO C[N@@H+](CCc1cccnc1)Cc1ccc(N2CCCCC2)cc1 ZINC000738299367 1020871764 /nfs/dbraw/zinc/87/17/64/1020871764.db2.gz OLYXTEKNKHLGSI-UHFFFAOYSA-N 1 1 309.457 3.746 20 10 DHCDMO Cc1cc(C[NH2+][C@H]2CCn3ccnc32)c(C)n1-c1ccccc1 ZINC000858541524 1032938459 /nfs/dbraw/zinc/93/84/59/1032938459.db2.gz BFCSWYWNTQCAMR-SFHVURJKSA-N 1 1 306.413 3.525 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2ncc[nH]2)c(C)n1-c1cccc(C)c1 ZINC000858544074 1032941063 /nfs/dbraw/zinc/94/10/63/1032941063.db2.gz YJHJPHUWQRSQTK-HNNXBMFYSA-N 1 1 308.429 3.976 20 10 DHCDMO CCOC(=O)CCCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000739916282 1020925069 /nfs/dbraw/zinc/92/50/69/1020925069.db2.gz WVFKONDFBAMEOH-UHFFFAOYSA-N 1 1 319.445 3.870 20 10 DHCDMO COCC[N@@H+](Cc1cccs1)Cc1cc(C)c(C)cc1O ZINC000740758325 1020946419 /nfs/dbraw/zinc/94/64/19/1020946419.db2.gz ARKIKPLYHSAWAQ-UHFFFAOYSA-N 1 1 305.443 3.719 20 10 DHCDMO Oc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000310817247 1021059820 /nfs/dbraw/zinc/05/98/20/1021059820.db2.gz GWBJTRDPXWJTSD-TXEJJXNPSA-N 1 1 310.235 3.777 20 10 DHCDMO CC(=O)c1cc(Cl)cc(CN(C)Cc2cnc(C)s2)c1[O-] ZINC000177034142 1021193421 /nfs/dbraw/zinc/19/34/21/1021193421.db2.gz YHFJFROVQIDHSO-UHFFFAOYSA-N 1 1 324.833 3.645 20 10 DHCDMO C[N@H+](Cc1cccc2ccccc21)Cc1cc2c(cc1O)OCO2 ZINC000917469461 1021276384 /nfs/dbraw/zinc/27/63/84/1021276384.db2.gz FHZUIYVTGMRZIN-UHFFFAOYSA-N 1 1 321.376 3.906 20 10 DHCDMO CC[NH+](CC)C[C@@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743388935 1021278238 /nfs/dbraw/zinc/27/82/38/1021278238.db2.gz WRHIWYHNEGUZKT-KRWDZBQOSA-N 1 1 318.505 3.988 20 10 DHCDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000743398409 1021285201 /nfs/dbraw/zinc/28/52/01/1021285201.db2.gz HQSIXNKDUFTFNN-DLBZAZTESA-N 1 1 305.487 3.987 20 10 DHCDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)c1 ZINC000917617604 1021324039 /nfs/dbraw/zinc/32/40/39/1021324039.db2.gz MDOTYFBEHDYYDM-MRXNPFEDSA-N 1 1 311.381 3.766 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000850522124 1021575809 /nfs/dbraw/zinc/57/58/09/1021575809.db2.gz DDUGFNMZLHSDMH-AWEZNQCLSA-N 1 1 313.397 3.646 20 10 DHCDMO CC[C@@H]([NH2+]Cc1nccc(OC)c1F)c1ccc(N(C)C)cc1 ZINC000850536865 1021589141 /nfs/dbraw/zinc/58/91/41/1021589141.db2.gz KOFCVCDOZBJWFR-OAHLLOKOSA-N 1 1 317.408 3.536 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(F)cc1O ZINC000850573406 1021616863 /nfs/dbraw/zinc/61/68/63/1021616863.db2.gz LOWKPNNLQUMWQH-SOVGHPHASA-N 1 1 317.404 3.737 20 10 DHCDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000154848455 1021674157 /nfs/dbraw/zinc/67/41/57/1021674157.db2.gz PQNDSZKRFMFSMW-MRXNPFEDSA-N 1 1 319.445 3.564 20 10 DHCDMO C[N@H+](Cc1c(O)cccc1OC(F)(F)F)C[C@H]1CC1(C)C ZINC001237122293 1021703932 /nfs/dbraw/zinc/70/39/32/1021703932.db2.gz HLIWQHQDUBGETO-SNVBAGLBSA-N 1 1 303.324 3.769 20 10 DHCDMO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)cc1C ZINC000066794522 1021757748 /nfs/dbraw/zinc/75/77/48/1021757748.db2.gz GBNZNZDXFJNZSS-LJQANCHMSA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)cc1C ZINC000066794522 1021757766 /nfs/dbraw/zinc/75/77/66/1021757766.db2.gz GBNZNZDXFJNZSS-LJQANCHMSA-N 1 1 315.388 3.722 20 10 DHCDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccccc1O ZINC000182873040 1021844287 /nfs/dbraw/zinc/84/42/87/1021844287.db2.gz XHOPFWIIKWCSPQ-CYBMUJFWSA-N 1 1 300.358 3.802 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)Cc1ncc(C)c(OC)c1C ZINC000110030884 1021912398 /nfs/dbraw/zinc/91/23/98/1021912398.db2.gz LWVFXUOMOLJYIZ-UHFFFAOYSA-N 1 1 314.429 3.825 20 10 DHCDMO CN(C)c1ccc(C[N@H+](Cc2cc(C3CC3)no2)C2CC2)cc1 ZINC000851732460 1021976068 /nfs/dbraw/zinc/97/60/68/1021976068.db2.gz QMIMZTRUBYHNTC-UHFFFAOYSA-N 1 1 311.429 3.783 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](Cc2cc(C3CC3)no2)C2CC2)cc1 ZINC000851732460 1021976083 /nfs/dbraw/zinc/97/60/83/1021976083.db2.gz QMIMZTRUBYHNTC-UHFFFAOYSA-N 1 1 311.429 3.783 20 10 DHCDMO COc1cc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)cc(OC)c1 ZINC000919955851 1021987354 /nfs/dbraw/zinc/98/73/54/1021987354.db2.gz FMIDPUWXFGHKOK-UHFFFAOYSA-N 1 1 315.413 3.658 20 10 DHCDMO Oc1ccccc1C[N@@H+](Cc1cccc(F)n1)C1CCCC1 ZINC000851771907 1021993660 /nfs/dbraw/zinc/99/36/60/1021993660.db2.gz RHINGLSJIBSAFK-UHFFFAOYSA-N 1 1 300.377 3.871 20 10 DHCDMO CCN(C)c1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000852084194 1022070194 /nfs/dbraw/zinc/07/01/94/1022070194.db2.gz QQRLVOVXRUXDQM-SFHVURJKSA-N 1 1 309.457 3.917 20 10 DHCDMO C[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccccc1O ZINC000111236058 1022253832 /nfs/dbraw/zinc/25/38/32/1022253832.db2.gz KNHIAYQKBAIOSC-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccccc1O ZINC000111236058 1022253844 /nfs/dbraw/zinc/25/38/44/1022253844.db2.gz KNHIAYQKBAIOSC-UHFFFAOYSA-N 1 1 312.344 3.818 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@@](C)(C(F)F)O1 ZINC000853631261 1022301363 /nfs/dbraw/zinc/30/13/63/1022301363.db2.gz UQQOLVZOYMFBEF-SGTLLEGYSA-N 1 1 321.367 3.790 20 10 DHCDMO Cc1cccc(OC[C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000756447948 1022381735 /nfs/dbraw/zinc/38/17/35/1022381735.db2.gz ZGWBNCJEBNHHTE-KBPBESRZSA-N 1 1 303.377 3.958 20 10 DHCDMO C[C@H]([NH2+]Cc1cccc(N)c1)c1cccc(C(F)(F)F)c1O ZINC000854216590 1022433697 /nfs/dbraw/zinc/43/36/97/1022433697.db2.gz CUFBYESWSXXBAF-JTQLQIEISA-N 1 1 310.319 3.844 20 10 DHCDMO Cc1ccc(O)c(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)c1 ZINC000121357656 1022481963 /nfs/dbraw/zinc/48/19/63/1022481963.db2.gz DBIDEBDHRPKYGL-UHFFFAOYSA-N 1 1 307.397 3.518 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000179623355 1022483798 /nfs/dbraw/zinc/48/37/98/1022483798.db2.gz KGOJBOTZKOESGJ-LBPRGKRZSA-N 1 1 303.324 3.565 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2c([O-])ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022786 1022564990 /nfs/dbraw/zinc/56/49/90/1022564990.db2.gz CTEDRHYTSAZBIT-QWRGUYRKSA-N 1 1 317.260 3.506 20 10 DHCDMO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1cc2c(cc1O)CCC2 ZINC000776779559 1022571337 /nfs/dbraw/zinc/57/13/37/1022571337.db2.gz NKTRLUXLEDTFJC-UHFFFAOYSA-N 1 1 321.342 3.930 20 10 DHCDMO COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)OC(C)(C)C3)c2c1 ZINC000068462327 1022644632 /nfs/dbraw/zinc/64/46/32/1022644632.db2.gz DPVINGJEUSCXTH-ZDUSSCGKSA-N 1 1 315.413 3.553 20 10 DHCDMO Cc1cccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000180195670 1022659804 /nfs/dbraw/zinc/65/98/04/1022659804.db2.gz JSZKMMOBCXLBMC-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1O ZINC000180195670 1022659808 /nfs/dbraw/zinc/65/98/08/1022659808.db2.gz JSZKMMOBCXLBMC-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@H]1CCCO1)CC1CCSCC1 ZINC000876532048 1033086996 /nfs/dbraw/zinc/08/69/96/1033086996.db2.gz XJEFQYKLXYWUFM-QGZVFWFLSA-N 1 1 321.486 3.516 20 10 DHCDMO CCN(CC)c1ccc(C[N@@H+](CCO)Cc2ccccc2)cc1 ZINC000768142737 1022891758 /nfs/dbraw/zinc/89/17/58/1022891758.db2.gz NKXVOGDDIFOCNR-UHFFFAOYSA-N 1 1 312.457 3.527 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C[C@H]2CCOc3ccccc32)cc1 ZINC000768128965 1022897945 /nfs/dbraw/zinc/89/79/45/1022897945.db2.gz ADQRXRITDBLOSO-QGZVFWFLSA-N 1 1 310.441 3.751 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2cncc3ccccc32)cc1 ZINC000768131233 1022901903 /nfs/dbraw/zinc/90/19/03/1022901903.db2.gz YDTQEEHAAKFELL-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO C[N@@H+](Cc1cccs1)Cc1cc(Br)ccc1O ZINC000768160733 1022906388 /nfs/dbraw/zinc/90/63/88/1022906388.db2.gz NLOYGEDUMNYUNO-UHFFFAOYSA-N 1 1 312.232 3.848 20 10 DHCDMO CCC[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1O ZINC000114717531 1022906633 /nfs/dbraw/zinc/90/66/33/1022906633.db2.gz LTTOQGAUKCYMOV-UHFFFAOYSA-N 1 1 323.396 3.854 20 10 DHCDMO CCC[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1O ZINC000114717531 1022906647 /nfs/dbraw/zinc/90/66/47/1022906647.db2.gz LTTOQGAUKCYMOV-UHFFFAOYSA-N 1 1 323.396 3.854 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@](CC)(CO)C2)cc1 ZINC000190234020 1022907306 /nfs/dbraw/zinc/90/73/06/1022907306.db2.gz CBYMSISBBARZSU-IBGZPJMESA-N 1 1 304.478 3.517 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2cccn2C)cc1F ZINC000768199811 1022913899 /nfs/dbraw/zinc/91/38/99/1022913899.db2.gz ZCBFXOVNROBOAP-SFHVURJKSA-N 1 1 301.409 3.567 20 10 DHCDMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(Br)ccc1O ZINC000768175740 1022914166 /nfs/dbraw/zinc/91/41/66/1022914166.db2.gz VAYZNAHOLNKJRW-UHFFFAOYSA-N 1 1 324.193 3.926 20 10 DHCDMO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)Cc2ccccc21 ZINC000768196357 1022925311 /nfs/dbraw/zinc/92/53/11/1022925311.db2.gz PTSWRSXXPKUQIK-QGZVFWFLSA-N 1 1 322.452 3.643 20 10 DHCDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000768261231 1022935540 /nfs/dbraw/zinc/93/55/40/1022935540.db2.gz AHTNLKADCVTLOK-RDJZCZTQSA-N 1 1 320.452 3.673 20 10 DHCDMO COc1cccc(C[NH+](Cc2ccco2)Cc2ccco2)c1O ZINC000162569294 1022939996 /nfs/dbraw/zinc/93/99/96/1022939996.db2.gz SRCKEVAMYZIVKE-UHFFFAOYSA-N 1 1 313.353 3.789 20 10 DHCDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000876572469 1033096599 /nfs/dbraw/zinc/09/65/99/1033096599.db2.gz DUIKUAITTULBCV-LPHOPBHVSA-N 1 1 316.489 3.658 20 10 DHCDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000768464217 1022973424 /nfs/dbraw/zinc/97/34/24/1022973424.db2.gz OOUYJYXJWVWECK-GOSISDBHSA-N 1 1 303.446 3.518 20 10 DHCDMO COc1cc(C[N@H+]2CCOC3(C2)CCCCCC3)c(O)cc1C ZINC000768462437 1022974270 /nfs/dbraw/zinc/97/42/70/1022974270.db2.gz LKFRUBVNTITAMW-UHFFFAOYSA-N 1 1 319.445 3.634 20 10 DHCDMO Oc1ccccc1C[N@@H+](C[C@@H]1CCCOC1)C1CCCCC1 ZINC000768532229 1022982810 /nfs/dbraw/zinc/98/28/10/1022982810.db2.gz IHRYNDXRCKCUOI-INIZCTEOSA-N 1 1 303.446 3.954 20 10 DHCDMO CCC[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)CC(C)C ZINC000876591686 1033097904 /nfs/dbraw/zinc/09/79/04/1033097904.db2.gz BFMVMANJFZHTRL-UHFFFAOYSA-N 1 1 304.478 3.516 20 10 DHCDMO C[N@@H+](Cc1ccccc1O)C1CCN(c2cccc(F)c2)CC1 ZINC000364298567 1022995067 /nfs/dbraw/zinc/99/50/67/1022995067.db2.gz GREVDSDPXZOHGW-UHFFFAOYSA-N 1 1 314.404 3.632 20 10 DHCDMO COCC[N@@H+](Cc1c(O)cccc1OC)[C@H](C)c1ccccc1 ZINC000768595948 1022997822 /nfs/dbraw/zinc/99/78/22/1022997822.db2.gz JNLWDRBHKUQPAT-OAHLLOKOSA-N 1 1 315.413 3.610 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)cc1C ZINC000364310442 1023007021 /nfs/dbraw/zinc/00/70/21/1023007021.db2.gz UHYNZMUKJLFBFI-WIYYLYMNSA-N 1 1 324.468 3.792 20 10 DHCDMO Cc1cc(O)c(C[NH2+]C[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1C ZINC000364310442 1023007040 /nfs/dbraw/zinc/00/70/40/1023007040.db2.gz UHYNZMUKJLFBFI-WIYYLYMNSA-N 1 1 324.468 3.792 20 10 DHCDMO CCOc1ccc(C[N@@H+](CC)CCc2cccs2)c(O)c1 ZINC000768756764 1023022733 /nfs/dbraw/zinc/02/27/33/1023022733.db2.gz BVBYOIQGXKWLLE-UHFFFAOYSA-N 1 1 305.443 3.917 20 10 DHCDMO CC[C@H](C)C[N@@H+](C)Cc1cc(Br)cc(OC)c1O ZINC000768772332 1023023903 /nfs/dbraw/zinc/02/39/03/1023023903.db2.gz ZHCDHUFNHFDCJQ-JTQLQIEISA-N 1 1 316.239 3.641 20 10 DHCDMO Cc1cccc(C[N@@H+](C)Cc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000876572179 1033095343 /nfs/dbraw/zinc/09/53/43/1033095343.db2.gz BHYWYMJIPVPUMT-UHFFFAOYSA-N 1 1 324.468 3.588 20 10 DHCDMO C[C@H]([N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1)C(C)(C)C ZINC000876598710 1033100958 /nfs/dbraw/zinc/10/09/58/1033100958.db2.gz PFJDSSYPHIJSNX-HNNXBMFYSA-N 1 1 304.478 3.514 20 10 DHCDMO Cc1ccc(O)c(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1 ZINC000769033626 1023070409 /nfs/dbraw/zinc/07/04/09/1023070409.db2.gz JAUIJDIDVFZNBE-LJQANCHMSA-N 1 1 311.425 3.882 20 10 DHCDMO C[C@H]1C[N@@H+](Cc2ccc(N(C)C)cc2)C[C@@H](c2ccccc2)O1 ZINC000769102994 1023090254 /nfs/dbraw/zinc/09/02/54/1023090254.db2.gz RNSFRKPJWHFSKN-JXFKEZNVSA-N 1 1 310.441 3.715 20 10 DHCDMO Oc1ccc(Br)cc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000769246314 1023107620 /nfs/dbraw/zinc/10/76/20/1023107620.db2.gz ZMPMLEWADLMCAG-AWEZNQCLSA-N 1 1 310.235 3.919 20 10 DHCDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769315712 1023119085 /nfs/dbraw/zinc/11/90/85/1023119085.db2.gz WATWUKLXVQDWOM-GOSISDBHSA-N 1 1 302.462 3.534 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1 ZINC000769316606 1023121001 /nfs/dbraw/zinc/12/10/01/1023121001.db2.gz KNTVLRXEJSIGSF-MRXNPFEDSA-N 1 1 311.381 3.766 20 10 DHCDMO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1 ZINC000769316594 1023121448 /nfs/dbraw/zinc/12/14/48/1023121448.db2.gz JSYBCYZMKVEXAL-GOSISDBHSA-N 1 1 324.424 3.818 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCCc3sccc3C2)c1O ZINC000769381100 1023135536 /nfs/dbraw/zinc/13/55/36/1023135536.db2.gz LQMNEXKGHJIRRZ-UHFFFAOYSA-N 1 1 303.427 3.801 20 10 DHCDMO COc1cccc(O)c1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000769378170 1023136186 /nfs/dbraw/zinc/13/61/86/1023136186.db2.gz ADNGLHJOTWPWHE-ZDUSSCGKSA-N 1 1 301.361 3.529 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1c(O)cccc1Cl)C2 ZINC000769426536 1023146474 /nfs/dbraw/zinc/14/64/74/1023146474.db2.gz RCXAJEREIIWNSV-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1c(O)cccc1Cl)C2 ZINC000769426536 1023146476 /nfs/dbraw/zinc/14/64/76/1023146476.db2.gz RCXAJEREIIWNSV-UHFFFAOYSA-N 1 1 318.760 3.512 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@](C)(c3ccccc3)C2)c1O ZINC000769424582 1023147663 /nfs/dbraw/zinc/14/76/63/1023147663.db2.gz LSIFGQSUGFMYAT-FQEVSTJZSA-N 1 1 311.425 3.955 20 10 DHCDMO C[C@@]1(c2ccccc2)C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769397292 1023149802 /nfs/dbraw/zinc/14/98/02/1023149802.db2.gz CLHDDATXROBDGD-SFHVURJKSA-N 1 1 317.816 3.793 20 10 DHCDMO C[C@@]1(c2ccccc2)C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000769397292 1023149805 /nfs/dbraw/zinc/14/98/05/1023149805.db2.gz CLHDDATXROBDGD-SFHVURJKSA-N 1 1 317.816 3.793 20 10 DHCDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc(N2CCOCC2)cc1 ZINC000769452262 1023156363 /nfs/dbraw/zinc/15/63/63/1023156363.db2.gz UVDQUBFFVYESRR-DLBZAZTESA-N 1 1 302.462 3.534 20 10 DHCDMO CCOc1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c(O)c1 ZINC000769499965 1023167130 /nfs/dbraw/zinc/16/71/30/1023167130.db2.gz YAADKMRHWLUSCP-WBVHZDCISA-N 1 1 307.459 3.651 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1O ZINC000769558583 1023180391 /nfs/dbraw/zinc/18/03/91/1023180391.db2.gz FVWKIMRJIZCAJO-CYBMUJFWSA-N 1 1 303.352 3.968 20 10 DHCDMO Cc1cccc(O)c1C[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000876680227 1033119339 /nfs/dbraw/zinc/11/93/39/1033119339.db2.gz AWUUFGALTOYMNM-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO Cc1cccc(O)c1C[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000876680227 1033119341 /nfs/dbraw/zinc/11/93/41/1033119341.db2.gz AWUUFGALTOYMNM-SFHVURJKSA-N 1 1 319.351 3.552 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+](C)[C@H]2C[C@H](OCC)C23CCC3)c1 ZINC000770353846 1023304875 /nfs/dbraw/zinc/30/48/75/1023304875.db2.gz VIQRLSVGCPIBJS-ROUUACIJSA-N 1 1 319.445 3.570 20 10 DHCDMO CC[N@@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C1CCC1 ZINC000770510507 1023316986 /nfs/dbraw/zinc/31/69/86/1023316986.db2.gz NCMYIGJQVOKZSJ-UHFFFAOYSA-N 1 1 302.462 3.676 20 10 DHCDMO Cc1cccc(C2=CC[N@@H+](Cc3cc4c(cc3O)OCO4)CC2)c1 ZINC000770660248 1023334536 /nfs/dbraw/zinc/33/45/36/1023334536.db2.gz FIKVOILCYACVCB-UHFFFAOYSA-N 1 1 323.392 3.719 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c(O)c1 ZINC000876725860 1033129626 /nfs/dbraw/zinc/12/96/26/1033129626.db2.gz ZTMLIJCBIZRCFP-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO Cc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c(O)c1 ZINC000876725860 1033129630 /nfs/dbraw/zinc/12/96/30/1033129630.db2.gz ZTMLIJCBIZRCFP-UHFFFAOYSA-N 1 1 302.443 3.668 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)Cc2nccc3ccccc32)cc1 ZINC000771935466 1023489840 /nfs/dbraw/zinc/48/98/40/1023489840.db2.gz UWEZPWWJSUWRHE-UHFFFAOYSA-N 1 1 305.425 3.933 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)c1ccc(F)cc1O ZINC000756780224 1023800261 /nfs/dbraw/zinc/80/02/61/1023800261.db2.gz XKKFWXDYMQSYPF-ZEQHWRKHSA-N 1 1 313.463 3.562 20 10 DHCDMO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000788606869 1023912119 /nfs/dbraw/zinc/91/21/19/1023912119.db2.gz AYKWASSFEOYNLP-SDDRHHMPSA-N 1 1 319.367 3.859 20 10 DHCDMO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H](O)c1ccccc1 ZINC000788623030 1023915556 /nfs/dbraw/zinc/91/55/56/1023915556.db2.gz VCDMBOIRBKPQPB-BKTGTZMESA-N 1 1 317.404 3.940 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCOCC1)c1cccc(C(F)(F)F)c1O ZINC000788695205 1023927530 /nfs/dbraw/zinc/92/75/30/1023927530.db2.gz ZEISVZNECLAQSW-QWRGUYRKSA-N 1 1 303.324 3.631 20 10 DHCDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1cccc(C(F)(F)F)c1O ZINC000788760487 1023930231 /nfs/dbraw/zinc/93/02/31/1023930231.db2.gz BDWNZSLLOIJUPA-MISXGVKJSA-N 1 1 317.351 3.613 20 10 DHCDMO COCCCCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000116879125 1033191206 /nfs/dbraw/zinc/19/12/06/1033191206.db2.gz JKLZIHGUJCDICO-UHFFFAOYSA-N 1 1 303.402 3.804 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508394 1024161333 /nfs/dbraw/zinc/16/13/33/1024161333.db2.gz ZWZUKRKGZRJANU-LSDHHAIUSA-N 1 1 310.441 3.680 20 10 DHCDMO C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508394 1024161344 /nfs/dbraw/zinc/16/13/44/1024161344.db2.gz ZWZUKRKGZRJANU-LSDHHAIUSA-N 1 1 310.441 3.680 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508404 1024162255 /nfs/dbraw/zinc/16/22/55/1024162255.db2.gz ZWZUKRKGZRJANU-HUUCEWRRSA-N 1 1 310.441 3.680 20 10 DHCDMO C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC000193508404 1024162259 /nfs/dbraw/zinc/16/22/59/1024162259.db2.gz ZWZUKRKGZRJANU-HUUCEWRRSA-N 1 1 310.441 3.680 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@H](c1ccccc1)[C@H]1CCCO1 ZINC000882937207 1024180322 /nfs/dbraw/zinc/18/03/22/1024180322.db2.gz KXQLLKPMXMVOCO-IAGOWNOFSA-N 1 1 319.351 3.680 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000882947014 1024182412 /nfs/dbraw/zinc/18/24/12/1024182412.db2.gz GYRXYHUCDGDQTO-OAHLLOKOSA-N 1 1 305.324 3.674 20 10 DHCDMO Cc1cccnc1[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C(C)C ZINC000883002364 1024207380 /nfs/dbraw/zinc/20/73/80/1024207380.db2.gz DSYSMKOHCNFUMA-HNNXBMFYSA-N 1 1 306.356 3.861 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000883176841 1024267683 /nfs/dbraw/zinc/26/76/83/1024267683.db2.gz LOCNXDYGNXTVET-UHFFFAOYSA-N 1 1 303.299 3.728 20 10 DHCDMO CC(C)(C)OC1CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000883194304 1024281316 /nfs/dbraw/zinc/28/13/16/1024281316.db2.gz SNCDZGUURONKAJ-UHFFFAOYSA-N 1 1 313.388 3.886 20 10 DHCDMO CC(C)=CC[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000790698665 1024356198 /nfs/dbraw/zinc/35/61/98/1024356198.db2.gz QVFWLBPLWVNSDT-SECBINFHSA-N 1 1 302.187 3.911 20 10 DHCDMO COc1ccc(CC[NH2+]Cc2c(O)ccc(Cl)c2F)cc1 ZINC000790946780 1024401716 /nfs/dbraw/zinc/40/17/16/1024401716.db2.gz VXMYFDZNBWAGAH-UHFFFAOYSA-N 1 1 309.768 3.526 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[NH2+]CCc1ccc(F)cc1F ZINC000790962924 1024407571 /nfs/dbraw/zinc/40/75/71/1024407571.db2.gz YEPUVYSVKLMPBI-UHFFFAOYSA-N 1 1 315.722 3.795 20 10 DHCDMO Cc1noc(C)c1CCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790974395 1024419299 /nfs/dbraw/zinc/41/92/99/1024419299.db2.gz TYXSPPBRGIGUPB-UHFFFAOYSA-N 1 1 312.772 3.512 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000271255092 1024477518 /nfs/dbraw/zinc/47/75/18/1024477518.db2.gz JKYFJPBRSGPZLY-WBMJQRKESA-N 1 1 321.804 3.727 20 10 DHCDMO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000271255090 1024478470 /nfs/dbraw/zinc/47/84/70/1024478470.db2.gz JKYFJPBRSGPZLY-LRDDRELGSA-N 1 1 321.804 3.727 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000792173383 1024641323 /nfs/dbraw/zinc/64/13/23/1024641323.db2.gz FGDMEUBIOROKGI-ZDUSSCGKSA-N 1 1 320.795 3.644 20 10 DHCDMO Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000792173383 1024641328 /nfs/dbraw/zinc/64/13/28/1024641328.db2.gz FGDMEUBIOROKGI-ZDUSSCGKSA-N 1 1 320.795 3.644 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@H](CC)C(=O)OC(C)(C)C ZINC000792233609 1024650006 /nfs/dbraw/zinc/65/00/06/1024650006.db2.gz REAPDXKDXKXEAG-OAHLLOKOSA-N 1 1 307.434 3.725 20 10 DHCDMO CN(C)c1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1F ZINC000116374152 1024857927 /nfs/dbraw/zinc/85/79/27/1024857927.db2.gz OHAKPGJRDAAPAF-UHFFFAOYSA-N 1 1 319.449 3.907 20 10 DHCDMO CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000793230497 1024944594 /nfs/dbraw/zinc/94/45/94/1024944594.db2.gz FWRFTDCKBHHVJN-ZWNOBZJWSA-N 1 1 303.324 3.564 20 10 DHCDMO COc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)c(O)c1 ZINC000793386537 1025028245 /nfs/dbraw/zinc/02/82/45/1025028245.db2.gz VSHSJCAFDDZMJR-INIZCTEOSA-N 1 1 321.367 3.757 20 10 DHCDMO C[C@]1(O)CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000279692741 1025156800 /nfs/dbraw/zinc/15/68/00/1025156800.db2.gz QAPXGJXOBUFQPZ-FQEVSTJZSA-N 1 1 311.425 3.796 20 10 DHCDMO CSC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)CCCC3)C1 ZINC000793790761 1025162771 /nfs/dbraw/zinc/16/27/71/1025162771.db2.gz KWIXZUNPCFBVGI-CQSZACIVSA-N 1 1 305.487 3.846 20 10 DHCDMO CC(C)c1nnc(C[N@H+](Cc2ccccc2O)C2CCCC2)[nH]1 ZINC000794374048 1025259326 /nfs/dbraw/zinc/25/93/26/1025259326.db2.gz AWVRIOKREFMMKB-UHFFFAOYSA-N 1 1 314.433 3.579 20 10 DHCDMO CC(C)c1nnc(C[N@@H+](Cc2ccccc2O)C2CCCC2)[nH]1 ZINC000794374048 1025259340 /nfs/dbraw/zinc/25/93/40/1025259340.db2.gz AWVRIOKREFMMKB-UHFFFAOYSA-N 1 1 314.433 3.579 20 10 DHCDMO COc1ccc(N2CCC[N@@H+](CCCc3ccccc3)CC2)cc1 ZINC000108094652 1025325916 /nfs/dbraw/zinc/32/59/16/1025325916.db2.gz GAPKUJNLPJQGOK-UHFFFAOYSA-N 1 1 324.468 3.840 20 10 DHCDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)o1 ZINC000137073963 1025495707 /nfs/dbraw/zinc/49/57/07/1025495707.db2.gz KXLCDKVXACUMQF-SFHVURJKSA-N 1 1 314.429 3.829 20 10 DHCDMO C[C@H]([NH2+]CCCSc1nccs1)c1c(O)cccc1F ZINC000886527973 1025678385 /nfs/dbraw/zinc/67/83/85/1025678385.db2.gz DNHUZRPTFXJBEK-JTQLQIEISA-N 1 1 312.435 3.821 20 10 DHCDMO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1c(O)cccc1F ZINC000886543780 1025689752 /nfs/dbraw/zinc/68/97/52/1025689752.db2.gz VIQYUOABLZJBCE-PSTGCABASA-N 1 1 321.367 3.833 20 10 DHCDMO C[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1c(O)cccc1F ZINC000886609475 1025735433 /nfs/dbraw/zinc/73/54/33/1025735433.db2.gz UUXRFDGJADQZBU-CYBMUJFWSA-N 1 1 300.377 3.699 20 10 DHCDMO C[C@@H]([NH2+]CCSCCC(F)(F)F)c1c(O)cccc1F ZINC000886648268 1025760823 /nfs/dbraw/zinc/76/08/23/1025760823.db2.gz PFQHAYMNHFVSJJ-SECBINFHSA-N 1 1 311.344 3.868 20 10 DHCDMO C[C@@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@@H+]1C ZINC000093644407 1026119051 /nfs/dbraw/zinc/11/90/51/1026119051.db2.gz VIZPDUHPMOWJOV-MFKMUULPSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[N@H+]1C ZINC000093644407 1026119055 /nfs/dbraw/zinc/11/90/55/1026119055.db2.gz VIZPDUHPMOWJOV-MFKMUULPSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644407 1026119065 /nfs/dbraw/zinc/11/90/65/1026119065.db2.gz VIZPDUHPMOWJOV-MFKMUULPSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[O-])CC[NH+]1C ZINC000093644407 1026119073 /nfs/dbraw/zinc/11/90/73/1026119073.db2.gz VIZPDUHPMOWJOV-MFKMUULPSA-N 1 1 317.260 3.614 20 10 DHCDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CCN1C ZINC000093643817 1026120491 /nfs/dbraw/zinc/12/04/91/1026120491.db2.gz GCEYNGOCJYGTGA-YLJYHZDGSA-N 1 1 315.505 3.591 20 10 DHCDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc(OC)c2O)s1 ZINC000093612541 1026120720 /nfs/dbraw/zinc/12/07/20/1026120720.db2.gz GRMNIIPNDUDYEG-LBPRGKRZSA-N 1 1 320.458 3.921 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1 ZINC000289811693 1026186388 /nfs/dbraw/zinc/18/63/88/1026186388.db2.gz SXFOHSOWZGTJMO-AQNXPRMDSA-N 1 1 323.436 3.705 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC000289826530 1026189613 /nfs/dbraw/zinc/18/96/13/1026189613.db2.gz OKYHZVTWUFMQBS-OAHLLOKOSA-N 1 1 318.804 3.786 20 10 DHCDMO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)c1O ZINC000808707085 1026357766 /nfs/dbraw/zinc/35/77/66/1026357766.db2.gz ZZCUTRSCDJDZNA-IINYFYTJSA-N 1 1 305.809 3.805 20 10 DHCDMO Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)n[nH]1 ZINC000808706207 1026358955 /nfs/dbraw/zinc/35/89/55/1026358955.db2.gz FFJYXIHSBIFWRA-JQWIXIFHSA-N 1 1 307.825 3.667 20 10 DHCDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(O)cccc1Cl ZINC000809689176 1026595540 /nfs/dbraw/zinc/59/55/40/1026595540.db2.gz WLMYVJIHGPIBNM-UHFFFAOYSA-N 1 1 320.776 3.628 20 10 DHCDMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1O ZINC000809758140 1026618253 /nfs/dbraw/zinc/61/82/53/1026618253.db2.gz DTTADWBHXQZOKO-CABCVRRESA-N 1 1 323.864 3.993 20 10 DHCDMO Oc1ccc(Cl)cc1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000809758639 1026618547 /nfs/dbraw/zinc/61/85/47/1026618547.db2.gz SBVIQPCGXQSESQ-KGLIPLIRSA-N 1 1 309.837 3.684 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C)C2CCC(F)(F)CC2)cc1F ZINC000809781782 1026624056 /nfs/dbraw/zinc/62/40/56/1026624056.db2.gz AIVMKQZAPBVLBM-UHFFFAOYSA-N 1 1 300.368 3.901 20 10 DHCDMO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC(C)(C)C1 ZINC000811511665 1027027210 /nfs/dbraw/zinc/02/72/10/1027027210.db2.gz QHMDNVACJWHNFF-OAHLLOKOSA-N 1 1 308.441 3.671 20 10 DHCDMO COc1ccc(O)c(CNc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC000811804969 1027087182 /nfs/dbraw/zinc/08/71/82/1027087182.db2.gz GILUCKOASKOLAN-UHFFFAOYSA-N 1 1 314.772 3.636 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1F ZINC000295348188 1027214844 /nfs/dbraw/zinc/21/48/44/1027214844.db2.gz YSKWGYLLVUDRFM-CJNGLKHVSA-N 1 1 316.424 3.664 20 10 DHCDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nccn2CC)cc1 ZINC000295363573 1027228129 /nfs/dbraw/zinc/22/81/29/1027228129.db2.gz ZRFJGTRJUDSELR-HNNXBMFYSA-N 1 1 300.450 3.600 20 10 DHCDMO CC[N@@H+](Cc1c2c(ccc1O)oc1c2CCCC1)[C@@H]1CCOC1 ZINC000812296346 1027246948 /nfs/dbraw/zinc/24/69/48/1027246948.db2.gz PJSBBLCHGGPBPK-CYBMUJFWSA-N 1 1 315.413 3.628 20 10 DHCDMO CC[N@H+](Cc1c2c(ccc1O)oc1c2CCCC1)C[C@H](C)OC ZINC000812302902 1027248543 /nfs/dbraw/zinc/24/85/43/1027248543.db2.gz HQLCTBBZBHGJAZ-ZDUSSCGKSA-N 1 1 317.429 3.874 20 10 DHCDMO CC[C@H]1CC[N@@H+](Cc2ccc(N3CCC(OC)CC3)cc2)C1 ZINC000296764968 1027729028 /nfs/dbraw/zinc/72/90/28/1027729028.db2.gz LZACQAQWJAMLQE-INIZCTEOSA-N 1 1 302.462 3.534 20 10 DHCDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1cc(F)ccc1O ZINC000778999221 1027742573 /nfs/dbraw/zinc/74/25/73/1027742573.db2.gz BBKSDEBALKOQKO-UHFFFAOYSA-N 1 1 307.340 3.571 20 10 DHCDMO CC[C@@H](c1ccccc1O)[N@H+]1CCO[C@H](c2ccc(C)o2)C1 ZINC000364621027 1027855107 /nfs/dbraw/zinc/85/51/07/1027855107.db2.gz GIDXNIKYJMJJQV-YJBOKZPZSA-N 1 1 301.386 3.818 20 10 DHCDMO Cc1cccc(C[N@@H+]2CCN(c3cccc(F)c3)C[C@H]2C)c1O ZINC000814178423 1027913166 /nfs/dbraw/zinc/91/31/66/1027913166.db2.gz PHXYMUIOBXKQNA-OAHLLOKOSA-N 1 1 314.404 3.550 20 10 DHCDMO Cc1ncccc1C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000527986226 1028047108 /nfs/dbraw/zinc/04/71/08/1028047108.db2.gz KHZOBTFOJXGVKD-LLVKDONJSA-N 1 1 310.319 3.965 20 10 DHCDMO COc1ccc(N2CCC([N@@H+](C)Cc3ccsc3)CC2)cc1 ZINC000367428048 1028185130 /nfs/dbraw/zinc/18/51/30/1028185130.db2.gz FKVDTGLOJZNTRV-UHFFFAOYSA-N 1 1 316.470 3.858 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@H](c3ccnc(C)n3)C2)ccc1N(C)C ZINC000815020171 1028329647 /nfs/dbraw/zinc/32/96/47/1028329647.db2.gz ZONKCFHBRVNSST-SFHVURJKSA-N 1 1 324.472 3.539 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)ccc1N(C)C ZINC000815068691 1028349247 /nfs/dbraw/zinc/34/92/47/1028349247.db2.gz ZEWPJWOCAWLGDG-IBGZPJMESA-N 1 1 309.457 3.747 20 10 DHCDMO CCc1nc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cs1 ZINC000815088215 1028357849 /nfs/dbraw/zinc/35/78/49/1028357849.db2.gz CFEWKRROINEIAA-ZDUSSCGKSA-N 1 1 303.475 3.931 20 10 DHCDMO CN(C)CCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815553081 1028540177 /nfs/dbraw/zinc/54/01/77/1028540177.db2.gz RDGQYIAOUVBTLT-IBGZPJMESA-N 1 1 312.457 3.607 20 10 DHCDMO CCC[N@@H+](Cc1ccccc1O)[C@@H](C)C(=O)N(C(C)C)C(C)C ZINC000076074534 1028554650 /nfs/dbraw/zinc/55/46/50/1028554650.db2.gz ICEIXEBBTXTERY-INIZCTEOSA-N 1 1 320.477 3.638 20 10 DHCDMO COC(=O)c1ccc(O)c([C@H](C)[NH2+]CCC(C)(C)C2CC2)c1 ZINC000815657257 1028585414 /nfs/dbraw/zinc/58/54/14/1028585414.db2.gz UETMWJDZBFDUHQ-LBPRGKRZSA-N 1 1 305.418 3.656 20 10 DHCDMO CCC[N@@H+](CCOCC(F)(F)C(F)F)Cc1ccccc1O ZINC000189480829 1028587839 /nfs/dbraw/zinc/58/78/39/1028587839.db2.gz HEZVBANFNGNUOJ-UHFFFAOYSA-N 1 1 323.330 3.521 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000372595042 1028872928 /nfs/dbraw/zinc/87/29/28/1028872928.db2.gz OVLKJTMUCCPYMP-IEBWSBKVSA-N 1 1 313.397 3.622 20 10 DHCDMO CC(C)COC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816494452 1028898062 /nfs/dbraw/zinc/89/80/62/1028898062.db2.gz MHYYJFQHWGAGAG-UHFFFAOYSA-N 1 1 315.816 3.822 20 10 DHCDMO Oc1ccc2c(c1)CC[N@H+](Cc1ccc3ccccc3c1O)CC2 ZINC000816498592 1028904978 /nfs/dbraw/zinc/90/49/78/1028904978.db2.gz BDBLENVYBVXIOV-UHFFFAOYSA-N 1 1 319.404 3.852 20 10 DHCDMO COc1ccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)cc1F ZINC000816530986 1028922077 /nfs/dbraw/zinc/92/20/77/1028922077.db2.gz CGCAXZXHBQURME-UHFFFAOYSA-N 1 1 313.731 3.622 20 10 DHCDMO CCOc1ccccc1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816537898 1028926346 /nfs/dbraw/zinc/92/63/46/1028926346.db2.gz XQHSJTNYHCUVTN-UHFFFAOYSA-N 1 1 309.768 3.873 20 10 DHCDMO Oc1c(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)ccc2ccccc21 ZINC000816521707 1028933770 /nfs/dbraw/zinc/93/37/70/1028933770.db2.gz XBSYGDLHACIQTL-SJLPKXTDSA-N 1 1 311.425 3.794 20 10 DHCDMO Oc1cc(F)c(Cl)cc1C[NH2+]C[C@H]1COc2ccccc2C1 ZINC000816528315 1028935064 /nfs/dbraw/zinc/93/50/64/1028935064.db2.gz WDUZIZJFRDWUBF-NSHDSACASA-N 1 1 321.779 3.526 20 10 DHCDMO [O-]c1c(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc2ccccc21 ZINC000816593052 1028938736 /nfs/dbraw/zinc/93/87/36/1028938736.db2.gz CNJOCDWYLMKACT-UHFFFAOYSA-N 1 1 310.441 3.509 20 10 DHCDMO CN(C)[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)c1ccccc1 ZINC000816561018 1028944621 /nfs/dbraw/zinc/94/46/21/1028944621.db2.gz JAGINNKEVRQTEE-INIZCTEOSA-N 1 1 322.811 3.577 20 10 DHCDMO C[N@H+](Cc1ccc2ccccc2c1O)C[C@H](O)Cc1ccccc1 ZINC000816624756 1028953209 /nfs/dbraw/zinc/95/32/09/1028953209.db2.gz GVLFIFNBPXSVEN-LJQANCHMSA-N 1 1 321.420 3.581 20 10 DHCDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc3ccccc3c1O)C2 ZINC000816609030 1028959582 /nfs/dbraw/zinc/95/95/82/1028959582.db2.gz QAWQKTTUVLRIKP-UHFFFAOYSA-N 1 1 311.425 3.936 20 10 DHCDMO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609283 1028960315 /nfs/dbraw/zinc/96/03/15/1028960315.db2.gz WOYHXTDNBSGJMR-YPMHNXCESA-N 1 1 315.816 3.700 20 10 DHCDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816609283 1028960321 /nfs/dbraw/zinc/96/03/21/1028960321.db2.gz WOYHXTDNBSGJMR-YPMHNXCESA-N 1 1 315.816 3.700 20 10 DHCDMO CCN(C)c1ccc([C@H](C)[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000373519757 1029069513 /nfs/dbraw/zinc/06/95/13/1029069513.db2.gz GNKMENCQAQBXOC-VQSBYGRUSA-N 1 1 315.505 3.810 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000817413288 1029152719 /nfs/dbraw/zinc/15/27/19/1029152719.db2.gz VQOZLQFXJBDRPB-LBPRGKRZSA-N 1 1 317.351 3.955 20 10 DHCDMO C[C@@H]1CC[C@@H](C[N@@H+](Cc2ccco2)Cc2ccccc2O)O1 ZINC000190859632 1029184402 /nfs/dbraw/zinc/18/44/02/1029184402.db2.gz LURLKFMQEXLPTQ-PBHICJAKSA-N 1 1 301.386 3.555 20 10 DHCDMO Cc1ccc(C)c([C@H](C)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817938400 1029284547 /nfs/dbraw/zinc/28/45/47/1029284547.db2.gz JVXQTPJLAZEBSH-JXFKEZNVSA-N 1 1 311.473 3.720 20 10 DHCDMO CC[C@@H](NC[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817943319 1029286821 /nfs/dbraw/zinc/28/68/21/1029286821.db2.gz UJKSWHIAKNWGRI-RBUKOAKNSA-N 1 1 315.436 3.632 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1F ZINC000817942945 1029287067 /nfs/dbraw/zinc/28/70/67/1029287067.db2.gz SABKXNXJRUVSRP-MOPGFXCFSA-N 1 1 315.436 3.632 20 10 DHCDMO C[C@@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817971170 1029311933 /nfs/dbraw/zinc/31/19/33/1029311933.db2.gz JWUOMTHYUJIDGG-INMHGKMJSA-N 1 1 319.468 3.607 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817980394 1029318375 /nfs/dbraw/zinc/31/83/75/1029318375.db2.gz ALWSEEDHXFKREE-SUHUHFCYSA-N 1 1 316.367 3.579 20 10 DHCDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3O)C2)s1 ZINC000374893469 1029490441 /nfs/dbraw/zinc/49/04/41/1029490441.db2.gz JGMQLEZSNNDDDM-GFCCVEGCSA-N 1 1 306.406 3.676 20 10 DHCDMO Cc1cc(Cl)cc(C[NH2+]Cc2noc3c2CCCC3)c1O ZINC000290247306 1029966296 /nfs/dbraw/zinc/96/62/96/1029966296.db2.gz VIWPUJUMJWDPHF-UHFFFAOYSA-N 1 1 306.793 3.511 20 10 DHCDMO CCCC[N@@H+](Cc1cncn1C(C)C)Cc1ccccc1O ZINC000822476660 1030039118 /nfs/dbraw/zinc/03/91/18/1030039118.db2.gz SGVNGCCHJGKVQS-UHFFFAOYSA-N 1 1 301.434 3.972 20 10 DHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1 ZINC000822525606 1030045751 /nfs/dbraw/zinc/04/57/51/1030045751.db2.gz JTAOYKUOHVZROV-QZTJIDSGSA-N 1 1 317.816 3.662 20 10 DHCDMO C[N@@H+](Cc1ccc2c(c1)OCCCCO2)Cc1ccccc1O ZINC000823409308 1030281015 /nfs/dbraw/zinc/28/10/15/1030281015.db2.gz XQFBFTDEYNRYSI-UHFFFAOYSA-N 1 1 313.397 3.576 20 10 DHCDMO COc1cccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c1O ZINC000291230163 1030410574 /nfs/dbraw/zinc/41/05/74/1030410574.db2.gz KIALUWLTLAMZIK-OLZOCXBDSA-N 1 1 317.351 3.954 20 10 DHCDMO Cc1ncc(C[N@@H+](Cc2ccccc2O)C2CCCCC2)n1C ZINC000824484731 1030565020 /nfs/dbraw/zinc/56/50/20/1030565020.db2.gz RWLZTEUWZYJHNA-UHFFFAOYSA-N 1 1 313.445 3.769 20 10 DHCDMO CCCn1nccc1C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000824555342 1030580252 /nfs/dbraw/zinc/58/02/52/1030580252.db2.gz FPZRICVJOOPLIF-UHFFFAOYSA-N 1 1 312.461 3.524 20 10 DHCDMO CCCn1nccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000824555342 1030580263 /nfs/dbraw/zinc/58/02/63/1030580263.db2.gz FPZRICVJOOPLIF-UHFFFAOYSA-N 1 1 312.461 3.524 20 10 DHCDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]2C2CC2)ccc1N1CCCCC1 ZINC000824651328 1030599804 /nfs/dbraw/zinc/59/98/04/1030599804.db2.gz XFZGEQHJSVMQFC-MRXNPFEDSA-N 1 1 315.417 3.569 20 10 DHCDMO Cc1cccc(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)c1O ZINC000824690810 1030613576 /nfs/dbraw/zinc/61/35/76/1030613576.db2.gz MKPYHQXUIHHHRP-MRXNPFEDSA-N 1 1 305.805 3.519 20 10 DHCDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)c2nccn21 ZINC000825017722 1030699532 /nfs/dbraw/zinc/69/95/32/1030699532.db2.gz YJBFXTIRNAQZIP-MAUKXSAKSA-N 1 1 310.445 3.669 20 10 DHCDMO CCc1ncc(C[NH2+]Cc2ccc(N(CC)CC)c(F)c2)o1 ZINC000825079481 1030720897 /nfs/dbraw/zinc/72/08/97/1030720897.db2.gz VNAULOXXHVUTOO-UHFFFAOYSA-N 1 1 305.397 3.512 20 10 DHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)cc1 ZINC000825133257 1030735361 /nfs/dbraw/zinc/73/53/61/1030735361.db2.gz AYBREEIRXKUWGS-IBGZPJMESA-N 1 1 302.462 3.535 20 10 DHCDMO C[C@H]([NH2+][C@H]1CCCC[C@H]1n1cccn1)c1ccc(F)cc1O ZINC000248531319 1030735429 /nfs/dbraw/zinc/73/54/29/1030735429.db2.gz XUNUIWRNLPQUFI-VBNZEHGJSA-N 1 1 303.381 3.562 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2C2CCOCC2)cc1Cl ZINC000825412171 1030803086 /nfs/dbraw/zinc/80/30/86/1030803086.db2.gz DPVVOOYUUCOWAX-MRXNPFEDSA-N 1 1 309.837 3.745 20 10 DHCDMO Cn1c2ccccc2[nH+]c1NCCCSc1nccs1 ZINC000179297286 1030989202 /nfs/dbraw/zinc/98/92/02/1030989202.db2.gz JAXVMXONVLNRCF-UHFFFAOYSA-N 1 1 304.444 3.624 20 10 DHCDMO CC[N@@H+](Cc1ccccc1O)Cc1ccc(OC)c(F)c1F ZINC001143916089 1031081199 /nfs/dbraw/zinc/08/11/99/1031081199.db2.gz PLRPCEOWEIMFEG-UHFFFAOYSA-N 1 1 307.340 3.701 20 10 DHCDMO CCOc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c1O ZINC000292864062 1031221915 /nfs/dbraw/zinc/22/19/15/1031221915.db2.gz VQVAPLNIUQYUML-GOSISDBHSA-N 1 1 312.413 3.769 20 10 DHCDMO CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1[O-] ZINC000844924112 1031403827 /nfs/dbraw/zinc/40/38/27/1031403827.db2.gz MPINBDDNGDKRCO-MRXNPFEDSA-N 1 1 322.811 3.884 20 10 DHCDMO C[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)[C@H]1C ZINC001144299932 1031440063 /nfs/dbraw/zinc/44/00/63/1031440063.db2.gz MSAOKQJMXDQYFT-ZJUUUORDSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)[C@H]1C ZINC001144299932 1031440071 /nfs/dbraw/zinc/44/00/71/1031440071.db2.gz MSAOKQJMXDQYFT-ZJUUUORDSA-N 1 1 316.214 3.914 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-])c1nccs1 ZINC000293622831 1031543832 /nfs/dbraw/zinc/54/38/32/1031543832.db2.gz MPQMWZPIGHIAAA-SECBINFHSA-N 1 1 314.813 3.877 20 10 DHCDMO C[C@H](C[N@H+](C)Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293622831 1031543836 /nfs/dbraw/zinc/54/38/36/1031543836.db2.gz MPQMWZPIGHIAAA-SECBINFHSA-N 1 1 314.813 3.877 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1cc(Cl)c(F)cc1O)c1nccs1 ZINC000293622831 1031543849 /nfs/dbraw/zinc/54/38/49/1031543849.db2.gz MPQMWZPIGHIAAA-SECBINFHSA-N 1 1 314.813 3.877 20 10 DHCDMO FC(F)[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000872254909 1031562507 /nfs/dbraw/zinc/56/25/07/1031562507.db2.gz MXYABISDLZHCKE-KRWDZBQOSA-N 1 1 324.415 3.533 20 10 DHCDMO CCOc1cccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872260076 1031563209 /nfs/dbraw/zinc/56/32/09/1031563209.db2.gz IBYBYOFFOVYSFT-KRWDZBQOSA-N 1 1 319.445 3.715 20 10 DHCDMO Oc1cccc(Cl)c1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872261441 1031563893 /nfs/dbraw/zinc/56/38/93/1031563893.db2.gz FFNHYLFDOXCWOK-CQSZACIVSA-N 1 1 309.837 3.969 20 10 DHCDMO CC(F)(F)CCC[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000929972722 1031665898 /nfs/dbraw/zinc/66/58/98/1031665898.db2.gz UBIUGIZISWCCPM-OAHLLOKOSA-N 1 1 313.388 3.809 20 10 DHCDMO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@](C)(O)c1ccccc1 ZINC000846043848 1031837183 /nfs/dbraw/zinc/83/71/83/1031837183.db2.gz LPYJRDLKKKOLFZ-DIFFPNOSSA-N 1 1 323.795 3.571 20 10 DHCDMO CSCc1cnc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000846055892 1031847334 /nfs/dbraw/zinc/84/73/34/1031847334.db2.gz ROLRERTUTJOYRX-UHFFFAOYSA-N 1 1 314.863 3.655 20 10 DHCDMO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1 ZINC000846105385 1031878312 /nfs/dbraw/zinc/87/83/12/1031878312.db2.gz TVHIVPBSWWRJFR-MAVJXHJTSA-N 1 1 306.400 3.887 20 10 DHCDMO Cc1ccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c(O)c1 ZINC000877470191 1033311202 /nfs/dbraw/zinc/31/12/02/1033311202.db2.gz FQXWGQKPIFZEFQ-CYBMUJFWSA-N 1 1 315.417 3.982 20 10 DHCDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000877468855 1033311779 /nfs/dbraw/zinc/31/17/79/1033311779.db2.gz OEOJAPJEXLWOBD-IXDOHACOSA-N 1 1 316.489 3.514 20 10 DHCDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877508909 1033330370 /nfs/dbraw/zinc/33/03/70/1033330370.db2.gz FJZOKQHLMOCDNB-OXJNMPFZSA-N 1 1 316.489 3.658 20 10 DHCDMO C[C@@H]([NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1O ZINC000877755964 1033431126 /nfs/dbraw/zinc/43/11/26/1033431126.db2.gz UZWNTZWZAQVWAO-SCTDSRPQSA-N 1 1 324.468 3.953 20 10 DHCDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3O)C2)n1 ZINC000877812517 1033462405 /nfs/dbraw/zinc/46/24/05/1033462405.db2.gz BYXYNBIULURRKI-LLVKDONJSA-N 1 1 308.834 3.800 20 10 DHCDMO Cc1csc([C@H]2CC[N@H+](Cc3ccc(N(C)C)c(F)c3)C2)n1 ZINC000877813710 1033463250 /nfs/dbraw/zinc/46/32/50/1033463250.db2.gz OEZMBOIJAOTUSF-AWEZNQCLSA-N 1 1 319.449 3.646 20 10 DHCDMO COc1cccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1O ZINC000126953723 1033610902 /nfs/dbraw/zinc/61/09/02/1033610902.db2.gz UKDKBFHZKSETRQ-HNNXBMFYSA-N 1 1 315.388 3.605 20 10 DHCDMO Cc1occc1C[N@@H+](C)Cc1c(O)cccc1Br ZINC000862231340 1033791177 /nfs/dbraw/zinc/79/11/77/1033791177.db2.gz GLWAEIYETKVLDO-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO Cc1occc1C[N@H+](C)Cc1c(O)cccc1Br ZINC000862231340 1033791191 /nfs/dbraw/zinc/79/11/91/1033791191.db2.gz GLWAEIYETKVLDO-UHFFFAOYSA-N 1 1 310.191 3.688 20 10 DHCDMO COc1ccc(N(CCCn2cc[nH+]c2C)C(C)C)cc1F ZINC000127427260 1033874090 /nfs/dbraw/zinc/87/40/90/1033874090.db2.gz RQEMSZXCGAYXOX-UHFFFAOYSA-N 1 1 305.397 3.644 20 10 DHCDMO Cc1cc(O)c(C[N@H+]2CC3(CCOCC3)[C@@H]2C(C)C)cc1Cl ZINC000826122055 1034119789 /nfs/dbraw/zinc/11/97/89/1034119789.db2.gz XJHPNZFQCOMCOT-KRWDZBQOSA-N 1 1 323.864 3.991 20 10 DHCDMO CC[C@H]([NH2+][C@@H]1CC[C@H](C)[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000863547997 1034126529 /nfs/dbraw/zinc/12/65/29/1034126529.db2.gz SZDVOEKJWHVARL-CWSCBRNRSA-N 1 1 317.260 3.880 20 10 DHCDMO C[C@@H]1CC[C@@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2O)CN1 ZINC000863546202 1034127213 /nfs/dbraw/zinc/12/72/13/1034127213.db2.gz JVCWQLCTSPOPHT-YVWKXTFCSA-N 1 1 324.468 3.796 20 10 DHCDMO Cc1cc(C[N@H+]2CC[C@H](c3nccs3)C2)ccc1N(C)C ZINC000880320870 1034294386 /nfs/dbraw/zinc/29/43/86/1034294386.db2.gz IJLGOAFFLJTKOV-HNNXBMFYSA-N 1 1 301.459 3.507 20 10 DHCDMO CC(C)[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)[C@@H](CO)C(C)C ZINC001202513124 1034319110 /nfs/dbraw/zinc/31/91/10/1034319110.db2.gz JPRPPTMMKRRKFQ-BLLLJJGKSA-N 1 1 317.832 3.563 20 10 DHCDMO COc1cc(C[N@H+]2CCC[C@@](C)(OC)C2)c(O)c(C(C)(C)C)c1 ZINC000794650935 1034330896 /nfs/dbraw/zinc/33/08/96/1034330896.db2.gz UJUXDRDRVFYNQJ-LJQANCHMSA-N 1 1 321.461 3.699 20 10 DHCDMO C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)ccc1[O-] ZINC000184936641 1034513052 /nfs/dbraw/zinc/51/30/52/1034513052.db2.gz ZSESGQIBEYHDAQ-CYBMUJFWSA-N 1 1 318.848 3.958 20 10 DHCDMO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc(F)cc1O ZINC000185104322 1034527519 /nfs/dbraw/zinc/52/75/19/1034527519.db2.gz PJCIIKWMFXDASI-CQSZACIVSA-N 1 1 314.404 3.851 20 10 DHCDMO COC1(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CCC(C)CC1 ZINC000794836069 1034592151 /nfs/dbraw/zinc/59/21/51/1034592151.db2.gz RUDGYNJJVSCOOD-JKGQDXBKSA-N 1 1 313.388 3.916 20 10 DHCDMO C[C@H]([NH2+]CCc1ccccn1)c1cc(Cl)c(Cl)cc1O ZINC000192592152 1034810394 /nfs/dbraw/zinc/81/03/94/1034810394.db2.gz WXVIOEWGBKAOMU-JTQLQIEISA-N 1 1 311.212 3.987 20 10 DHCDMO C[C@H]([NH2+]CCCn1ccnc1)c1cc(Cl)c(Cl)cc1O ZINC000192591395 1034811418 /nfs/dbraw/zinc/81/14/18/1034811418.db2.gz OWBCPRPPCDEBQH-JTQLQIEISA-N 1 1 314.216 3.636 20 10 DHCDMO C[C@@H](O)C[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192888585 1034821682 /nfs/dbraw/zinc/82/16/82/1034821682.db2.gz KGUOGFBVTCROHF-BBBLOLIVSA-N 1 1 306.233 3.757 20 10 DHCDMO CC[C@H](CCO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192944987 1034823385 /nfs/dbraw/zinc/82/33/85/1034823385.db2.gz XCUVPNHRRJBNDK-VHSXEESVSA-N 1 1 306.233 3.758 20 10 DHCDMO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ccc(N2CCCCC2)c(C)c1 ZINC001176916108 1035339728 /nfs/dbraw/zinc/33/97/28/1035339728.db2.gz SYRWGEOIHSGVPI-OALUTQOASA-N 1 1 302.462 3.595 20 10 DHCDMO Oc1c(F)cc(F)cc1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC001177122846 1035349636 /nfs/dbraw/zinc/34/96/36/1035349636.db2.gz ZXJBQLXSWLVKHI-UHFFFAOYSA-N 1 1 317.257 3.979 20 10 DHCDMO C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC001206297667 1035361079 /nfs/dbraw/zinc/36/10/79/1035361079.db2.gz ZRNXFJBXNVACRX-OAHLLOKOSA-N 1 1 317.260 3.650 20 10 DHCDMO Cc1cc(O)c(CNC[C@]2([NH+](C)C)CCC[C@H](C)C2)c(Cl)c1 ZINC001177441437 1035372550 /nfs/dbraw/zinc/37/25/50/1035372550.db2.gz ATUXQOSQDJXROU-UGSOOPFHSA-N 1 1 324.896 3.954 20 10 DHCDMO COc1ccccc1C(C)(C)C[NH2+]Cc1cc(F)cc(F)c1O ZINC001177565794 1035381183 /nfs/dbraw/zinc/38/11/83/1035381183.db2.gz IOCKRTFBZFFMOD-UHFFFAOYSA-N 1 1 321.367 3.746 20 10 DHCDMO Cn1c[nH+]c2cc(NCc3ccc(OC(F)F)c(F)c3)ccc21 ZINC001178037456 1035407516 /nfs/dbraw/zinc/40/75/16/1035407516.db2.gz KYSKWHUEGKSCPT-UHFFFAOYSA-N 1 1 321.302 3.926 20 10 DHCDMO CCN(C)c1ccc(C[N@@H+](CCOC)Cc2cccs2)cc1 ZINC000773733815 1035417761 /nfs/dbraw/zinc/41/77/61/1035417761.db2.gz NFMCOMITFCWINL-UHFFFAOYSA-N 1 1 318.486 3.853 20 10 DHCDMO Cc1cc(O)c(CN[C@@H](C)C[NH+]2CCC(C)CC2)c(Cl)c1 ZINC001179148809 1035467388 /nfs/dbraw/zinc/46/73/88/1035467388.db2.gz WDIUPFMXJVJGDB-AWEZNQCLSA-N 1 1 310.869 3.564 20 10 DHCDMO c1cc(CNC[C@H]2CC[N@@H+]2C2CCCCCC2)cc2c1OCC2 ZINC001179386948 1035476602 /nfs/dbraw/zinc/47/66/02/1035476602.db2.gz WPWDNCGPSHGMMR-LJQANCHMSA-N 1 1 314.473 3.508 20 10 DHCDMO c1cc(CNC[C@H]2CC[N@H+]2C2CCCCCC2)cc2c1OCC2 ZINC001179386948 1035476604 /nfs/dbraw/zinc/47/66/04/1035476604.db2.gz WPWDNCGPSHGMMR-LJQANCHMSA-N 1 1 314.473 3.508 20 10 DHCDMO CCN(C)c1ccc(C[NH2+][C@H](COC)c2ccc(C)o2)cc1 ZINC000773832698 1035510405 /nfs/dbraw/zinc/51/04/05/1035510405.db2.gz AOAAHKZYRBWROS-QGZVFWFLSA-N 1 1 302.418 3.521 20 10 DHCDMO CN(C)c1ccc(C[N@@H+](C[C@@H]2CCC(C)(C)O2)C2CC2)cc1 ZINC000775572909 1035572879 /nfs/dbraw/zinc/57/28/79/1035572879.db2.gz UXVFTQGEWKKSQN-SFHVURJKSA-N 1 1 302.462 3.675 20 10 DHCDMO Cc1nc([C@H]2CC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)no1 ZINC000905685802 1035612467 /nfs/dbraw/zinc/61/24/67/1035612467.db2.gz XUHMCEGPXHMSHS-AWEZNQCLSA-N 1 1 315.417 3.505 20 10 DHCDMO Cc1nc([C@@H]2CC[N@H+](Cc3cc(C(C)C)c(C)cc3O)C2)no1 ZINC000905685803 1035614000 /nfs/dbraw/zinc/61/40/00/1035614000.db2.gz XUHMCEGPXHMSHS-CQSZACIVSA-N 1 1 315.417 3.505 20 10 DHCDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC001193869888 1035762263 /nfs/dbraw/zinc/76/22/63/1035762263.db2.gz ALBXPSFKNMEIRG-IBGZPJMESA-N 1 1 304.478 3.924 20 10 DHCDMO CCC[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H](O)c1ccccc1 ZINC001181419304 1035904653 /nfs/dbraw/zinc/90/46/53/1035904653.db2.gz YVOBMYJTTBYGQK-SJLPKXTDSA-N 1 1 321.367 3.662 20 10 DHCDMO CN(Cc1cccs1)c1ccc(C[N@H+]2CC[C@H](F)C2)cc1 ZINC001181894238 1036037849 /nfs/dbraw/zinc/03/78/49/1036037849.db2.gz WQNMGLHNKUEEDB-HNNXBMFYSA-N 1 1 304.434 3.928 20 10 DHCDMO Cc1ccc(C[N@H+](C)Cc2cc(Br)cc(C)c2O)o1 ZINC000775642250 1036157892 /nfs/dbraw/zinc/15/78/92/1036157892.db2.gz IQIXKXCHRUQWFP-UHFFFAOYSA-N 1 1 324.218 3.997 20 10 DHCDMO C[C@@H]([NH2+]C[C@H](O)c1ccco1)c1cc(Cl)c(Cl)cc1O ZINC000774115007 1036157947 /nfs/dbraw/zinc/15/79/47/1036157947.db2.gz JJDFBXIYULBZEV-OQPBUACISA-N 1 1 316.184 3.676 20 10 DHCDMO COc1cc(C)cc(C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)c1O ZINC001182271605 1036162259 /nfs/dbraw/zinc/16/22/59/1036162259.db2.gz JFUOJHHFWMKXSO-AWEZNQCLSA-N 1 1 317.404 3.911 20 10 DHCDMO Cc1ccc(OCC[N@H+](C)Cc2cccc(Cl)c2[O-])cc1 ZINC000775647449 1036174610 /nfs/dbraw/zinc/17/46/10/1036174610.db2.gz WECXCDSGLHZALW-UHFFFAOYSA-N 1 1 305.805 3.865 20 10 DHCDMO CC(C)N(C)CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000774162617 1036206081 /nfs/dbraw/zinc/20/60/81/1036206081.db2.gz QMXFQKLPXKXSMW-JTQLQIEISA-N 1 1 305.249 3.690 20 10 DHCDMO CCN(CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1CC1 ZINC000774162631 1036206559 /nfs/dbraw/zinc/20/65/59/1036206559.db2.gz QWTIYOFTRTYQPT-JTQLQIEISA-N 1 1 317.260 3.834 20 10 DHCDMO Cc1cccc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1O ZINC000775649301 1036215297 /nfs/dbraw/zinc/21/52/97/1036215297.db2.gz NXHLXBAMQFFUPU-UHFFFAOYSA-N 1 1 310.441 3.931 20 10 DHCDMO C[C@H]([NH2+]CCN1CC[C@@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000774212084 1036231947 /nfs/dbraw/zinc/23/19/47/1036231947.db2.gz YGVOZKBSYWWALZ-MNOVXSKESA-N 1 1 317.260 3.691 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)c1 ZINC000775658365 1036245349 /nfs/dbraw/zinc/24/53/49/1036245349.db2.gz LIYPRYOYQBPVIY-QGZVFWFLSA-N 1 1 315.388 3.747 20 10 DHCDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)cc(O)c1O ZINC001204346725 1036387326 /nfs/dbraw/zinc/38/73/26/1036387326.db2.gz XDVLVXWIIKZPFL-LLVKDONJSA-N 1 1 321.804 3.953 20 10 DHCDMO Cc1cc(Br)cc(C[N@H+]2CC[C@@H](C3CC3)C2)c1O ZINC000775725675 1036562133 /nfs/dbraw/zinc/56/21/33/1036562133.db2.gz LHJBTVDYIFIMHQ-GFCCVEGCSA-N 1 1 310.235 3.695 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)c1 ZINC000775727011 1036573459 /nfs/dbraw/zinc/57/34/59/1036573459.db2.gz DYSSNWJNUGZTFO-CZUORRHYSA-N 1 1 301.386 3.967 20 10 DHCDMO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)c(O)cc1Br ZINC001250120619 1036644768 /nfs/dbraw/zinc/64/47/68/1036644768.db2.gz KRLFQBXXAJTXHL-CQSZACIVSA-N 1 1 316.214 3.787 20 10 DHCDMO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)c(O)cc1Br ZINC001250120619 1036644773 /nfs/dbraw/zinc/64/47/73/1036644773.db2.gz KRLFQBXXAJTXHL-CQSZACIVSA-N 1 1 316.214 3.787 20 10 DHCDMO COc1cccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1O ZINC000153507871 1036687398 /nfs/dbraw/zinc/68/73/98/1036687398.db2.gz LCWUNABKJXYZFU-INIZCTEOSA-N 1 1 301.361 3.877 20 10 DHCDMO C[C@H]([NH2+]CCCN(C)C)c1ccc(N2CCCCCC2)cc1 ZINC000151943203 1036741152 /nfs/dbraw/zinc/74/11/52/1036741152.db2.gz HXTHUVFJGUJHAZ-KRWDZBQOSA-N 1 1 303.494 3.669 20 10 DHCDMO CCC1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000774836231 1037049466 /nfs/dbraw/zinc/04/94/66/1037049466.db2.gz QTGAOMPGQPTSLL-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO CCC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000774836231 1037049483 /nfs/dbraw/zinc/04/94/83/1037049483.db2.gz QTGAOMPGQPTSLL-UHFFFAOYSA-N 1 1 322.405 3.710 20 10 DHCDMO Cc1cc(O)c(CNCC2([NH+](C)C)CCCCC2)c(Cl)c1 ZINC001198907945 1037169213 /nfs/dbraw/zinc/16/92/13/1037169213.db2.gz KDHAOWZQODKXQW-UHFFFAOYSA-N 1 1 310.869 3.708 20 10 DHCDMO COc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000776014250 1037297947 /nfs/dbraw/zinc/29/79/47/1037297947.db2.gz QQNQWGWHDSWUSP-MFKMUULPSA-N 1 1 303.324 3.564 20 10 DHCDMO CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775028993 1037435956 /nfs/dbraw/zinc/43/59/56/1037435956.db2.gz JHWCYLOVINXQFS-TZMCWYRMSA-N 1 1 322.405 3.758 20 10 DHCDMO COc1nc2ccccc2cc1CNc1ccc2c(c1)[nH+]cn2C ZINC001201114252 1037532606 /nfs/dbraw/zinc/53/26/06/1037532606.db2.gz AOBAZCSZAVDZKZ-UHFFFAOYSA-N 1 1 318.380 3.742 20 10 DHCDMO CC1([NH2+]Cc2c(O)ccc(Cl)c2F)Cc2ccccc2C1 ZINC001201512171 1037733520 /nfs/dbraw/zinc/73/35/20/1037733520.db2.gz HSBALOURHWMLPK-UHFFFAOYSA-N 1 1 305.780 3.832 20 10 DHCDMO COc1ccc(CNC[C@@H]2CCC[N@H+]2C2CCCCC2)cc1C ZINC001202185236 1038089246 /nfs/dbraw/zinc/08/92/46/1038089246.db2.gz ZZILHRWOPZNIQO-IBGZPJMESA-N 1 1 316.489 3.890 20 10 DHCDMO COc1ccc(C[NH2+]C[C@@H]2CCCN2C2CCCCC2)cc1C ZINC001202185236 1038089265 /nfs/dbraw/zinc/08/92/65/1038089265.db2.gz ZZILHRWOPZNIQO-IBGZPJMESA-N 1 1 316.489 3.890 20 10 DHCDMO COc1ccc(CNC[C@H]2CCC[N@H+]2C2CCCCC2)cc1C ZINC001202185238 1038090291 /nfs/dbraw/zinc/09/02/91/1038090291.db2.gz ZZILHRWOPZNIQO-LJQANCHMSA-N 1 1 316.489 3.890 20 10 DHCDMO COc1ccc(C[NH2+]C[C@H]2CCCN2C2CCCCC2)cc1C ZINC001202185238 1038090299 /nfs/dbraw/zinc/09/02/99/1038090299.db2.gz ZZILHRWOPZNIQO-LJQANCHMSA-N 1 1 316.489 3.890 20 10 DHCDMO CCn1nccc1C[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000156779689 1038284863 /nfs/dbraw/zinc/28/48/63/1038284863.db2.gz XBTZKWOOTRHNQO-UHFFFAOYSA-N 1 1 313.445 3.944 20 10 DHCDMO Cc1cccc(CC[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC001190436966 1038315685 /nfs/dbraw/zinc/31/56/85/1038315685.db2.gz PTFPEPKHHZKLCZ-UHFFFAOYSA-N 1 1 311.473 3.909 20 10 DHCDMO CC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775493442 1038576449 /nfs/dbraw/zinc/57/64/49/1038576449.db2.gz SJPXIBCBTQOIMW-BBRMVZONSA-N 1 1 310.869 3.818 20 10 DHCDMO CC[C@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1cc(Cl)ccc1[O-] ZINC000775493443 1038577267 /nfs/dbraw/zinc/57/72/67/1038577267.db2.gz SJPXIBCBTQOIMW-CJNGLKHVSA-N 1 1 310.869 3.818 20 10 DHCDMO Cc1cc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)ccc1N(C)C ZINC001192262379 1038616269 /nfs/dbraw/zinc/61/62/69/1038616269.db2.gz WBGFHOZRUKXYSQ-UHFFFAOYSA-N 1 1 320.477 3.613 20 10 DHCDMO Cc1cc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)ccc1N(C)C ZINC001192262379 1038616355 /nfs/dbraw/zinc/61/63/55/1038616355.db2.gz WBGFHOZRUKXYSQ-UHFFFAOYSA-N 1 1 320.477 3.613 20 10 DHCDMO CCC[N@@H+](Cc1nc(-c2ccccc2)no1)Cc1ccccc1O ZINC000170779311 1038959375 /nfs/dbraw/zinc/95/93/75/1038959375.db2.gz JGKIUDRFEVZLRE-UHFFFAOYSA-N 1 1 323.396 3.854 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1O)c1ccc2c(c1)OCO2 ZINC000170789156 1038965185 /nfs/dbraw/zinc/96/51/85/1038965185.db2.gz WSSOPQGOZRNMKS-QWRGUYRKSA-N 1 1 303.333 3.672 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(O)c1C ZINC000760899127 1039040760 /nfs/dbraw/zinc/04/07/60/1039040760.db2.gz XDAKZRVPHDWTSK-MRXNPFEDSA-N 1 1 304.478 3.782 20 10 DHCDMO C[C@H](C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000172097105 1039739380 /nfs/dbraw/zinc/73/93/80/1039739380.db2.gz JJXMFVRVYJTHDF-GOSISDBHSA-N 1 1 324.468 3.759 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000173011085 1040133781 /nfs/dbraw/zinc/13/37/81/1040133781.db2.gz OXEQLPPVIUZTCG-NSHDSACASA-N 1 1 319.298 3.508 20 10 DHCDMO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC000173011085 1040133786 /nfs/dbraw/zinc/13/37/86/1040133786.db2.gz OXEQLPPVIUZTCG-NSHDSACASA-N 1 1 319.298 3.508 20 10 DHCDMO COc1cc(Cl)cc(C[N@@H+]2CCc3cccc(F)c3C2)c1O ZINC000761201284 1040574082 /nfs/dbraw/zinc/57/40/82/1040574082.db2.gz GEUHNTZEYFYXDR-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO COc1cc(Cl)cc(C[N@H+]2CCc3cccc(F)c3C2)c1O ZINC000761201284 1040574095 /nfs/dbraw/zinc/57/40/95/1040574095.db2.gz GEUHNTZEYFYXDR-UHFFFAOYSA-N 1 1 321.779 3.752 20 10 DHCDMO Cc1ccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)c(O)c1C ZINC000273525904 130131925 /nfs/dbraw/zinc/13/19/25/130131925.db2.gz VCLLMCATTRIGHI-WBMJQRKESA-N 1 1 321.367 3.671 20 10 DHCDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1O ZINC000273533388 130134065 /nfs/dbraw/zinc/13/40/65/130134065.db2.gz WVRSSGFZYVQJJB-QWRGUYRKSA-N 1 1 304.321 3.851 20 10 DHCDMO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)n(C)n1 ZINC000284385492 131076097 /nfs/dbraw/zinc/07/60/97/131076097.db2.gz OYISLDYCXUQTOX-VIFPVBQESA-N 1 1 314.216 3.592 20 10 DHCDMO CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(F)cc1[O-] ZINC000286251329 131226534 /nfs/dbraw/zinc/22/65/34/131226534.db2.gz UKZUGAHAUFFCIU-INIZCTEOSA-N 1 1 305.397 3.557 20 10 DHCDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCC(C)CC3)cc2)c2nccn21 ZINC000297908971 132039903 /nfs/dbraw/zinc/03/99/03/132039903.db2.gz WMPFUBOBCBXADM-LPHOPBHVSA-N 1 1 324.472 3.915 20 10 DHCDMO Cc1nn(C)c(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000299541477 132110074 /nfs/dbraw/zinc/11/00/74/132110074.db2.gz AEHAAGRZIVAORS-UHFFFAOYSA-N 1 1 314.477 3.514 20 10 DHCDMO C[C@H](NC1CC[NH+](C(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000119860562 333261225 /nfs/dbraw/zinc/26/12/25/333261225.db2.gz UTRVGQWRZWGVKW-HNNXBMFYSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000119860562 333261226 /nfs/dbraw/zinc/26/12/26/333261226.db2.gz UTRVGQWRZWGVKW-HNNXBMFYSA-N 1 1 303.494 3.666 20 10 DHCDMO C[C@@H](CCCO)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000296603851 335145211 /nfs/dbraw/zinc/14/52/11/335145211.db2.gz VUBRYISNAHBVKN-UWVGGRQHSA-N 1 1 306.233 3.758 20 10 DHCDMO CO[C@]1(C)CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294652430 334211725 /nfs/dbraw/zinc/21/17/25/334211725.db2.gz KWFBYJXYQWZQRT-OAHLLOKOSA-N 1 1 301.789 3.576 20 10 DHCDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294652430 334211726 /nfs/dbraw/zinc/21/17/26/334211726.db2.gz KWFBYJXYQWZQRT-OAHLLOKOSA-N 1 1 301.789 3.576 20 10 DHCDMO COC1CCN(c2ccc(C[N@@H+](C)[C@H](C)C3(C)CC3)cc2)CC1 ZINC000295079396 334217605 /nfs/dbraw/zinc/21/76/05/334217605.db2.gz RAOAFDQGWLRBSX-MRXNPFEDSA-N 1 1 316.489 3.922 20 10 DHCDMO COc1ccc(N2CCC(Nc3cc[nH+]cc3Cl)CC2)cc1 ZINC000301574818 336315940 /nfs/dbraw/zinc/31/59/40/336315940.db2.gz LVLYKHIAWYQKAR-UHFFFAOYSA-N 1 1 317.820 3.825 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000375256592 337006641 /nfs/dbraw/zinc/00/66/41/337006641.db2.gz SUJQRTGGXMKBLT-UYAOXDASSA-N 1 1 309.409 3.975 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1CCc2cnc(C(C)C)nc2C1 ZINC000375343951 337008523 /nfs/dbraw/zinc/00/85/23/337008523.db2.gz ZYODFCFYINNICQ-QGZVFWFLSA-N 1 1 311.429 3.815 20 10 DHCDMO CC[C@H](c1ccccc1O)[N@H+]1C[C@@H](CC)O[C@]2(CCCOC2)C1 ZINC000377697534 337059069 /nfs/dbraw/zinc/05/90/69/337059069.db2.gz NPQSZUCXRLMYQA-SZVBFZGTSA-N 1 1 319.445 3.503 20 10 DHCDMO Cc1nnc([C@@H]([NH2+][C@H](C)c2cc(C)ccc2O)c2ccccc2)[nH]1 ZINC000185324279 337205138 /nfs/dbraw/zinc/20/51/38/337205138.db2.gz PHTWMGYRCBXIHW-ACJLOTCBSA-N 1 1 322.412 3.567 20 10 DHCDMO Cc1n[nH]c(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000271063459 518192209 /nfs/dbraw/zinc/19/22/09/518192209.db2.gz HWQSNQQMGXNYDV-UHFFFAOYSA-N 1 1 300.450 3.503 20 10 DHCDMO COc1cc(O)c(C[N@@H+](Cc2ccccc2)C2CC2)cc1OC ZINC000159652440 522773467 /nfs/dbraw/zinc/77/34/67/522773467.db2.gz FBFBSMVHNMEBNR-UHFFFAOYSA-N 1 1 313.397 3.574 20 10 DHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000156389153 523155945 /nfs/dbraw/zinc/15/59/45/523155945.db2.gz QJKRWEJDFVNQER-LZQZEXGQSA-N 1 1 311.425 3.791 20 10 DHCDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2C(=O)Nc2ccc(N)cc2)c1 ZINC000364886442 524388452 /nfs/dbraw/zinc/38/84/52/524388452.db2.gz SENNNQSPRWJZPD-LJQANCHMSA-N 1 1 323.440 3.570 20 10 DHCDMO Cc1cccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c1O ZINC000180471797 524403643 /nfs/dbraw/zinc/40/36/43/524403643.db2.gz ULZZCGOPXCBEHB-GOSISDBHSA-N 1 1 311.425 3.739 20 10 DHCDMO C[C@H]1[N@H+](Cc2c(O)ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780831 525004214 /nfs/dbraw/zinc/00/42/14/525004214.db2.gz XFXBLFRYSAXMMC-LLVKDONJSA-N 1 1 313.800 3.576 20 10 DHCDMO C[C@H]1[N@@H+](Cc2c(O)ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780831 525004225 /nfs/dbraw/zinc/00/42/25/525004225.db2.gz XFXBLFRYSAXMMC-LLVKDONJSA-N 1 1 313.800 3.576 20 10 DHCDMO CC(C)[N@H+](Cc1ncc(Cl)n1C)Cc1ccc(N(C)C)cc1 ZINC000298725005 535122647 /nfs/dbraw/zinc/12/26/47/535122647.db2.gz QFHQPBYQYWXMML-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO CC(C)[N@@H+](Cc1ncc(Cl)n1C)Cc1ccc(N(C)C)cc1 ZINC000298725005 535122655 /nfs/dbraw/zinc/12/26/55/535122655.db2.gz QFHQPBYQYWXMML-UHFFFAOYSA-N 1 1 320.868 3.550 20 10 DHCDMO CC[C@@H]([NH2+]Cc1cccc(OC)c1OC)c1ccc(F)cc1O ZINC000285989054 535806222 /nfs/dbraw/zinc/80/62/22/535806222.db2.gz IAELLDKUYKPZOO-OAHLLOKOSA-N 1 1 319.376 3.789 20 10 DHCDMO CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319334 535912500 /nfs/dbraw/zinc/91/25/00/535912500.db2.gz DIEPMFUUKGWGBT-WBMJQRKESA-N 1 1 308.853 3.571 20 10 DHCDMO