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367 SMILES Strings for Leucyl-cystinyl aminopeptidase

Compound NameSMILES String
BDBM23971 CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O
BDBM85550 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50008434 CC(C)C[C@H](N)C(=O)CC(Cc1ccccc1)C(O)=O
BDBM50017484 CC(CC(=O)[C@@H](N)CCCCN)C(O)=O
BDBM50017470 CC(C)CCNC(=O)C(CC(C)C)NC(=O)C(CC(O)C(N)CC(C)C)Cc1ccccc1
BDBM50017472 CC(C)CCNC(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](N)CC(C)C)Cc1ccccc1)C(C)C
BDBM50017473 CC(C)CC(N)C(=O)CC(C)C(O)=O
BDBM50017476 NCCCC[C@H](N)C(=O)CC(Cc1ccccc1)C(O)=O
BDBM50017477 CC(C)CCNC(=O)[C@@H](NC(=O)[C@H](C)CC(=O)[C@@H](N)CC(C)C)C(C)C
BDBM50017478 CC(C)C[C@@H](N)[C@H](O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(O)=O
BDBM50017479 CC(CC(=O)[C@@H](N)CCCCN)C(=O)NC(Cc1ccccc1)C(O)=O
BDBM50017483 CC(C)CCNC(=O)[C@@H](NC(=O)[C@H](CC(=O)[C@@H](N)CC(C)C)Cc1ccccc1)C(C)C
BDBM50047222 CCC(C)C(NC(=O)[C@@H](CC(=O)NO)Cc1ccccc1)C(=O)NC(C(C)C)C(O)=O
BDBM50046314 N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)C(=O)OCc1ccccc1
BDBM50046316 N[C@H](CS)Cc1ccc(OCc2ccccc2)cc1
BDBM50046321 N[C@@H](Cc1ccc(OCc2ccccc2)cc1)[C@H](O)C(=O)OCc1ccccc1
BDBM50046329 COC(=O)C(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1
BDBM50242870 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H]([C@H](C)CC)C(=O)NCc1ccccc1C(O)=O |r|
BDBM50242871 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H]([C@H](C)CC)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50242872 CC[C@@H](C)[C@H](NC(=O)c1cc(N)cc(Cc2ccc(O)cc2)c1)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50242938 CC(C)[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50243085 Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)NCc1ccccc1CC(O)=O
BDBM50243086 CC[C@@H](C)[C@H](NC(=O)c1cc(Cc2ccc(O)cc2)cc(NC(=O)[C@@H](N)C(C)C)c1)C(O)=O |r|
BDBM50242861 CC[C@H](C)[C@H](NC(=O)c1cc(Cc2ccc(O)cc2)cc(NC(=O)[C@@H](N)C(C)C)c1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50242862 CC(C)[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N1CCC[C@H]1C(=O)NCc1ccccc1C(O)=O |r|
BDBM50242863 CC(C)[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N1CCC[C@H]1C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50242864 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N1CCC[C@H]1C(=O)NCc1ccccc1C(O)=O |r|
BDBM50242865 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N1CCC[C@H]1C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50242866 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H](CC(C)C)C(=O)NCc1ccccc1C(O)=O |r|
BDBM50242867 CCCC[C@H](N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H](CC(C)C)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50242868 CC[C@@H](C)[C@H](NC(=O)c1cc(Cc2ccc(O)cc2)cc(NC(=O)[C@@H](N)C(C)C)c1)C(=O)NCc1ccccc1C(O)=O |r|
BDBM50242869 CC[C@@H](C)[C@H](NC(=O)c1cc(Cc2ccc(O)cc2)cc(NC(=O)[C@@H](N)C(C)C)c1)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331035 CC[C@H](C)[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50331036 N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50331037 N[C@@H]1CCSSCC[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50331038 N[C@@H]1CCSSCC[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331039 N[C@H]1CCSSCC[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331040 N[C@H]1CCSSCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1 |r|
BDBM50331041 CNC(=O)[C@@H]1CCSSCC[C@H](N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1 |r|
BDBM50331042 N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331043 N[C@H]1CCSSC[C@@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331044 N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1 |r|
BDBM50331045 N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1cccnc1 |r|
BDBM50331046 N[C@H]1CCSSCC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331047 N[C@H]1CCSSCC[C@@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50331048 CCOC(=O)C1=C(NC(C)=O)Oc2cc(O)ccc2C1c1cnc2ccccc2c1 |c:5|
BDBM50346448 N[C@H]1CC\C=C\CC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r,t:4|
BDBM50346449 N[C@H]1CC\C=C/CC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)NCc1ccccc1 |r,c:4|
BDBM50346450 N[C@H]1CC\C=C\CC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)NCc1ccccc1 |r,t:4|
BDBM50346451 N[C@H]1CC\C=C\CC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r,t:4|
BDBM50346452 N[C@H]1CCC=CCN[C@@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r,w:5.5|
BDBM50346453 N[C@H]1CCCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50346454 CN1[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](C\C=C/CCCC[C@H](N)C1=O)C(=O)NCc1ccccc1 |r,c:17|
BDBM50346455 N[C@H]1CCCC\C=C\C[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r,t:6|
BDBM50346456 N[C@H]1CC\C=C/CC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r,c:4|
BDBM50346457 CN1[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](C\C=C\CCCC[C@H](N)C1=O)C(=O)NCc1ccccc1 |r,t:17|
BDBM50346458 N[C@H]1CCCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1 |r|
BDBM50346459 CN1[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CC\C=C/CCC[C@H](N)C1=O)C(=O)NCc1ccccc1 |r,c:18|
BDBM50346460 CN1[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CC\C=C\CCC[C@H](N)C1=O)C(=O)NCc1ccccc1 |r,t:18|
BDBM50346461 N[C@H]1CCCCCCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r|
BDBM50405948 CC(C)C[C@@H](N)C(=O)CC(Cc1ccccc1)C(O)=O |r|
BDBM50415626 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H]1Cc2c(CN(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)C1=O)[nH]c1ccccc21 |r|
BDBM50415627 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N[C@@H](Cc2ccccc2)C(O)=O)C1=O |r|
BDBM50415628 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CN)C(C)C)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N[C@@H](Cc2ccccc2)C(O)=O)C1=O |r|
BDBM50415629 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CN)C(C)C)C(=O)N[C@H]1Cc2c(CN(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)C1=O)[nH]c1ccccc21 |r|
BDBM50415630 CCCC[C@@H](N)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)N[C@@H](Cc2ccccc2)C(O)=O)C1=O |r|
BDBM50415631 CCCC[C@@H](N)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]1Cc2c(CN(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)C1=O)[nH]c1ccccc21 |r|
BDBM50415632 CCCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50415633 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CN)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(O)=O)Cc1ccccc1 |r|
BDBM50415634 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CN)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50415635 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N1Cc2[nH]cnc2C[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50415636 CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM50449018 CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccccc1C#N
BDBM50449019 CCOC(=O)C1C(c2ccccc2)c2ccc(O)cc2OC1=N
BDBM50449020 CN(C)c1ccc(cc1)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449022 COc1cc(cc(OC)c1OC)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449023 COc1cc(OC)cc(c1)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449024 COc1cccc(c1)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449025 COc1ccc(cc1)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449026 CCOC(=O)C1=C(NC(C)=O)Oc2cc(O)ccc2C1c1cccnc1 |c:5|
BDBM50449027 CCOC(=O)C1C(c2cccnc2)c2cccc(O)c2OC1=N
BDBM50449028 CCOC(=O)C1C(c2cccnc2)c2cc(Cl)c(O)cc2OC1=N
BDBM50449029 Oc1ccc2C(C(C(=O)OCc3ccccc3)C(=N)Oc2c1)c1cccnc1
BDBM50449030 COCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449031 CC(C)(C)OC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449032 CCCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449033 CCCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449034 COC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449021 Oc1ccc2C(C(C#N)C(=N)Oc2c1)c1cccnc1
BDBM50448996 Oc1cccc(c1)C1[C-](C#N)C(=[NH2+])Oc2cc(ccc12)[N+]([O-])=O
BDBM50448997 CCOC(=O)C1C(c2ccc(OC)c(OC)c2)c2ccc(O)cc2OC1=N
BDBM50448998 CCOC(=O)C1C(c2ccc(cc2)N(C)C)c2ccc(O)cc2OC1=N
BDBM50448999 CCOC(=O)[C-]1C(c2ccc(cc2)[N+]([O-])=O)c2ccc(O)cc2OC1=[NH2+]
BDBM50449000 CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccnc2ccccc12
BDBM50449001 CCOC(=O)C1C(c2ccncc2)c2ccc(O)cc2OC1=N
BDBM50449002 CCOC(=O)C1C(c2ccc(cc2)C#N)c2ccc(O)cc2OC1=N
BDBM50449003 CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1c(Cl)ccnc1Cl
BDBM50449004 CCOC(=O)C1C(c2cccc(c2)C#N)c2ccc(O)cc2OC1=N
BDBM50449005 CCOC(=O)C1C(c2cccc(Cl)c2)c2ccc(O)cc2OC1=N
BDBM50449006 CCOC(=O)C1C(c2ccc(O)cc2OC1=N)c1ccccc1[N+]([O-])=O
BDBM50449007 CCOC(=O)C1C(c2cc3ccccc3cn2)c2ccc(O)cc2OC1=N
BDBM50449008 CCOC(=O)C1C(c2ccccn2)c2ccc(O)cc2OC1=N
BDBM50449009 COc1ccc(cc1OC)C1C(C#N)C(=N)Oc2cc(O)ccc12
BDBM50449010 CCOC(=O)C1C(c2cnc3ccccc3c2)c2ccc(O)cc2OC1=N
BDBM50449011 CCOC(=O)C1C(c2cccnc2)c2ccc(O)cc2OC1=N
BDBM50449012 CCOC(=O)C1C(c2cccnc2)c2c(OC1=N)ccc1ccccc21
BDBM50449013 CCOC(=O)C1C(c2cccnc2)c2ccc3ccccc3c2OC1=N
BDBM50449014 CCOC(=O)C1C(c2ccc(cc2)-c2ccccn2)c2ccc(O)cc2OC1=N
BDBM50449015 CCOC(=O)C1C(c2ccc(Cl)cc2)c2ccc(O)cc2OC1=N
BDBM50449016 CCOC(=O)C1C(c2ccc(Br)cc2)c2ccc(O)cc2OC1=N
BDBM50449017 CCOC(=O)C1C(c2ccc(C)cc2)c2ccc(O)cc2OC1=N
BDBM50439348 N[C@@H](CCc1ccccc1)C(=O)Nc1cc(ccc1N)C(O)=O |r|
BDBM50439349 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1 |r|
BDBM50439350 N[C@@H](CCc1ccccc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50439351 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1 |r|
BDBM50439352 [#6]-[#8]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-c1ccc(-[#7])c(-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-c2ccccc2)c1 |r|
BDBM50439353 NCCCC[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(O)=O |r|
BDBM50439354 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1 |r|
BDBM50439355 COC(=O)[C@@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)[C@@H](C)O |r|
BDBM50439356 CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(O)=O |r|
BDBM50439357 CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(=O)OCc1ccccc1 |r|
BDBM50439358 COC(=O)[C@H](C)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1 |r|
BDBM50077132 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(NC(=O)[C@@H](N)CC(C)C)c(N)c1 |r|
BDBM50077133 Clc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(c1)-c1nnn[nH]1
BDBM50076745 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1 |r|
BDBM50076796 N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(O)=O |r|
BDBM50076814 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)OC |r|
BDBM50076816 N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(ccc1N)C(O)=O |r|
BDBM50076817 NCCCC[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccccc2)c1)C(O)=O |r|
BDBM50076850 NCCCC[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1)C(O)=O |r|
BDBM50076955 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(O)cc2)c1 |r|
BDBM50076956 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(OCc3ccccc3)cc2)c1 |r|
BDBM50076958 CC(C)C[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCCN)C(O)=O |r|
BDBM50076962 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCCN)C(=O)OC |r|
BDBM50076965 CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1)C(=O)OCc1ccccc1 |r|
BDBM50076966 CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1)C(O)=O |r|
BDBM50076968 COC(=O)[C@@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1)[C@@H](C)O |r|
BDBM50076969 N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50076971 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCCNC(N)=N)c1 |r|
BDBM50076972 N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50076974 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(N)c1 |r|
BDBM50076975 Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50076977 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1 |r|
BDBM50076978 N[C@@H](CCc1ccccc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50076980 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c(N)c1 |r|
BDBM50076981 N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50076983 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c(N)c1 |r|
BDBM50076984 N[C@@H](CCc1ccc(O)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077016 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](C(C)C)C(=O)OCc1ccccc1 |r|
BDBM50077017 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC |r|
BDBM50077019 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077020 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)CCCNC(N)=N)c(N)c1 |r|
BDBM50077021 N[C@@H](CCCNC(N)=N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077022 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(O)cc2)c1 |r|
BDBM50077023 N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077024 N[C@@H](CCc1ccc(OCc2ccccc2)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50077025 N[C@@H](CCc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077026 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](C(C)C)C(=O)OCc1ccccc1 |r|
BDBM50077027 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC |r|
BDBM50077028 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50077029 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077031 CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCCNC(N)=N)c1)C(O)=O |r|
BDBM50077069 COC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c(N)c1 |r|
BDBM50077103 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)OC |r|
BDBM50077106 COC(=O)c1ccc(NC(=O)[C@@H](N)CCCNC(N)=N)c(N)c1 |r|
BDBM50077118 CC(C)[C@H](NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1)C(=O)OCc1ccccc1 |r|
BDBM50077119 CC(C)[C@H](NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1)C(O)=O |r|
BDBM50077120 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(OCc3ccccc3)cc2)c(N)c1 |r|
BDBM50077121 N[C@@H](CCc1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50077122 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM50077123 COC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(OCc3ccccc3)cc2)c(N)c1 |r|
BDBM50077124 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(N)c1 |r|
BDBM50077125 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1 |r|
BDBM50077126 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](CCCCN)C(=O)OC |r|
BDBM50077128 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(OCc3ccccc3)cc2)c1 |r|
BDBM50077131 NCCC[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(O)=O |r|
BDBM50076744 CC(C)C[C@H](CP(O)(=O)[C@@H](N)CCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|
BDBM50076815 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCCNC(N)=N)c1 |r|
BDBM50076967 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1 |r|
BDBM50076970 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)OC |r|
BDBM50076976 COC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(N)c(N)c1 |r|
BDBM50076979 COC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1 |r|
BDBM50076982 N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
BDBM50077015 CC(C)C[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50077018 CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM50077030 CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM50077127 COC(=O)[C@H](CCCCN)NC(=O)c1ccc(NC(=O)[C@@H](N)CCCNC(N)=N)c(N)c1 |r|
BDBM50077129 N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1cc(ccc1N)C(O)=O |r|
BDBM50077130 COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(OCc3ccccc3)cc2)c1 |r|
BDBM50076973 COC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1 |r|
BDBM50077116 Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
BDBM284931 CSC[C@H](N)[C@@]1(Cc2nccc3oc(CCC4CC4)cc23)OC(C)(C)OC1=O |r|
BDBM284932 COC(=O)[C@@](O)(Cc1nccc2oc(CCC3CC3)cc12)[C@@H](N)CSC |r|
BDBM284933 CSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(N)=O |r|
BDBM284934 CCC(O)CCc1cc2c(C[C@@](O)([C@@H](N)CSC)C(O)=O)nccc2o1 |r|
BDBM284935 CCC(Cl)CCc1cc2c(C[C@@](O)([C@@H](N)CSC)C(O)=O)nccc2o1 |r|
BDBM284936 CCCCc1cc2c(C[C@@](O)([C@@H](N)CSC)C(O)=O)nccc2s1 |r|
BDBM284937 CSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC(C)C)cc12)C(O)=O |r|
BDBM284938 CCSC[C@H](N)[C@](O)(Cc1nccc2oc(CC)c(CC)c12)C(O)=O |r|
BDBM271247 CC(C)C[C@H](N)[C@](O)(Cc1cc2OCCOc2cn1)C(O)=O |r|
BDBM271248 CC(C)C[C@@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,16.16,wD:13.12,6.6,4.4,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-4.31,-.98,;-2.77,.56,)|
BDBM271249 N[C@H]1COCCCCCCCCCCCOc2ccnc(C[C@]1(O)C(O)=O)c2 |r|
BDBM271250 CC(C)C[C@H](N)[C@](O)(Cc1cc(Oc2ccc(Br)cc2)ccn1)C(O)=O |r|
BDBM271251 CC(C)CC[C@H](N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271252 [#7]-[#6@@H](\[#6]=[#6]-1\[#6]-[#6]-[#8]-[#6]-[#6]-1)[C@]([#8])([#6]-c1cc(-[#8]-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)ccn1)[#6](-[#8])=O |r|
BDBM271253 N[C@@H](c1ccc(Br)cc1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271254 COCCCOc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM284939 N[C@@H](CSCC1CCC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284940 N[C@@H](CSC1CCC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284941 CCCSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284942 N[C@@H](CCC1CCC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284943 N[C@@H](CCCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284944 N[C@@H](CCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284945 N[C@@H](COCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284946 N[C@@H](COCCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM271255 N[C@@H](COc1cccc(Br)c1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271256 N[C@@H](COc1ccccc1Br)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271257 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCC(C)(C)C)c(C)cn1)C(O)=O |r|
BDBM271258 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)c(C)cn1)C(O)=O |r,wU:6.7,4.4,16.16,wD:13.12,6.6,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;4.67,,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-4.31,-.98,;-2,.36,)|
BDBM271259 N[C@@H](COCCC(F)(F)F)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271260 COCCCCC[C@H](N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271261 CCC(CC)CC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM284947 CS(=O)(=O)C[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284948 CS(=O)C[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284949 CSC[C@H](N)[C@](O)(Cc1nccc2OC(CCC3CC3)Cc12)C(O)=O |r|
BDBM284950 CSC[C@@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284951 N[C@@H](CSCCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284952 CC(C)CSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284953 N[C@@H](CSCC1CC1)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284954 CCCCc1cc2c(C[C@@](O)([C@@H](N)CSC)C(O)=O)ncc(C)c2o1 |r|
BDBM271262 Cc1ccc(OC[C@H](N)[C@](O)(Cc2cc(OC3CCCCC3)ccn2)C(O)=O)nc1 |r|
BDBM271263 N[C@@H](COc1ccc(cn1)C(F)(F)F)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271264 N[C@@H](COC1CCCCC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271265 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COc2cnccn2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(8.67,4.62,;7.34,3.85,;7.34,2.31,;6,1.54,;4.67,2.31,;4.67,3.85,;6,4.62,;3.33,1.54,;3.33,,;4.67,-.77,;4.67,-2.31,;3.33,-3.08,;2,-2.31,;.67,-3.08,;-.67,-2.31,;.1,-.98,;-2,-3.08,;-2,-4.62,;-3.33,-2.31,;-4.67,-3.08,;-6,-2.31,;-7.34,-3.08,;-8.67,-2.31,;-8.67,-.77,;-7.34,,;-6,-.77,;-1.44,-.98,;-2.98,-.98,;-.67,.36,;2,-.77,)|
BDBM271266 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COc2cnn(C)c2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(9.26,4.62,;7.93,3.85,;7.93,2.31,;6.6,1.54,;5.26,2.31,;5.26,3.85,;6.6,4.62,;3.93,1.54,;3.93,,;5.26,-.77,;5.26,-2.31,;3.93,-3.08,;2.6,-2.31,;1.26,-3.08,;-.07,-2.31,;.7,-.98,;-1.41,-3.08,;-1.41,-4.62,;-2.74,-2.31,;-4.07,-3.08,;-5.41,-2.31,;-5.41,-.77,;-6.87,-.29,;-7.78,-1.54,;-9.26,-1.94,;-6.87,-2.79,;-.84,-.98,;-2.38,-.98,;-.07,.36,;2.6,-.77,)|
BDBM271267 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@H](C)CC2CC2)ccn1)C(O)=O |r|
BDBM271268 CC(C)C[C@H](N)[C@](O)(Cc1nccc2OC(CCC3CC3)Cc12)C(O)=O |r|
BDBM284955 CSC[C@H](N)[C@](O)(Cc1nccc2oc(cc12)C1CCCC1)C(O)=O |r|
BDBM271269 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COc2ccc(F)cn2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(9.34,4.62,;8,3.85,;8,2.31,;6.67,1.54,;5.33,2.31,;5.33,3.85,;6.67,4.62,;4,1.54,;4,,;5.33,-.77,;5.33,-2.31,;4,-3.08,;2.67,-2.31,;1.33,-3.08,;,-2.31,;.77,-.98,;-1.33,-3.08,;-1.33,-4.62,;-2.67,-2.31,;-4,-3.08,;-5.33,-2.31,;-5.33,-.77,;-6.67,,;-8,-.77,;-9.34,,;-8,-2.31,;-6.67,-3.08,;-.77,-.98,;,.36,;-2.31,-.98,;2.67,-.77,)|
BDBM271270 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)Cn2cccn2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(7.85,4.86,;6.52,4.09,;6.52,2.55,;5.19,1.78,;3.85,2.55,;3.85,4.09,;5.19,4.86,;2.52,1.78,;2.52,.24,;3.85,-.53,;3.85,-2.07,;2.52,-2.84,;1.18,-2.07,;-.15,-2.84,;-1.48,-2.07,;-.71,-.74,;-2.82,-2.84,;-2.82,-4.38,;-4.15,-2.07,;-5.48,-2.84,;-5.48,-4.38,;-6.95,-4.86,;-7.85,-3.61,;-6.95,-2.37,;-2.25,-.74,;-3.79,-.74,;-1.48,.6,;1.18,-.53,)|
BDBM271271 CC(C)COCC[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:9.10,7.7,19.19,wD:16.15,9.9,(-9.34,-3.08,;-8,-2.31,;-8,-.77,;-6.67,-3.08,;-5.33,-2.31,;-4,-3.08,;-2.67,-2.31,;-1.33,-3.08,;-1.33,-4.62,;,-2.31,;.77,-.98,;1.33,-3.08,;2.67,-2.31,;2.67,-.77,;4,,;4,1.54,;5.33,2.31,;6.67,1.54,;8,2.31,;8,3.85,;9.34,4.62,;6.67,4.62,;5.33,3.85,;5.33,-.77,;5.33,-2.31,;4,-3.08,;-.77,-.98,;-2.31,-.98,;,.36,)|
BDBM271272 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCN(CC2)C(=O)OCc2ccccc2)ccn1)C(O)=O |r|
BDBM271273 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COCCC=C)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(9.34,4.62,;8,3.85,;8,2.31,;6.67,1.54,;5.33,2.31,;5.33,3.85,;6.67,4.62,;4,1.54,;4,,;5.33,-.77,;5.33,-2.31,;4,-3.08,;2.67,-2.31,;1.33,-3.08,;,-2.31,;.77,-.98,;-1.33,-3.08,;-1.33,-4.62,;-2.67,-2.31,;-4,-3.08,;-5.33,-2.31,;-6.67,-3.08,;-8,-2.31,;-9.34,-3.08,;-.77,-.98,;,.36,;-2.31,-.98,;2.67,-.77,)|
BDBM271274 N[C@@H](COc1ccc(F)cc1)[C@](O)(Cc1cc(ccn1)N1CCc2ccccc2C1)C(O)=O |r|
BDBM271275 CC(C)C[C@H](N)[C@](O)(Cc1cc(ccn1)N1CCC(C)(C)CC1)C(O)=O |r|
BDBM271276 N[C@@H](COc1ccc(F)cc1)[C@](O)(Cc1cc(NC2CCCCC2)ccn1)C(O)=O |r|
BDBM271277 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@H](C)Cc2ccccc2)ccn1)C(O)=O |r|
BDBM271278 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCc2ccccc2OC(F)(F)F)ccn1)C(O)=O |r|
BDBM271279 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCc2ccccc2Cl)ccn1)C(O)=O |r|
BDBM271280 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCc2ccsc2)ccn1)C(O)=O |r|
BDBM271281 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCOc2ccccc2)ccn1)C(O)=O |r|
BDBM271282 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCOC2CCCCC2)ccn1)C(O)=O |r|
BDBM271283 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCOCc2ccccc2)ccn1)C(O)=O |r|
BDBM271284 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCN2CCCCC2)ccn1)C(O)=O |r|
BDBM271285 CCCCCCOc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271286 COc1cccc(Oc2ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c2)c1 |r|
BDBM271287 N[C@@H](COc1ccc(F)cc1)[C@](O)(Cc1cc(ccn1)N(CC(F)(F)F)C1CCCCC1)C(O)=O |r|
BDBM271288 CSC[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:5.6,3.3,15.15,wD:12.11,5.5,(-7.34,-2.31,;-6,-3.08,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-4.26,-1.37,;-2,.36,)|
BDBM271289 CCCC[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)CSCC(C)C)C(O)=O)c1 |r|
BDBM271290 CCSC[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,4.4,16.16,wD:13.12,6.6,(-8,-3.08,;-6.67,-2.31,;-5.33,-3.08,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-2.31,;-.56,-.98,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;4,3.85,;4,-.77,;4,-2.31,;2.67,-3.08,;-2.1,-.98,;-3.59,-1.37,;-1.33,.36,)|
BDBM271291 CC(C)SC[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:7.8,5.5,17.17,wD:14.13,7.7,(-8,-3.08,;-6.67,-2.31,;-6.67,-.77,;-5.33,-3.08,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-2.31,;-.56,-.98,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;4,3.85,;4,-.77,;4,-2.31,;2.67,-3.08,;-2.1,-.98,;-1.33,.36,;-3.59,-1.37,)|
BDBM271292 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CSC2CCC2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(8.28,4.62,;6.94,3.85,;6.94,2.31,;5.61,1.54,;4.28,2.31,;4.28,3.85,;5.61,4.62,;2.94,1.54,;2.94,,;4.28,-.77,;4.28,-2.31,;2.94,-3.08,;1.61,-2.31,;.28,-3.08,;-1.06,-2.31,;-.29,-.98,;-2.39,-3.08,;-2.39,-4.62,;-3.72,-2.31,;-5.06,-3.08,;-6.39,-2.31,;-6.79,-.82,;-8.28,-1.22,;-7.88,-2.71,;-1.83,-.98,;-3.32,-1.37,;-1.06,.36,;1.61,-.77,)|
BDBM271293 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CSCCC2CC2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(9.44,4.62,;8.11,3.85,;8.11,2.31,;6.77,1.54,;5.44,2.31,;5.44,3.85,;6.77,4.62,;4.1,1.54,;4.1,,;5.44,-.77,;5.44,-2.31,;4.1,-3.08,;2.77,-2.31,;1.44,-3.08,;.1,-2.31,;.87,-.98,;-1.23,-3.08,;-1.23,-4.62,;-2.56,-2.31,;-3.9,-3.08,;-5.23,-2.31,;-6.57,-3.08,;-7.9,-2.31,;-8.67,-.98,;-9.44,-2.31,;-.67,-.98,;-2.15,-1.37,;.1,.36,;2.77,-.77,)|
BDBM271294 CC(C)COC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271295 N[C@@H](COCCC1CC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271184 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271185 CCC(Cl)CCCOC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271186 CCC(O)CCCOC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271187 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271188 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271296 CC(C)C[C@H](N)[C@](O)(Cc1cc(SCCC2CC2)ccn1)C(O)=O |r|
BDBM271297 N[C@@H](CSCC1CC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271298 N[C@@H](CSCC1CCC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271299 CC(C)SC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271300 N[C@@H](CSC1CCC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271301 CC(C)SC[C@H](N)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271302 N[C@@H](CSCC1CCC1)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271303 CCCC[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)COCC2CC2)C(O)=O)c1 |r|
BDBM271189 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CSCC2CC2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(8.77,4.62,;7.44,3.85,;7.44,2.31,;6.1,1.54,;4.77,2.31,;4.77,3.85,;6.1,4.62,;3.44,1.54,;3.44,,;4.77,-.77,;4.77,-2.31,;3.44,-3.08,;2.1,-2.31,;.77,-3.08,;-.56,-2.31,;.21,-.98,;-1.9,-3.08,;-1.9,-4.62,;-3.23,-2.31,;-4.56,-3.08,;-5.9,-2.31,;-7.23,-3.08,;-8.77,-3.08,;-8,-4.41,;-1.33,-.98,;-.56,.36,;-2.87,-.98,;2.1,-.77,)|
BDBM271190 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,4.4,16.16,wD:13.12,6.6,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-4.31,-.98,;-2,.36,)|
BDBM271191 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC(C)c2ccccc2)ccn1)C(O)=O |r|
BDBM271192 CC(C)C[C@H](N)[C@](O)(Cc1cc(O)ccn1)C(O)=O |r|
BDBM271193 CC(C)C[C@H](N)[C@@]1(Cc2cc(O[C@H]3CC[C@H](C)CC3)ccn2)OC(C)(C)OC1=O |r,wU:6.6,4.4,15.15,wD:12.11,6.23,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-1.1,-1.06,;-2,.18,;-2.77,1.52,;-1.23,1.52,;-3.47,-.29,;-3.47,-1.83,;-5.01,-1.83,)|
BDBM271194 N[C@@H](CCC1CCC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271195 N[C@@H](c1ccc(cc1)C#N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271304 CC(C)C[C@H](N)[C@](O)(Cc1cc(S[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,4.4,16.16,wD:13.12,6.6,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-2,.36,;-4.31,-.98,)|
BDBM271305 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COCCC2CC2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(9.44,4.62,;8.11,3.85,;8.11,2.31,;6.77,1.54,;5.44,2.31,;5.44,3.85,;6.77,4.62,;4.1,1.54,;4.1,,;5.44,-.77,;5.44,-2.31,;4.1,-3.08,;2.77,-2.31,;1.44,-3.08,;.1,-2.31,;.87,-.98,;-1.23,-3.08,;-1.23,-4.62,;-2.56,-2.31,;-3.9,-3.08,;-5.23,-2.31,;-6.57,-3.08,;-7.9,-2.31,;-8.67,-.98,;-9.44,-2.31,;-.67,-.98,;.1,.36,;-2.21,-.98,;2.77,-.77,)|
BDBM271306 CC(C)C[C@H](N)[C@](O)(Cc1cc(SC2CCCCCC2)ccn1)C(O)=O |r|
BDBM271307 N[C@@H](COCCC1CC1)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271308 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CC2(C)CC2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(7.44,4.62,;6.1,3.85,;6.1,2.31,;4.77,1.54,;3.44,2.31,;3.44,3.85,;4.77,4.62,;2.1,1.54,;2.1,,;3.44,-.77,;3.44,-2.31,;2.1,-3.08,;.77,-2.31,;-.56,-3.08,;-1.9,-2.31,;-1.13,-.98,;-3.23,-3.08,;-3.23,-4.62,;-4.56,-2.31,;-5.9,-3.08,;-5.9,-4.62,;-6.67,-1.75,;-7.44,-3.08,;-2.67,-.98,;-1.9,.36,;-4.21,-.98,;.77,-.77,)|
BDBM271309 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CC(C)(C)C)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(7.34,4.62,;6,3.85,;6,2.31,;4.67,1.54,;3.33,2.31,;3.33,3.85,;4.67,4.62,;2,1.54,;2,,;3.33,-.77,;3.33,-2.31,;2,-3.08,;.67,-2.31,;-.67,-3.08,;-2,-2.31,;-1.23,-.98,;-3.33,-3.08,;-3.33,-4.62,;-4.67,-2.31,;-6,-3.08,;-7.34,-3.85,;-6.77,-1.75,;-5.23,-4.41,;-2.77,-.98,;-2,.36,;-4.26,-1.37,;.67,-.77,)|
BDBM271196 N[C@@H](COc1ccccc1C#N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271197 N[C@H]1COCCCCCCCCCCOc2ccnc(C[C@]1(O)C(O)=O)c2 |r|
BDBM271198 CC(C)C[C@H](N)[C@](O)(Cc1cc(ccn1)N1CCCCC1)C(O)=O |r|
BDBM271199 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCc2cccc3ccccc23)ccn1)C(O)=O |r|
BDBM271200 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCc2cnn(C)c2)ccn1)C(O)=O |r|
BDBM271201 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@@H]2C[C@H]3C[C@@H]([C@@H]2C)C3(C)C)ccn1)C(O)=O |r|
BDBM271202 COC(=O)[C@@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)[C@@H](N)CC(C)C |r,wU:4.5,21.23,14.14,wD:11.10,4.4,(-5.64,-.21,;-4.1,-.21,;-2.77,-.98,;-2,.36,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-3.33,-3.08,;-3.33,-4.62,;-4.67,-2.31,;-6,-3.08,;-7.34,-2.31,;-6,-4.62,)|
BDBM271310 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)CC(C)(C)F)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(7.34,4.62,;6,3.85,;6,2.31,;4.67,1.54,;3.33,2.31,;3.33,3.85,;4.67,4.62,;2,1.54,;2,,;3.33,-.77,;3.33,-2.31,;2,-3.08,;.67,-2.31,;-.67,-3.08,;-2,-2.31,;-1.23,-.98,;-3.33,-3.08,;-3.33,-4.62,;-4.67,-2.31,;-6,-3.08,;-7.34,-2.31,;-6,-4.62,;-7.34,-3.85,;-2.77,-.98,;-2,.36,;-4.26,-1.37,;.67,-.77,)|
BDBM271311 CCSC[C@H](N)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271312 CCCSC[C@H](N)[C@](O)(Cc1cc(OC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271313 CC(C)CSC[C@H](N)[C@](O)(Cc1cc(OC2CCCCCC2)ccn1)C(O)=O |r|
BDBM271314 CCC(CC)CC[C@H](N)[C@](O)(Cc1cc(OC(C)C)ccn1)C(O)=O |r|
BDBM271315 N[C@@H](CCC(F)(F)F)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271316 CC(C)CC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM271317 CC(C)C[C@H](N)[C@](O)(Cc1nccc2sc(CCC3CC3)cc12)C(O)=O |r|
BDBM271203 CCCCSc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271204 CC(C)C[C@H](N)[C@](O)(Cc1cc(Oc2ccc3ccccc3c2)ccn1)C(O)=O |r|
BDBM271205 CC(C)C[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM271206 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCC2CCC3(CC3)CC2)ccn1)C(O)=O |r|
BDBM271207 COc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1C |r|
BDBM271208 N[C@@H](c1ccc(cc1)C1CC1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271209 N[C@@H](c1ccc(cc1)S(=O)(=O)C1CC1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271210 CCCCCCn1ccc2cnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)cc12 |r|
BDBM271318 N[C@@H](CCC(F)(F)F)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM271319 CCS(=O)(=O)C[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:8.9,6.6,18.18,wD:15.14,8.8,(-8,-3.08,;-6.67,-2.31,;-5.33,-3.08,;-6.1,-4.41,;-4.56,-4.41,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-2.31,;-.56,-.98,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;4,3.85,;4,-.77,;4,-2.31,;2.67,-3.08,;-2.1,-.98,;-3.59,-1.37,;-1.33,.36,)|
BDBM271320 CCS(=O)C[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:7.8,5.5,17.17,wD:7.7,14.13,(-8,-3.08,;-6.67,-2.31,;-5.33,-3.08,;-5.33,-4.62,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-2.31,;-.56,-.98,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;4,3.85,;4,-.77,;4,-2.31,;2.67,-3.08,;-2.1,-.98,;-3.59,-1.37,;-1.01,.11,)|
BDBM271321 N[C@@H](CSCC1CC1)[C@](O)(Cc1cc(OC2CCCCCC2)ccn1)C(O)=O |r|
BDBM271322 N[C@@H](CSC1CCC1)[C@](O)(Cc1cc(OC2CCCCCC2)ccn1)C(O)=O |r|
BDBM271323 CC(C)CSC[C@H](N)[C@](O)(Cc1cc(OCCCC2CC2)ccn1)C(O)=O |r|
BDBM271324 N[C@@H](CSCCC1CC1)[C@](O)(Cc1cc(OCCCC2CC2)ccn1)C(O)=O |r|
BDBM271211 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@@H]2C[C@@H]3C[C@@H]3C2)ccn1)C(O)=O |r|
BDBM271212 COc1ccccc1COc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271213 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCC2(C)CC2)ccn1)C(O)=O |r|
BDBM271214 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCCCC2CC2)ccn1)C(O)=O |r|
BDBM271215 COCc1ccc(OC[C@H](N)[C@](O)(Cc2cc(OC3CCCCC3)ccn2)C(O)=O)cc1 |r|
BDBM271216 COc1cc(F)cc(OC[C@H](N)[C@](O)(Cc2cc(OC3CCCCC3)ccn2)C(O)=O)c1 |r|
BDBM271217 C[C@H]1CC[C@@H](CC1)Oc1ccnc(C[C@@](O)([C@@H](N)COc2ncccn2)C(O)=O)c1 |r,wU:14.14,16.17,1.0,wD:4.7,14.15,(8.67,4.62,;7.34,3.85,;7.34,2.31,;6,1.54,;4.67,2.31,;4.67,3.85,;6,4.62,;3.33,1.54,;3.33,,;4.67,-.77,;4.67,-2.31,;3.33,-3.08,;2,-2.31,;.67,-3.08,;-.67,-2.31,;.1,-.98,;-2,-3.08,;-2,-4.62,;-3.33,-2.31,;-4.67,-3.08,;-6,-2.31,;-6,-.77,;-7.34,,;-8.67,-.77,;-8.67,-2.31,;-7.34,-3.08,;-1.44,-.98,;-2.98,-.98,;-.67,.36,;2,-.77,)|
BDBM271325 CCCC[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)CSCC)C(O)=O)c1 |r|
BDBM271326 CCSC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271327 CCCSC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271328 CCSC[C@H](N)[C@](O)(Cc1cc(OCCCC2CC2)ccn1)C(O)=O |r|
BDBM271329 CCCSCC[C@H](N)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271330 CCCSC[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:7.8,5.5,17.17,wD:7.7,14.13,(-8.67,-2.31,;-7.34,-3.08,;-6,-2.31,;-4.67,-3.08,;-3.33,-2.31,;-2,-3.08,;-2,-4.62,;-.67,-2.31,;.1,-.98,;.67,-3.08,;2,-2.31,;2,-.77,;3.33,,;3.33,1.54,;4.67,2.31,;6,1.54,;7.34,2.31,;7.34,3.85,;8.67,4.62,;6,4.62,;4.67,3.85,;4.67,-.77,;4.67,-2.31,;3.33,-3.08,;-1.44,-.98,;-2.92,-1.37,;-.67,.36,)|
BDBM271331 CCCC[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)CSCC2CCC2)C(O)=O)c1 |r|
BDBM271218 CC(C)C[C@H](N)[C@](O)(Cc1cc2n(CCC3CCCCC3)cnc2cn1)C(O)=O |r|
BDBM271219 CC(C)C[C@H](N)[C@](O)(Cc1cc(NC(=O)[C@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,4.4,18.18,wD:6.6,15.14,(-8,-1.92,;-6.67,-2.69,;-6.67,-4.23,;-5.33,-1.93,;-4,-2.69,;-4,-4.23,;-2.67,-1.93,;-1.9,-.59,;-1.33,-2.69,;,-1.93,;,-.38,;1.33,.38,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,1.93,;4,.38,;5.33,-.38,;6.67,.38,;8,-.38,;6.67,1.93,;5.33,2.69,;2.67,-.38,;2.67,-1.93,;1.33,-2.69,;-3.44,-.59,;-2.67,.74,;-4.98,-.59,)|
BDBM271220 N[C@@H](COCCCC1CC1)[C@](O)(Cc1cc(OCCC2CC2)ccn1)C(O)=O |r|
BDBM271221 N[C@@H](c1ccc(cc1)-c1ccccc1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271222 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCN(C)CC2)ccn1)C(O)=O |r|
BDBM271223 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCN(CC2)C(C)=O)ccn1)C(O)=O |r|
BDBM271224 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCc2ccccc2)ccn1)C(O)=O |r|
BDBM271225 N[C@@H](\C=C\c1ccccc1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271226 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCCCCC2)ccn1)C(O)=O |r|
BDBM271227 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CCC(F)(F)CC2)ccn1)C(O)=O |r|
BDBM271228 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2C3CC4CC(C3)CC2C4)ccn1)C(O)=O |r,wU:6.7,4.4,wD:6.6,TLB:17:18:13:15.16.22,THB:20:18:15:13.22.21,(-6.67,-2.31,;-5.33,-3.08,;-5.33,-4.62,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-2.31,;-.56,-.98,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;6.67,2.31,;6.67,3.85,;4.81,3.45,;5.33,3.1,;5.88,2.72,;4.37,2.47,;4,3.85,;5.33,4.62,;4,-.77,;4,-2.31,;2.67,-3.08,;-2.1,-.98,;-3.64,-.98,;-1.33,.36,)|
BDBM271229 N[C@@H](c1ccc(cc1)-c1cccnc1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271230 CS(=O)(=O)c1ccc(cc1)-c1ccc(cc1)[C@H](N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271231 CC(C)C[C@H](N)[C@](O)(Cc1ncc(C)c(OCCc2ccccc2)c1C)C(O)=O |r|
BDBM271232 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CC3CCC2C3)ccn1)C(O)=O |r|
BDBM271233 N[C@@H](c1ccc(cc1)N1CCOCC1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271234 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2Cc3ccccc3C2)ccn1)C(O)=O |r|
BDBM271235 COCc1ccc(cc1)[C@H](N)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271236 N[C@@H](COCc1ccccc1)[C@](O)(Cc1cc(OC2CCCCC2)ccn1)C(O)=O |r|
BDBM271237 COc1cc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)ncc1Cc1ccccc1 |r|
BDBM271238 COc1cc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)ncc1Br |r|
BDBM271239 CC(C)C[C@H](N)[C@](O)(Cc1cc(OCc2ccccc2C(F)(F)F)ccn1)C(O)=O |r|
BDBM284928 CCSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284929 CSC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM284930 CC(C)SC[C@H](N)[C@](O)(Cc1nccc2oc(CCC3CC3)cc12)C(O)=O |r|
BDBM271240 CCCC[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271241 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@@H]2CC[C@H](C)CC2)ccn1)C(O)=O |r,wU:6.7,13.12,4.4,16.16,wD:6.6,(-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-3.33,-3.08,;-3.33,-4.62,;-2,-2.31,;-1.23,-.98,;-.67,-3.08,;.67,-2.31,;.67,-.77,;2,,;2,1.54,;3.33,2.31,;4.67,1.54,;6,2.31,;6,3.85,;7.34,4.62,;4.67,4.62,;3.33,3.85,;3.33,-.77,;3.33,-2.31,;2,-3.08,;-2.77,-.98,;-4.31,-.98,;-2,.36,)|
BDBM271242 COc1cc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)ncc1COCc1ccccc1 |r|
BDBM271243 CC(C)C[C@@H](C)Oc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271244 CCC(C)(C)CCOc1ccnc(C[C@@](O)([C@@H](N)CC(C)C)C(O)=O)c1 |r|
BDBM271245 CC(C)C[C@H](N)[C@](O)(Cc1cc(OC2CC(C)(C)OC(C)(C)C2)ccn1)C(O)=O |r|
BDBM271246 CC(C)C[C@H](N)[C@](O)(Cc1cc(O[C@H]2CC[C@]3(CCCO3)CC2)ccn1)C(O)=O |r,wU:6.7,13.12,4.4,16.20,wD:6.6,(-7.85,-2.93,;-6.52,-3.7,;-6.52,-5.24,;-5.19,-2.93,;-3.85,-3.7,;-3.85,-5.24,;-2.52,-2.93,;-1.75,-1.6,;-1.18,-3.7,;.15,-2.93,;.15,-1.39,;1.48,-.62,;1.48,.92,;2.82,1.69,;2.82,3.23,;4.15,4,;5.48,3.23,;6.95,2.75,;7.85,4,;6.95,5.24,;5.48,4.77,;5.48,1.69,;4.15,.92,;2.82,-1.39,;2.82,-2.93,;1.48,-3.7,;-3.29,-1.6,;-4.83,-1.6,;-2.52,-.27,)|