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Drug Details

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Name:CHEMBL87252
PubChem ID:44321125
Pathway:Show KEGG pathways
InChI:InChI=1S/C42H59N7O9/c1-7-24(5)35(40(55)47-33(42(57)58)20-27-22-44-30-17-13-12-16-28(27)30)49-41(56)36(25(6)8-2)48-39(54)32(21-34(50)51)46-38(53)31(18-23(3)4)45-37(52)29(43)19-26-14-10-9-11-15-26/h9-17,22-25,29,31-33,35-36,44H,7-8,18-21,43H2,1-6H3,(H,45,52)(H,46,53)(H,47,55)(H,48,54)(H,49,56)(H,50,51)(H,57,58)/t24-,25-,29-,31-,32-,33-,35-,36-/m0/s1
SMILES:CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N)CC(C)C)CC(=O)O)C

Properties:
Formula:C42H59N7O9Atoms:58
Molecular Weight:805.959Rotatable Bonds:28
H-bond Acceptors:15H-bond Donors:9
logP:5.0568
Targets:
Synonyms:
CHEBI:240537
CHEMBL87252