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Name:CHEMBL424962
PubChem ID:44385299
Pathway:Show KEGG pathways
InChI:InChI=1S/C39H53N9O12/c1-6-19(3)32(37(57)46-29(39(59)60)12-22-16-41-25-11-9-8-10-24(22)25)48-38(58)33(20(4)7-2)47-36(56)28(15-31(52)53)45-35(55)27(14-30(50)51)44-34(54)26(43-21(5)49)13-23-17-40-18-42-23/h8-11,16-20,26-29,32-33,41H,6-7,12-15H2,1-5H3,(H,40,42)(H,43,49)(H,44,54)(H,45,55)(H,46,57)(H,47,56)(H,48,58)(H,50,51)(H,52,53)(H,59,60)/t19?,20?,26-,27-,28-,29-,32-,33-/m0/s1
SMILES:CCC([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C(CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1[nH]cnc1)NC(=O)C)CC(=O)O)CC(=O)O)C

Properties:
Formula:C39H53N9O12Atoms:60
Molecular Weight:839.891Rotatable Bonds:30
H-bond Acceptors:19H-bond Donors:11
logP:2.0765
Targets:
Synonyms:
CHEBI:391294
CHEMBL424962