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Name:CHEMBL25159
PubChem ID:44458498
Pathway:Show KEGG pathways
InChI:InChI=1S/C35H50N5O10PS.2Na/c1-23(2)18-31(39-33(42)29(40-52(4,48)49)16-10-11-17-36-35(45)50-21-25-12-6-5-7-13-25)51(46,47)22-24(3)32(41)38-30(34(43)44)19-26-20-37-28-15-9-8-14-27(26)28;;/h5-9,12-15,20,23-24,29-31,37,40H,10-11,16-19,21-22H2,1-4H3,(H,36,45)(H,38,41)(H,39,42)(H,43,44)(H,46,47);;/q;2*+1/p-2/t24?,29-,30-,31?;;/m0../s1
SMILES:CC(CC(P(=O)(CC(C(=O)N[C@H](C(=O)[O-])Cc1c[nH]c2c1cccc2)C)[O-])NC(=O)[C@@H](NS(=O)(=O)C)CCCCNC(=O)OCc1ccccc1)C.[Na+].[Na+]

Properties:
Formula:C35H48N5Na2O10PSAtoms:54
Molecular Weight:807.801Rotatable Bonds:25
H-bond Acceptors:14H-bond Donors:5
logP:5.4371
Targets:
NameUniprot IDSourceReferencesInteraction
NeprilysinNEP_RATBindingDB-shows
Synonyms:
CHEBI:129165
CHEMBL25159