Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:AC1LAMDM
PubChem ID:516319
Pathway:-
InChI:InChI=1S/C36H48N4O2/c1-2-31-23-33(22-27-12-6-3-7-13-27)40(37-31)32-18-20-38(21-19-32)24-30-25-39(26-34(30)28-14-8-4-9-15-28)35(36(41)42)29-16-10-5-11-17-29/h3-4,6-9,12-15,23,29-30,32,34-35H,2,5,10-11,16-22,24-26H2,1H3,(H,41,42)/t30-,34+,35+/m0/s1
SMILES:CCc1nn(c(c1)Cc1ccccc1)C1CCN(CC1)C[C@H]1CN(C[C@@H]1c1ccccc1)[C@H](C1CCCCC1)C(=O)O

Properties:
Formula:C36H48N4O2Atoms:42
Molecular Weight:568.792Rotatable Bonds:10
H-bond Acceptors:6H-bond Donors:1
logP:6.2981
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
(2R)-2-[(3S,4S)-3-[[4-(5-benzyl-3-ethylpyrazol-1-yl)piperidin-1-yl]methyl]
AC1LAMDM
CHEBI:388022
CHEMBL173609
CID 516319
CID516319