General Information of the Compound
Compound ID
CP0496637
Compound Name
N-(3,3-diphenylpropyl)-2-phenylacetamide
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Synonyms
AC1LPTMM
AKOS003282986
BDBM50263154
CHEMBL502133
MCULE-4189132608
MolPort-001-541-705
N-(3,3-Diphenyl)propyl-2-phenylacetamide
N-(3,3-diphenylpropyl)-2-phenylacetamide
ST50924105
STK439151
ZINC1115339
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Structure
Formula
C23H23NO
Molecular Weight
329.443
Canonical SMILES
O=C(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1
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InChI
InChI=1S/C23H23NO/c25-23(18-19-10-4-1-5-11-19)24-17-16-22(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,24,25)
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InChIKey
JFOKDVSVRVUJTI-UHFFFAOYSA-N
Physicochemical Property
logP
4.5675
Rotatable Bonds
7
Heavy Atom Count
25
Polar Areas
29.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
25

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 1293167
ChEMBL ID
CHEMBL502133
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01298, Cannabinoid receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 560 nM
   TI
   LI
   LO
   TS
Protein ID: PT00834, Cannabinoid receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki > 7900 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( N-(3,3-Diphenyl)propyl-2-phenylacetamide )
Drug Name N-(3,3-Diphenyl)propyl-2-phenylacetamide
Target(s)
Cannabinoid receptor 1 (CB1)
Inhibitor