General Information of the Compound
Compound ID
CP0568324
Compound Name
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-2,3-dihydro-1H-inden-1-yl]benzamide
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Formula
C24H22N2O2
Molecular Weight
370.452
Canonical SMILES
NC(=O)[C@H](N([C@@H]1CCc2ccccc12)C(=O)c1ccccc1)c1ccccc1
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InChI
InChI=1S/C24H22N2O2/c25-23(27)22(18-10-3-1-4-11-18)26(24(28)19-12-5-2-6-13-19)21-16-15-17-9-7-8-14-20(17)21/h1-14,21-22H,15-16H2,(H2,25,27)/t21-,22-/m1/s1
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InChIKey
FVVLSCKLLIQBRK-FGZHOGPDSA-N
Physicochemical Property
logP
4.0429
Rotatable Bonds
5
Heavy Atom Count
28
Polar Areas
63.4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
28

"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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ChEMBL ID
CHEMBL4748099
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: PT03065, Transient receptor potential cation channel subfamily M member 8
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  1
1
IC50 = 270 nM
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