General Information of the Compound
Compound ID
CP0464715
Compound Name
(R)-(5-phenoxy-2,3-dihydro-1H-inden-2-yl)(5-(pyridin-2-yl)oxazol-2-yl)methanone
    Show/Hide
Structure
Formula
C24H18N2O3
Molecular Weight
382.419
Canonical SMILES
O=C([C@@H]1Cc2ccc(Oc3ccccc3)cc2C1)c1ncc(o1)-c1ccccn1
    Show/Hide
InChI
InChI=1S/C24H18N2O3/c27-23(24-26-15-22(29-24)21-8-4-5-11-25-21)18-12-16-9-10-20(14-17(16)13-18)28-19-6-2-1-3-7-19/h1-11,14-15,18H,12-13H2/t18-/m1/s1
    Show/Hide
InChIKey
RLFWFFNASDWVLA-GOSISDBHSA-N
Physicochemical Property
logP
5.1266
Rotatable Bonds
5
Heavy Atom Count
29
Polar Areas
65.22
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
29

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 52951245
SID: 123102748
ChEMBL ID
CHEMBL1765875
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: PT01099, Fatty-acid amide hydrolase 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7 Chlorocebus aethiops (Green monkey)  1
1
Ki = 42 nM
   TI
   LI
   LO
   TS