General Information of the Compound
Compound ID
CP0482258
Compound Name
(Indan-2-yl)(oxazol-2-yl)methanone
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Structure
Formula
C13H11NO2
Molecular Weight
213.236
Canonical SMILES
O=C(C1Cc2ccccc2C1)c1ncco1
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InChI
InChI=1S/C13H11NO2/c15-12(13-14-5-6-16-13)11-7-9-3-1-2-4-10(9)8-11/h1-6,11H,7-8H2
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InChIKey
PLYBUZWPJNORNM-UHFFFAOYSA-N
Physicochemical Property
logP
2.2723
Rotatable Bonds
2
Heavy Atom Count
16
Polar Areas
43.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Complexity
16

"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: 52951455
SID: 123102997
ChEMBL ID
CHEMBL1765987
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 = 7100 nM
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