General Information of the Compound
Compound ID
CP0520917
Compound Name
5-(4-fluorophenyl)-3-phenyl-1,3-oxazolidin-2-one
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Structure
Formula
C15H12FNO2
Molecular Weight
257.264
Canonical SMILES
Fc1ccc(cc1)C1CN(C(=O)O1)c1ccccc1
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InChI
InChI=1S/C15H12FNO2/c16-12-8-6-11(7-9-12)14-10-17(15(18)19-14)13-4-2-1-3-5-13/h1-9,14H,10H2
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InChIKey
VVYWQSDVABGQHI-UHFFFAOYSA-N
Physicochemical Property
logP
3.5236
Rotatable Bonds
2
Heavy Atom Count
19
Polar Areas
29.54
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Complexity
19

"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: 137648272
ChEMBL ID
CHEMBL4085437
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: PT04078, Acyl-CoA (8-3)-desaturase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000063 Hep-G2 Homo sapiens (Human)  1
1
IC50 = 190 nM
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