Molecule

ID:58617

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₀ClNO₂
Molecular Mass
271.6984
Exact Mass
271.04000625
Charge
0
InChI
InChI=1S/C15H10ClNO2/c16-12-7-3-1-5-10(12)9-17-13-8-4-2-6-11(13)14(18)15(17)19/h1-8H,9H2
InChIKey
GXOAQYBGXKBALO-UHFFFAOYSA-N
Canonic Smiles
Clc1ccccc1CN1c2ccccc2C(=O)C1=O
Isomeric Smiles
c1ccc2c(c1)C(=O)C(=O)N2Cc1ccccc1Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.1441274
LogD (pH = 7.4)
3.1441274
Log P
3.1441274
Molar Refractivity
73.0083
Polarizability
27.831093
Polar Surface Area
37.38
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation