Molecule

ID:90070

General Information
Structure
MolImage
Molecular Formula
C₁₈H₁₅N
Molecular Mass
245.3184
Exact Mass
245.12044949
Charge
0
InChI
InChI=1S/C18H15N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKey
ODHXBMXNKOYIBV-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)N(c1ccccc1)c1ccccc1
Isomeric Smiles
N(c1ccccc1)(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.294806
LogD (pH = 7.4)
5.294806
Log P
5.294806
Molar Refractivity
79.2185
Polarizability
30.773209
Polar Surface Area
3.24
Rotatable Bonds
3
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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