Molecule

ID:8324

General Information
Structure
MolImage
Molecular Formula
C₇H₄FNS
Molecular Mass
153.1767632
Exact Mass
153.00484835
Charge
0
InChI
InChI=1S/C7H4FNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey
NFIUJHJMCQQYDL-UHFFFAOYSA-N
Canonic Smiles
S=C=Nc1ccc(cc1)F
Isomeric Smiles
C(=Nc1ccc(cc1)F)=S
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.1377711
LogD (pH = 7.4)
3.137773
Log P
3.137773
Molar Refractivity
43.3373
Polarizability
15.672372
Polar Surface Area
12.36
Rotatable Bonds
1
Lipinski's Rule of Five
true
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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