Molecule

ID:74481

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅N
Molecular Mass
113.2007
Exact Mass
113.12044949
Charge
0
InChI
InChI=1S/C7H15N/c8-7-5-3-1-2-4-6-7/h7H,1-6,8H2
InChIKey
VXVVUHQULXCUPF-UHFFFAOYSA-N
Canonic Smiles
NC1CCCCCC1
Isomeric Smiles
NC1CCCCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-1.4095719
LogD (pH = 7.4)
-1.1248164
Log P
1.6183803
Molar Refractivity
35.534
Polarizability
14.445701
Polar Surface Area
26.02
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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