Molecule

ID:29932

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₅N₃O₃
Molecular Mass
295.3773
Exact Mass
295.18959168
Charge
0
InChI
InChI=1S/C15H25N3O3/c1-10(2)12-16-13(21-17-12)11-6-8-18(9-7-11)14(19)20-15(3,4)5/h10-11H,6-9H2,1-5H3
InChIKey
QIHZUQZZJHBESB-UHFFFAOYSA-N
Canonic Smiles
O=C(N1CCC(CC1)c1onc(n1)C(C)C)OC(C)(C)C
Isomeric Smiles
N1(CCC(CC1)c1onc(n1)C(C)C)C(=O)OC(C)(C)C
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.9590573
LogD (pH = 7.4)
2.9590573
Log P
2.9590573
Molar Refractivity
80.3673
Polarizability
30.516712
Polar Surface Area
68.46
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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