Molecule

ID:134181

General Information
Structure
MolImage
Molecular Formula
C₁₉H₂₄O₂
Molecular Mass
284.39266
Exact Mass
284.17763001
Charge
0
InChI
InChI=1S/C19H24O2/c1-18-7-5-16-13(6-9-21-16)14(18)4-8-19-10-12(15(20)11-19)2-3-17(18)19/h6,9,12,14,17H,2-5,7-8,10-11H2,1H3/t12-,14+,17-,18+,19+/m0/s1
InChIKey
DDWYTNONBBOFFA-OXQYBPPISA-N
Canonic Smiles
O=C1C[C@]23C[C@H]1CC[C@H]3[C@]1([C@H](CC2)c2ccoc2CC1)C
Isomeric Smiles
C[C@@]12CCc3c(cco3)[C@H]1CC[C@@]13[C@H]2CC[C@H](C1)C(=O)C3
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.8288753
LogD (pH = 7.4)
3.8288753
Log P
3.8288753
Molar Refractivity
81.443
Polarizability
31.814959
Polar Surface Area
30.21
Rotatable Bonds
0
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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