Molecule

ID:65176

General Information
Structure
MolImage
Molecular Formula
C₂₂H₃₇NSn
Molecular Mass
434.23688
Exact Mass
435.19479419
Charge
0
InChI
InChI=1S/C10H10N.3C4H9.Sn/c1-3-6-10-9(4-2)7-5-8-11-10;3*1-3-4-2;/h3-7H,1H2,2H3;3*1,3-4H2,2H3;/b9-4-,10-6+;;;;
InChIKey
YRBFKFHZQDPOEC-CHCSYVTFSA-N
Canonic Smiles
CCCC[Sn](c1cc/c(=C/C)/c(=C\C=C)/n1)(CCCC)CCCC
Isomeric Smiles
C(=C)/C=c/1\c(=C/C)\ccc(n1)[Sn](CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.3092604
LogD (pH = 7.4)
5.311971
Log P
8.8819
Molar Refractivity
109.2519
Polarizability
45.552845
Polar Surface Area
12.36
Rotatable Bonds
11
Lipinski's Rule of Five
false
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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