Molecule

ID:41035

General Information
Structure
MolImage
Molecular Formula
C₃H₆N₄S
Molecular Mass
130.17154
Exact Mass
130.03131721
Charge
0
InChI
InChI=1S/C3H6N4S/c1-7(4)3-2-5-6-8-3/h2H,4H2,1H3
InChIKey
TVIYLQKEQPUWBT-UHFFFAOYSA-N
Canonic Smiles
CN(c1cnns1)N
Isomeric Smiles
c1(snnc1)N(N)C
Calculated Properties
JChem
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
0.14656676
LogD (pH = 7.4)
0.16628096
Log P
0.16653818
Molar Refractivity
43.0279
Polarizability
11.75155
Polar Surface Area
55.04
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation