이름: 5-amino-4-methyl-1-pyridin-2-yl-1H-pyrazole-3-carboxylic acid ethyl ester
SMILES:
CCOC(=O)c1nn(-c2ccccn2)c(N)c1CMolecular Processing
Molecular formula
C12H14N4O2
Molecular weight
246.27
Exact mass
246.1117
XLogP
1.33
TPSA
83.03
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
66.46
Supplementary Information
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