COc1cccc(-c2n[nH]c3ncnc(N)c23)c1
Name: 3-(3-Methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
SMILES: COc1cccc(-c2n[nH]c3ncnc(N)c23)c1

Molecular Processing

Molecular formula
C12H11N5O
Molecular weight
241.25
Exact mass
241.0964
XLogP
1.61
TPSA
89.71
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
68.08

Supplementary Information

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