SMILES:
Oc1ccc(CCn2cncn2)cc1Molecular Processing
Molecular formula
C10H11N3O
Molecular weight
189.22
Exact mass
189.0902
XLogP
1.23
TPSA
50.94
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
51.83
Supplementary Information
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