SMILES:
CCOc1ccc2ccc(N)nc2n1Molecular Processing
Molecular formula
C10H11N3O
Molecular weight
189.22
Exact mass
189.0902
XLogP
1.61
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
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
55.12
Supplementary Information
Récupération des détails…
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