SMILES:
CCCc1c(-c2ccccc2)nn(-c2ccccn2)c1OMolecular Processing
Molecular formula
C17H17N3O
Molecular weight
279.34
Exact mass
279.1372
XLogP
3.59
TPSA
50.94
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
82.45
Supplementary Information
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