SMILES:
CCNc1nc2ccc(N)cc2cc1CMolecular Processing
Molecular formula
C12H15N3
Molecular weight
201.27
Exact mass
201.1266
XLogP
2.56
TPSA
50.94
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
65.06
Supplementary Information
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