SMILES:
Cc1cnc2c(c1)cc1n2[C@H](C)CNC1Molecular Processing
Molecular formula
C12H15N3
Molecular weight
201.27
Exact mass
201.1266
XLogP
2.01
TPSA
29.85
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
60.89
Supplementary Information
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