SMILES:
Cc1ccc(C)c(NCc2cccc3[nH]nnc23)c1Molecular Processing
Molecular formula
C15H16N4
Molecular weight
252.32
Exact mass
252.1375
XLogP
3.19
TPSA
53.6
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
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
0.2
Molar refractivity
77.13
Supplementary Information
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