SMILES:
CC(c1ccccc1)c1cc(Cl)nnc1NMolecular Processing
Molecular formula
C12H12ClN3
Molecular weight
233.7
Exact mass
233.072
XLogP
2.86
TPSA
51.8
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
65.41
Supplementary Information
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