SMILES:
CC(C)(N)COc1ccc(Cl)nn1Molecular Processing
Molecular formula
C8H12ClN3O
Molecular weight
201.66
Exact mass
201.0669
XLogP
1.25
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
50.8
Supplementary Information
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