SMILES:
CC(C)(N)CCOc1ccc(Cl)nn1Molecular Processing
Molecular formula
C9H14ClN3O
Molecular weight
215.68
Exact mass
215.0825
XLogP
1.64
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
14
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
0.556
Molar refractivity
55.42
Supplementary Information
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