SMILES:
Clc1ccc(-n2nc3ccccc3c2NC2CCOCC2)cc1Molecular Processing
Molecular formula
C18H18ClN3O
Molecular weight
327.82
Exact mass
327.1138
XLogP
4.27
TPSA
39.08
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
93.54
Supplementary Information
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