SMILES:
CC(=O)NCC(C)(C)CNc1cc(-c2c[nH]c3ncccc23)cc(Cl)n1Molecular Processing
Molecular formula
C19H22ClN5O
Molecular weight
371.87
Exact mass
371.1513
XLogP
3.85
TPSA
82.7
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
105.29
Supplementary Information
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