Name: product
SMILES:
Nc1ccc(-c2cnc(OC3CN4CCC3CC4)nc2)cc1Molecular Processing
Molecular formula
C17H20N4O
Molecular weight
296.37
Exact mass
296.1637
XLogP
2.2
TPSA
64.27
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
85.46
Supplementary Information
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