SMILES:
c1cncc(Nc2cc3c4c(c2)[C@@H]2CNCC[C@@H]2N4CCOC3)c1Molecular Processing
Molecular formula
C19H22N4O
Molecular weight
322.41
Exact mass
322.1794
XLogP
2.62
TPSA
49.42
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
94.98
Supplementary Information
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