c1ccc2ncc(Nc3cc4c5c(c3)[C@@H]3CNCC[C@@H]3N5CCOC4)cc2c1
SMILES: c1ccc2ncc(Nc3cc4c5c(c3)[C@@H]3CNCC[C@@H]3N5CCOC4)cc2c1

Molecular Processing

Molecular formula
C23H24N4O
Molecular weight
372.47
Exact mass
372.195
XLogP
3.77
TPSA
49.42
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
28
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
112.49

Supplementary Information

Details werden geladen…

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