SMILES:
CN1CC[C@]23CCCC[C@H]2[C@H]1Cc1ccc(Oc2nc(-c4ccccc4)nc4ccccc24)cc13Molecular Processing
Molecular formula
C31H31N3O
Molecular weight
461.61
Exact mass
461.2467
XLogP
6.78
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
35
Rings
7
Aromatic rings
4
Saturated rings
2
Aliphatic rings
3
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.355
Molar refractivity
139.86
Supplementary Information
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