SMILES:
COc1ccc(C(=O)Nc2ccc(COc3ccc4c(c3)CCC(CN(C)C)C4)cc2)cc1Molecular Processing
Molecular formula
C28H32N2O3
Molecular weight
444.58
Exact mass
444.2413
XLogP
5.19
TPSA
50.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
132.23
Supplementary Information
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