Cc1c(C)c(N2Cc3cc4c(cc3C2)OCO4)c(C)c2c1OC(C)(C)C2c1ccccc1
SMILES: Cc1c(C)c(N2Cc3cc4c(cc3C2)OCO4)c(C)c2c1OC(C)(C)C2c1ccccc1

Molecular Processing

Molecular formula
C28H29NO3
Molecular weight
427.54
Exact mass
427.2147
XLogP
6.16
TPSA
30.93
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
32
Rings
6
Aromatic rings
3
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
126.1

Supplementary Information

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