Cc1ccc(C2=CCC(C)(C)c3cc(C(=O)c4ccc5cc(C(=O)O)ccc5c4)ccc32)cc1
SMILES: Cc1ccc(C2=CCC(C)(C)c3cc(C(=O)c4ccc5cc(C(=O)O)ccc5c4)ccc32)cc1

Molecular Processing

Molecular formula
C31H26O3
Molecular weight
446.55
Exact mass
446.1882
XLogP
7.19
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.161
Molar refractivity
136.68

Supplementary Information

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