SMILES:
CC1(C)c2cc(Br)ccc2-c2cc3c(cc21)C(O)(c1cc2ccccc2c2ccccc12)c1ccccc1C3(O)c1cc2ccccc2c2ccccc12Molecular Processing
Molecular formula
C51H35BrO2
Molecular weight
759.74
Exact mass
758.182
XLogP
12.25
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
54
Rings
11
Aromatic rings
9
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.098
Molar refractivity
225.26
Supplementary Information
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