SMILES:
COc1c(C(C)(C)C)cc2c(c1-c1ccccc1)CC(CC(C)(C)C)=C2Molecular Processing
Molecular formula
C25H32O
Molecular weight
348.53
Exact mass
348.2453
XLogP
7.04
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
112.88
Supplementary Information
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