SMILES:
CCCCCC=Cc1c(C(C)C)nc(C(C)C)c(CO)c1-c1ccc(F)cc1Molecular Processing
Molecular formula
C25H34FNO
Molecular weight
383.55
Exact mass
383.2624
XLogP
7.22
TPSA
33.12
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
9
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.48
Molar refractivity
116.91
Supplementary Information
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