SMILES:
CC(C)Sc1ccc(C(CC2CCCC2)C(=O)N(C)C(C)C(O)c2ccccc2)cc1Molecular Processing
Molecular formula
C27H37NO2S
Molecular weight
439.67
Exact mass
439.2545
XLogP
6.43
TPSA
40.54
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
130.38
Supplementary Information
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