SMILES:
CCOC(=O)c1ccc(CCCC2SCC(=O)N2CCC2(O)CCCCC2)c(C)c1Molecular Processing
Molecular formula
C24H35NO4S
Molecular weight
433.61
Exact mass
433.2287
XLogP
4.48
TPSA
66.84
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
30
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
120.68
Supplementary Information
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