CCn1cc(C(=O)NCC2CC3CC3N2C(=O)c2nc(C)sc2-c2cccc(F)c2)c(C)n1
SMILES: CCn1cc(C(=O)NCC2CC3CC3N2C(=O)c2nc(C)sc2-c2cccc(F)c2)c(C)n1

Molecular Processing

Molecular formula
C24H26FN5O2S
Molecular weight
467.57
Exact mass
467.1791
XLogP
3.82
TPSA
80.12
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
123.69

Supplementary Information

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