SMILES:
Cc1cc(C)c(S(=O)(=O)N[C@H](CNc2cccc3c2cnn3-c2ccc(F)cc2)C(C)C)c(C)c1Molecular Processing
Molecular formula
C27H31FN4O2S
Molecular weight
494.64
Exact mass
494.2152
XLogP
5.5
TPSA
76.02
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
139.12
Supplementary Information
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