SMILES:
CC(=O)N1CCc2c(sc(C)c2CCN2CCC(=C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)C1Molecular Processing
Molecular formula
C30H32F2N2OS
Molecular weight
506.66
Exact mass
506.2203
XLogP
6.38
TPSA
23.55
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.367
Molar refractivity
142.05
Supplementary Information
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