SMILES:
CCn1nc(C)cc1C(=O)NCC1CC2CC2N1C(=O)c1nc(C)sc1-c1cccc(F)c1Molecular 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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