SMILES:
Cc1nc(C(=O)N2[C@H](CNC(=O)c3c(C)nc4sccn34)C[C@@H]3C[C@@H]32)c(-c2cccc(F)c2)s1Molecular Processing
Molecular formula
C24H22FN5O2S2
Molecular weight
495.61
Exact mass
495.1199
XLogP
4.31
TPSA
79.6
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
34
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
128.85
Supplementary Information
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