SMILES:
CC(C)C[C@H](CO)Nc1nc(SC(C)c2cccc(C(F)(F)F)c2)nc2nc(N)sc12Molecular Processing
Molecular formula
C20H24F3N5OS2
Molecular weight
471.57
Exact mass
471.1374
XLogP
5.36
TPSA
96.95
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
119.29
Supplementary Information
Obteniendo detalles…
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