SMILES:
Cc1cc(Cl)cc2nn(CC(C)(C#N)NC(=S)c3ccc(C(F)(F)F)cc3)nc12Molecular Processing
Molecular formula
C19H15ClF3N5S
Molecular weight
437.88
Exact mass
437.0689
XLogP
4.66
TPSA
66.53
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
107.57
Supplementary Information
Details werden geladen…
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