SMILES:
Cc1nc(NC(=O)CCl)sc1-c1ccnc(Nc2ccc(F)cc2)n1Molecular Processing
Molecular formula
C16H13ClFN5OS
Molecular weight
377.83
Exact mass
377.0513
XLogP
3.97
TPSA
79.8
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
96.91
Supplementary Information
Récupération des détails…
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