SMILES:
Cc1nc(C(=O)N2C(CN)CC3CC32)c(-c2cccc(F)c2)s1Molecular Processing
Molecular formula
C17H18FN3OS
Molecular weight
331.42
Exact mass
331.1155
XLogP
2.82
TPSA
59.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
87.77
Supplementary Information
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