SMILES:
Cl.O=C(Nc1ccsc1-c1ccc(F)cc1)OC1CN2CCC1CC2Molecular Processing
Molecular formula
C18H20ClFN2O2S
Molecular weight
382.89
Exact mass
382.0918
XLogP
4.62
TPSA
41.57
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.389
Molar refractivity
100.02
Supplementary Information
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