SMILES:
O=C1c2ccccc2C(=O)N1CCCCSc1nccc(NC(=S)NCC(F)(F)F)n1Molecular Processing
Molecular formula
C19H18F3N5O2S2
Molecular weight
469.51
Exact mass
469.0854
XLogP
3.49
TPSA
87.22
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
114.08
Supplementary Information
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