SMILES:
CSc1nn(Cc2ccc(F)cc2)c(=O)c2c(OCc3ccccc3)c3n(c12)CCN(C)C3=OMolecular Processing
Molecular formula
C25H23FN4O3S
Molecular weight
478.55
Exact mass
478.1475
XLogP
3.77
TPSA
69.36
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
129.01
Supplementary Information
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