SMILES:
Cc1nn(Cc2ccc(F)cc2)c(=O)c2c(O)c3n(c12)CCN(C)C3=OMolecular Processing
Molecular formula
C18H17FN4O3
Molecular weight
356.36
Exact mass
356.1285
XLogP
1.49
TPSA
80.36
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
92.86
Supplementary Information
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