SMILES:
CN1Cc2c(C=O)ncn2-c2ccc(F)cc2C1=OMolecular Processing
Molecular formula
C13H10FN3O2
Molecular weight
259.24
Exact mass
259.0757
XLogP
1.41
TPSA
55.2
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
64.71
Supplementary Information
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