SMILES:
N#Cc1c(Cl)c(-c2ccc(O)c(F)c2)nc2ccc(O)cc12Molecular Processing
Molecular formula
C16H8ClFN2O2
Molecular weight
314.7
Exact mass
314.0258
XLogP
3.98
TPSA
77.14
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
80.19
Supplementary Information
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