SMILES:
OCc1cc(Oc2ccc3[nH]ccc3c2)ccn1Molecular Processing
Molecular formula
C14H12N2O2
Molecular weight
240.26
Exact mass
240.0899
XLogP
2.85
TPSA
58.14
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
68.53
Supplementary Information
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