SMILES:
O=Cc1ccc2[nH]c(-c3n[nH]c4ccccc34)cc2c1Molecular Processing
Molecular formula
C16H11N3O
Molecular weight
261.28
Exact mass
261.0902
XLogP
3.52
TPSA
61.54
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
20
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
78.77
Supplementary Information
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