SMILES:
CC1(CO)c2ccccc2-c2[nH]c(=O)c3nccn3c21Molecular Processing
Molecular formula
C15H13N3O2
Molecular weight
267.29
Exact mass
267.1008
XLogP
1.3
TPSA
70.39
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
74.79
Supplementary Information
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