SMILES:
Cc1ccc(-c2cn3cc([N+](=O)[O-])ccc3n2)cc1Molecular Processing
Molecular formula
C14H11N3O2
Molecular weight
253.26
Exact mass
253.0851
XLogP
3.22
TPSA
60.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
72.02
Supplementary Information
Details werden geladen…
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