이름: Intermediate 2
SMILES:
c1ccc(-n2cnc3cnccc32)cc1Molecular Processing
Molecular formula
C12H9N3
Molecular weight
195.22
Exact mass
195.0796
XLogP
2.42
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
58.87
Supplementary Information
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