SMILES:
CNC(=O)c1ccc2[nH]c(-c3n[nH]c4ccccc34)nc2c1Molecular Processing
Molecular formula
C16H13N5O
Molecular weight
291.31
Exact mass
291.112
XLogP
2.47
TPSA
86.46
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
84.57
Supplementary Information
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