名称: Compound 6
SMILES:
NC(=O)c1cccc2c(NCc3ccccc3)nnnc12Molecular Processing
Molecular formula
C15H13N5O
Molecular weight
279.3
Exact mass
279.112
XLogP
1.74
TPSA
93.79
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
79.62
Supplementary Information
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