SMILES:
COc1ccc(Cn2nnc(-c3cnc4cc(C(=O)O)ccn4c3=O)n2)cc1Molecular Processing
Molecular formula
C18H14N6O4
Molecular weight
378.35
Exact mass
378.1077
XLogP
1.1
TPSA
124.5
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
97.33
Supplementary Information
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