SMILES:
CCOC(=O)c1c(N)c2cnccc2n1CMolecular Processing
Molecular formula
C11H13N3O2
Molecular weight
219.24
Exact mass
219.1008
XLogP
1.33
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
61.08
Supplementary Information
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