SMILES:
COc1ncc(-c2cccnn2)c(OC)n1Molecular Processing
Molecular formula
C10H10N4O2
Molecular weight
218.22
Exact mass
218.0804
XLogP
0.95
TPSA
70.02
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
56.16
Supplementary Information
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