SMILES:
OCCOc1ccc(-n2ccnc2)cc1Molecular Processing
Molecular formula
C11H12N2O2
Molecular weight
204.23
Exact mass
204.0899
XLogP
1.24
TPSA
47.28
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
56.14
Supplementary Information
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