SMILES:
COc1cc(C(C)C)c(Oc2cnc(N)[nH]c2=O)cc1CMolecular Processing
Molecular formula
C15H19N3O3
Molecular weight
289.34
Exact mass
289.1426
XLogP
2.58
TPSA
90.23
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
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
0.333
Molar refractivity
81.16
Supplementary Information
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