SMILES:
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1-c1ccco1Molecular Processing
Molecular formula
C18H20N4O3
Molecular weight
340.38
Exact mass
340.1535
XLogP
3.83
TPSA
109.42
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
95.72
Supplementary Information
Récupération des détails…
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