SMILES:
COc1cc(C(=O)Nc2cnn(Cc3c(C)noc3C)c2)cc2c1OCCO2Molecular Processing
Molecular formula
C19H20N4O5
Molecular weight
384.39
Exact mass
384.1434
XLogP
2.57
TPSA
100.64
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
99.24
Supplementary Information
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