SMILES:
COCCc1nc2c(N)nc3cc(O)ccc3c2n1CC(C)(C)OMolecular Processing
Molecular formula
C17H22N4O3
Molecular weight
330.39
Exact mass
330.1692
XLogP
1.83
TPSA
106.42
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
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
0.412
Molar refractivity
92.99
Supplementary Information
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