Name: 6-(2,3-Dihydroxypropyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SMILES:
Cn1c(=O)c2c(-c3ccccc3)n(CC(O)CO)cc2n(C)c1=OMolecular Processing
Molecular formula
C17H19N3O4
Molecular weight
329.36
Exact mass
329.1376
XLogP
0.06
TPSA
89.39
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
90.95
Supplementary Information
Details werden geladen…
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