In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 23 | Yes |
Popular Name: 1,3-dimethyl-7-[(1S)-1-methyl-3-phenyl-propyl]purine-2,6-dione 1,3-dimethyl-7-[(1S)-1-methyl-3-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.75 | 10.64 | -11.68 | 0 | 6 | 0 | 62 | 312.373 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.