In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 29 | No |
Popular Name: 1,3-dimethyl-8-[(4-oxo-2-thioxo-thiazolidin-3-yl)amino]-7-phenethyl-purine-2,6-dione 1,3-dimethyl-8-[(4-oxo-2-thioxo-…
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) | 2.16 | 12.21 | -17.38 | 1 | 9 | 0 | 94 | 430.515 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.