In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 22 | Yes |
Popular Name: (9aR)-8-[2-(o-tolylsulfanyl)acetyl]-3,4,6,7,9,9a-hexahydro-2H-pyrazino[1,2-a]pyrazin-1-one (9aR)-8-[2-(o-tolylsulfanyl)acet…
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) | 0.97 | 3.94 | -18.07 | 1 | 5 | 0 | 53 | 319.43 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.