In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 19 | Yes |
Popular Name: (9aR)-2-(3-chloro-2-pyridyl)-8-methyl-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazin-9-one (9aR)-2-(3-chloro-2-pyridyl)-8-m…
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) | 0.86 | 4.26 | -10.65 | 0 | 5 | 0 | 40 | 280.759 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.86 | 4.73 | -36.47 | 1 | 5 | 1 | 41 | 281.767 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.