In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 19 | Yes |
Popular Name: 2-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]quinoxaline 2-[(8aR)-3,4,6,7,8,8a-hexahydro-…
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) | 2.24 | 7.47 | -40.18 | 1 | 4 | 1 | 33 | 255.345 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 5.33 | -7.5 | 0 | 4 | 0 | 32 | 254.337 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.