In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 23 | Yes |
Popular Name: 1-[(11bS)-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-2-yl]-2-phenyl-ethanone 1-[(11bS)-1,3,4,6,7,11b-hexahydr…
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) | 2.93 | 8.82 | -10.74 | 0 | 3 | 0 | 24 | 306.409 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 10.97 | -48.11 | 1 | 3 | 1 | 25 | 307.417 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.