In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 25 | Yes |
Popular Name: (11bR)-2-phenethylsulfonyl-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline (11bR)-2-phenethylsulfonyl-1,3,4…
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) | 2.99 | 7.34 | -10.52 | 0 | 4 | 0 | 41 | 356.491 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 9.48 | -48.85 | 1 | 4 | 1 | 42 | 357.499 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.