In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2009 | 13 | Yes |
Popular Name: (1S,6R,7R,8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol (1S,6R,7R,8S,8aS)-1,2,3,5,6,7,8,…
None
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) | -2.04 | -5.87 | -40.24 | 5 | 5 | 1 | 85 | 190.219 | 0 | ↓ |
Hi High (pH 8-9.5) | -2.04 | -5.12 | -53.23 | 4 | 5 | 0 | 88 | 189.211 | 0 | ↓ |