In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 17 | Yes |
Popular Name: 1-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]pyrrole-2-carboxylic 1-[(1R,8aR)-1,2,3,5,6,7,8,8a-oct…
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) | 1.78 | 8.77 | -65.02 | 1 | 4 | 0 | 49 | 234.299 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 6.72 | -49.33 | 0 | 4 | -1 | 48 | 233.291 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.