In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 24 | Yes |
Popular Name: N-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-2-morpholino-pyridine-3-carboxamide N-[(1S,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) | 1.18 | 7.22 | -42.73 | 2 | 6 | 1 | 59 | 331.44 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.18 | 7.68 | -86.1 | 3 | 6 | 2 | 60 | 332.448 | 3 | ↓ |