In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | Yes |
Popular Name: 2-[(1S)-1-[[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]ethyl]benzene-1,4-diol 2-[(1S)-1-[[(1S,8aR)-1,2,3,5,6,7…
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) | 2.54 | 1.44 | -40.25 | 4 | 4 | 1 | 60 | 277.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 3.7 | -111.56 | 5 | 4 | 2 | 61 | 278.396 | 3 | ↓ |