| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: (3S)-1-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-N-ethyl-pyrrolidin-3-amine (3S)-1-[(1R,8aR)-1,2,3,5,6,7,8,8…
| 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) | 1.67 | 7.77 | -196.45 | 4 | 3 | 3 | 25 | 240.415 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.15 | -36.46 | 2 | 3 | 1 | 23 | 238.399 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.59 | -29.93 | 2 | 3 | 1 | 20 | 238.399 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 2.95 | -0.35 | 1 | 3 | 0 | 19 | 237.391 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 5.78 | -84.45 | 3 | 3 | 2 | 24 | 239.407 | 3 | ↓ |
