| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[(2R)-1-[(1R,2S)-2-amino-1-(5-methyl-2-thienyl)propyl]-2-piperidyl]ethanol 2-[(2R)-1-[(1R,2S)-2-amino-1-(5-…
| 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) | 1.79 | 2.21 | -43.44 | 4 | 3 | 1 | 51 | 283.461 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | 3.81 | -28.22 | 4 | 3 | 1 | 51 | 283.461 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 1.85 | -3.36 | 3 | 3 | 0 | 49 | 282.453 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.79 | 4.1 | -119.38 | 5 | 3 | 2 | 52 | 284.469 | 5 | ↓ |
