| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 19 | Yes |
Popular Name: (1R,2R)-1-(4-bromo-2-thienyl)-1-[(2S)-2-ethyl-1-piperidyl]butan-2-amine (1R,2R)-1-(4-bromo-2-thienyl)-1-…
| 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) | 4.08 | 6.24 | -41.04 | 3 | 2 | 1 | 31 | 346.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.08 | 5.93 | -1.56 | 2 | 2 | 0 | 29 | 345.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 7.74 | -31.31 | 3 | 2 | 1 | 30 | 346.358 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 8.03 | -111.43 | 4 | 2 | 2 | 32 | 347.366 | 5 | ↓ |
