| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 19 | Yes |
Popular Name: (2S)-2-(5-chloro-2-thienyl)-2-(4,4-diethyl-1-piperidyl)ethanamine (2S)-2-(5-chloro-2-thienyl)-2-(4…
| 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) | 3.66 | 5.75 | -47.7 | 3 | 2 | 1 | 31 | 301.907 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 5.4 | -1.06 | 2 | 2 | 0 | 29 | 300.899 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 7.84 | -125.26 | 4 | 2 | 2 | 32 | 302.915 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 7.2 | -32.38 | 3 | 2 | 1 | 30 | 301.907 | 5 | ↓ |
