| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2009 | 20 | Yes |
Popular Name: (2S)-2-(5-chloro-2-thienyl)-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]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) | 2.25 | 2.47 | -52.56 | 3 | 3 | 1 | 34 | 328.811 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 2.39 | -3.65 | 2 | 3 | 0 | 32 | 327.803 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 4.57 | -116.58 | 4 | 3 | 2 | 35 | 329.819 | 5 | ↓ |
