| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 19 | Yes |
Popular Name: (2S)-2-(4-tert-butylpiperazin-1-yl)-2-(5-chloro-2-thienyl)ethanamine (2S)-2-(4-tert-butylpiperazin-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) | 2.51 | 4.94 | -104.82 | 4 | 3 | 2 | 35 | 303.903 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 2.79 | -48.68 | 3 | 3 | 1 | 34 | 302.895 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 2.45 | -1.66 | 2 | 3 | 0 | 32 | 301.887 | 4 | ↓ |
