| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | Yes |
Popular Name: (1S)-1-(5-bromo-2-thienyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]ethanamine (1S)-1-(5-bromo-2-thienyl)-N-[2-…
| 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) | 2.81 | 6.34 | -93.89 | 3 | 3 | 2 | 24 | 334.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 2.77 | -2.38 | 1 | 3 | 0 | 19 | 332.311 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 3.97 | -41.47 | 2 | 3 | 1 | 23 | 333.319 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 5.14 | -34.33 | 2 | 3 | 1 | 20 | 333.319 | 5 | ↓ |
