| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 20 | Yes |
Popular Name: 1-(4-methylpiperazin-1-yl)-2-[[(1S,2R)-2-phenylcyclopropyl]amino]ethanone 1-(4-methylpiperazin-1-yl)-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) | 1.04 | 5.68 | -43.69 | 2 | 4 | 1 | 40 | 274.388 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 4.39 | -8.56 | 1 | 4 | 0 | 36 | 273.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.04 | 8.02 | -101.14 | 3 | 4 | 2 | 41 | 275.396 | 4 | ↓ |
