| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 18 | Yes |
Popular Name: 1-(4-methylpiperazin-1-yl)-2-[(1-methyl-4-piperidyl)amino]ethanone 1-(4-methylpiperazin-1-yl)-2-[(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) | -0.24 | 1.28 | -42.02 | 2 | 5 | 1 | 43 | 255.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.24 | 2.47 | -40.6 | 2 | 5 | 1 | 40 | 255.386 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.24 | 4.81 | -87.13 | 3 | 5 | 2 | 41 | 256.394 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.24 | 3.66 | -108.31 | 3 | 5 | 2 | 45 | 256.394 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.24 | 3.62 | -99.84 | 3 | 5 | 2 | 45 | 256.394 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.24 | 6 | -176.21 | 4 | 5 | 3 | 46 | 257.402 | 3 | ↓ |
