| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 30th, 2011 | 22 | Yes |
Popular Name: 2-[isopropyl(methyl)amino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]acetamide 2-[isopropyl(methyl)amino]-N-[6-…
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| 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) | 1.45 | 7.8 | -81.34 | 3 | 6 | 2 | 54 | 307.442 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.22 | -9.22 | 1 | 6 | 0 | 52 | 305.426 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 5.44 | -39.46 | 2 | 6 | 1 | 53 | 306.434 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 8.15 | -155.1 | 4 | 6 | 3 | 55 | 308.45 | 5 | ↓ |
