| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 22 | Yes |
Popular Name: N-(2-methoxyethyl)-2-[[2-(4-methylpiperazin-1-yl)-3,4-dioxo-cyclobuten-1-yl]amino]acetamide N-(2-methoxyethyl)-2-[[2-(4-meth…
| 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) | -3.73 | -4.88 | -34.28 | 3 | 8 | 1 | 97 | 311.362 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.15 | -3.14 | -12.31 | 2 | 8 | 0 | 94 | 310.354 | 6 | ↓ |
| Mid Mid (pH 6-8) | -3.73 | -4.11 | -18.1 | 2 | 8 | 0 | 100 | 310.354 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -3.73 | -2.52 | -98.11 | 4 | 8 | 2 | 99 | 312.37 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
