| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2011 | 22 | Yes |
Popular Name: 1-(3-bromo-4-methyl-phenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]urea 1-(3-bromo-4-methyl-phenyl)-3-[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) | 1.87 | 5.46 | -46.15 | 3 | 6 | 1 | 66 | 370.271 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 3.1 | -8.75 | 2 | 6 | 0 | 65 | 369.263 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
