| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 19 | Yes |
Popular Name: (5-bromo-2-hydroxy-phenyl)-(4-cyclopropylpiperazin-1-yl)methanone (5-bromo-2-hydroxy-phenyl)-(4-cy…
| 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) | 2.44 | 5.84 | -42.42 | 2 | 4 | 1 | 45 | 326.214 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 4.45 | -47.76 | 0 | 4 | -1 | 47 | 324.198 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 3.62 | -8.56 | 1 | 4 | 0 | 44 | 325.206 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
