| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 30 | Yes |
Popular Name: 3-(2-bromophenoxy)-7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]chromen-4-one 3-(2-bromophenoxy)-7-hydroxy-8-[…
| 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) | 3.22 | 5.11 | -60.9 | 3 | 7 | 1 | 88 | 476.347 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 3.26 | -47.47 | 1 | 7 | -1 | 89 | 474.331 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 2.72 | -16.42 | 2 | 7 | 0 | 86 | 475.339 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 5.66 | -42.23 | 2 | 7 | 0 | 90 | 475.339 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
