| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2013 | 21 | No |
Popular Name: physcion physcion
| 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) | 1.44 | 3.94 | -9.53 | 2 | 5 | 0 | 84 | 286.283 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 5.91 | -117.81 | 0 | 5 | -2 | 89 | 284.267 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.93 | -48.8 | 1 | 5 | -1 | 87 | 285.275 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.63 | -116.17 | 0 | 5 | -2 | 89 | 284.267 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 3.88 | -50.31 | 1 | 5 | -1 | 87 | 285.275 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.64 | -116.13 | 0 | 5 | -2 | 89 | 284.267 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 3.88 | -50.35 | 1 | 5 | -1 | 87 | 285.275 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 5.91 | -117.83 | 0 | 5 | -2 | 89 | 284.267 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.93 | -48.81 | 1 | 5 | -1 | 87 | 285.275 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.60 | 3.92 | -48.12 | 1 | 5 | -1 | 87 | 285.275 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Patent Database Links | US2007238784 | ChEBI |
No pre-computed analogs available. Try a structural similarity search.