| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2009 | 23 | No |
Popular Name: 3'-Formyl-2',4',6',beta-tetrahydroxy-5'-methylchalcone 3'-Formyl-2',4',6',beta-tetrahyd…
| 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) | 3.36 | 1.45 | -16.96 | 3 | 6 | 0 | 118 | 313.285 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 3.76 | -112.86 | 2 | 6 | -2 | 121 | 312.277 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 3.61 | -20.31 | 1 | 6 | 0 | 124 | 311.269 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 2.65 | -24.11 | 2 | 6 | 0 | 121 | 312.277 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 2.62 | -33.64 | 2 | 6 | 0 | 121 | 312.277 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 3.89 | -57.42 | 2 | 6 | -1 | 115 | 313.285 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 3.07 | -42.98 | 3 | 6 | -1 | 118 | 313.285 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.78 | -129.83 | 1 | 6 | -2 | 118 | 312.277 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 2.7 | -63.03 | 3 | 6 | -1 | 118 | 313.285 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 2.52 | -46.17 | 2 | 6 | 0 | 121 | 312.277 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 4.89 | -23.37 | 3 | 6 | 0 | 112 | 314.293 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.