| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 16 | Yes |
Popular Name: 2-(carboxymethyl)-6-hydroxy-7-oxo-cyclohepta-1,3,5-triene-1-carboxylic 2-(carboxymethyl)-6-hydroxy-7-ox…
| 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) | 0.18 | 4.62 | -148.47 | 1 | 6 | -2 | 118 | 222.152 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 5.51 | -218.4 | 0 | 6 | -3 | 120 | 221.144 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
