| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 9 | Yes |
Popular Name: Cyclohexa-2,5-dienecarboxylic acid Cyclohexa-2,5-dienecarboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4794-04-1 , [4794-04-1] , [4794-4-1]
2,5-Cyclohexadiene-1-carboxylic acid
2-Methyloxazole-4-carbohydrazide
| 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) | 0.13 | 0.93 | -47.08 | 0 | 2 | -1 | 40 | 123.131 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 4.08 | -9.37 | 2 | 6 | 0 | 77 | 382.46 | 8 | ↓ |
