| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2009 | 19 | No |
Popular Name: DHMEQ DHMEQ
Find On: PubMed — Wikipedia — Google
CAS Numbers: 287194-38-1 , 287194-40-5
2-Hydroxy-N-((1S,2S,6S)-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl)benzamide
Cis(+/-)-2-hydroxy-N-(2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl)benzamide
| 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) | 0.45 | -1.06 | -15.34 | 3 | 6 | 0 | 99 | 261.233 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | -0.2 | -55.04 | 2 | 6 | -1 | 102 | 260.225 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 0.4 | -118.65 | 1 | 6 | -2 | 105 | 259.217 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.