| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 23 | No |
Popular Name: 5-Bromo-3-indolyl beta-D-glucuronide cyclohexylammonium salt 5-Bromo-3-indolyl beta-D-glucuro…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 18656-96-7 , 199326-16-4 , [18656-96-7]
"5-Bromo-4-chloro-3-indolyl-¦Â-D-glucuronide cyclohexylammonium salt, 98%"
5-Bromo-3-indolyl-beta-D-glucuronide cyclohexylammonium salt
| 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) | 0.48 | -0.88 | -45.49 | 4 | 8 | -1 | 135 | 387.162 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1997036001A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.