| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2010 | 11 | Yes |
Popular Name: 7-Bromoisochroman 7-Bromoisochroman
Find On: PubMed — Wikipedia — Google
CAS Numbers: 149910-98-5 , [149910-98-5]
| 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) | 2.67 | 5.2 | -3.26 | 0 | 1 | 0 | 9 | 213.074 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | US5364876; US5395827; WO1993005772A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.