| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2012 | 18 | Yes |
Popular Name: Z-Dab-OH Z-Dab-OH
Find On: PubMed — Wikipedia — Google
CAS Numbers: [62234-40-6] , [70882-66-5]
| 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) | -2.44 | 2.86 | -42.93 | 5 | 6 | 0 | 120 | 252.27 | 7 | ↓ |
| Hi High (pH 8-9.5) | -2.44 | 2.58 | -43.99 | 4 | 6 | -1 | 118 | 251.262 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4555502 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.