| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 21 | Yes |
Popular Name: benzyl benzyl
None
| 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) | 3.94 | 6.47 | -43.62 | 4 | 4 | 1 | 66 | 285.367 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 6.1 | -7.49 | 3 | 4 | 0 | 64 | 284.359 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1994017090A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
