| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 37 | No |
Popular Name: benzyl benzyl
| 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) | 4.24 | 12.39 | -16.45 | 2 | 8 | 0 | 108 | 520.607 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 4.24 | 12.68 | -50.08 | 3 | 8 | 1 | 110 | 521.615 | 12 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4144232; US4203896 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
