| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2014 | 28 | No |
| 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) | 3.31 | 7.57 | -14 | 4 | 6 | 0 | 97 | 373.412 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 7.41 | -38.64 | 5 | 6 | 1 | 99 | 374.42 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 172-175? | Alfa-Aesar |
| Melting_Point | 172-175° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.