| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 15 | Yes |
| 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) | 1.93 | 6.21 | -51.99 | 2 | 3 | 1 | 34 | 202.281 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 4.85 | -8.56 | 1 | 3 | 0 | 30 | 201.273 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 6.69 | -107.11 | 3 | 3 | 2 | 36 | 203.289 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
