| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | 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) | 1.89 | 6.26 | -81.05 | 3 | 4 | 2 | 34 | 299.503 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 4.19 | -31.43 | 2 | 4 | 1 | 32 | 298.495 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.89 | 8.06 | -197.74 | 4 | 4 | 3 | 35 | 300.511 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
