| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 19 | 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) | 3.16 | 8.43 | -37.04 | 2 | 3 | 1 | 40 | 264.437 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.84 | -40.13 | 2 | 3 | 1 | 44 | 264.437 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 9.34 | -113.16 | 3 | 3 | 2 | 45 | 265.445 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
