| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2009 | 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) | 1.86 | 4.31 | -20.55 | 3 | 5 | 0 | 82 | 253.261 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 3.28 | -55.96 | 2 | 5 | -1 | 84 | 252.253 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 3.23 | -18.92 | 3 | 5 | 0 | 78 | 253.261 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
