| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 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) | -0.58 | 4.95 | -46.69 | 3 | 5 | 1 | 62 | 278.405 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.58 | 4.62 | -9.17 | 2 | 5 | 0 | 60 | 277.397 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.58 | 5.34 | -101.26 | 4 | 5 | 2 | 63 | 279.413 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
