| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 13 | 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) | -0.02 | 2.58 | -46.8 | 3 | 4 | 1 | 54 | 179.247 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.02 | 1.13 | -6.13 | 2 | 4 | 0 | 50 | 178.239 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.02 | 3.02 | -88 | 4 | 4 | 2 | 56 | 180.255 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
