| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 15 | 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) | 0.18 | 0.64 | -46.6 | 3 | 4 | 1 | 53 | 211.285 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.18 | 0.22 | -4.81 | 2 | 4 | 0 | 52 | 210.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 2.91 | -96.76 | 4 | 4 | 2 | 54 | 212.293 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
