| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 16 | 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) | 2.06 | 6.35 | -52.32 | 2 | 3 | 1 | 34 | 216.308 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 4.9 | -8.04 | 1 | 3 | 0 | 30 | 215.3 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 6.79 | -91.45 | 3 | 3 | 2 | 36 | 217.316 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
