| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 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) | 4.59 | 9.38 | -112.79 | 3 | 2 | 2 | 21 | 266.473 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 8.14 | -34.54 | 2 | 2 | 1 | 16 | 265.465 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 7.56 | -30.83 | 2 | 2 | 1 | 20 | 265.465 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
