| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
| 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) | 3.09 | 8.04 | -35.6 | 2 | 3 | 1 | 30 | 317.425 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 5.78 | -4.99 | 1 | 3 | 0 | 28 | 316.417 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.09 | 9.2 | -113.41 | 3 | 3 | 2 | 34 | 318.433 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
