| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 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) | 0.99 | 5.39 | -85.89 | 3 | 4 | 2 | 34 | 271.449 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 3 | -33.34 | 2 | 4 | 1 | 32 | 270.441 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.99 | 7.25 | -200.14 | 4 | 4 | 3 | 35 | 272.457 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
