| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 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) | 1.48 | 8.24 | -99.61 | 4 | 4 | 2 | 50 | 264.417 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 7.06 | -33.12 | 3 | 4 | 1 | 45 | 263.409 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 8.7 | -178.34 | 5 | 4 | 3 | 51 | 265.425 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
