| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 26 | 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) | 0.11 | 5.51 | -76.84 | 4 | 7 | 1 | 97 | 358.466 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | 5.23 | -23.83 | 3 | 7 | 0 | 95 | 357.458 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.11 | 5.95 | -100.8 | 5 | 7 | 2 | 98 | 359.474 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
