| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 21 | 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) | 0.45 | 1.46 | -21.31 | 2 | 6 | 0 | 88 | 305.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 1.53 | -49.48 | 1 | 6 | -1 | 90 | 304.351 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.45 | 1.74 | -55.02 | 3 | 6 | 1 | 89 | 306.367 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
