| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 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) | 1.49 | 6.5 | -82.55 | 3 | 5 | 2 | 50 | 294.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 6.9 | -97.74 | 3 | 5 | 2 | 50 | 294.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 5.68 | -40.15 | 2 | 5 | 1 | 46 | 293.435 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.49 | 8.45 | -180.83 | 4 | 5 | 3 | 52 | 295.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
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