| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 36 | Yes |
None
| 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) | 1.40 | 4.1 | -61.78 | 2 | 12 | -1 | 152 | 489.468 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 1.52 | -132.03 | 1 | 12 | -2 | 155 | 488.46 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 6.6 | -24.04 | 3 | 12 | 0 | 149 | 490.476 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 4.8 | -65.52 | 2 | 12 | -1 | 152 | 489.468 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
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