| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | 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) | 2.88 | 8.42 | -41.9 | 2 | 4 | 1 | 42 | 271.388 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 6.21 | -10.85 | 1 | 4 | 0 | 41 | 270.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 8.53 | -91.09 | 3 | 4 | 2 | 43 | 272.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
