| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 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) | 1.04 | 2.05 | -52.11 | 3 | 6 | -1 | 91 | 278.332 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.04 | 4.32 | -67.54 | 4 | 6 | 0 | 92 | 279.34 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.04 | 2.34 | -41.12 | 5 | 6 | 1 | 89 | 280.348 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
