| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 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) | 3.11 | 4.54 | -123.66 | 1 | 6 | -2 | 104 | 422.054 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 4.4 | -43.62 | 2 | 6 | -1 | 102 | 423.062 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
