| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 32 | No |
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) | 3.64 | 6.12 | -4.63 | 0 | 6 | 0 | 38 | 440.68 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 7.57 | -40.98 | 1 | 6 | 1 | 39 | 441.688 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.64 | 9.73 | -104.04 | 2 | 6 | 2 | 40 | 442.696 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
