| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 16 | 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) | 3.12 | 6.02 | -9.17 | 1 | 3 | 0 | 38 | 213.284 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 6.18 | -26.23 | 2 | 3 | 1 | 39 | 214.292 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 6.19 | -23.74 | 2 | 3 | 1 | 39 | 214.292 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
