| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 15 | 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) | 2.73 | 5.11 | -9.73 | 2 | 3 | 0 | 52 | 199.257 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 5.25 | -25.4 | 3 | 3 | 1 | 53 | 200.265 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 5.27 | -29.31 | 3 | 3 | 1 | 53 | 200.265 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
