| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 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) | 2.06 | 6.35 | -45.35 | 2 | 2 | 1 | 29 | 219.333 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 5.07 | -4.24 | 1 | 2 | 0 | 25 | 218.325 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 5.56 | -33.01 | 2 | 2 | 1 | 26 | 219.333 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
