| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 14 | 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) | 1.22 | 4.6 | -53.58 | 2 | 3 | 1 | 34 | 188.254 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 2.92 | -7.95 | 1 | 3 | 0 | 30 | 187.246 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 5.04 | -95.98 | 3 | 3 | 2 | 36 | 189.262 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
