| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | 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) | 2.56 | 10.92 | -103.21 | 3 | 3 | 2 | 36 | 305.491 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 9.53 | -7.09 | 1 | 3 | 0 | 30 | 303.475 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 10.4 | -41.03 | 2 | 3 | 1 | 34 | 304.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
