| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 22 | No |
| 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 | 6.7 | -12.32 | 1 | 3 | 0 | 54 | 302.414 | 0 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 6.49 | -18.39 | 1 | 3 | 0 | 54 | 302.414 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97.0-103.0% | APIChem |
No pre-computed analogs available. Try a structural similarity search.