| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 29 | 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) | 3.54 | 7.51 | -36.52 | 2 | 4 | 1 | 37 | 409.472 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 8.37 | -36.98 | 2 | 4 | 1 | 37 | 409.472 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 6.24 | -7.27 | 1 | 4 | 0 | 36 | 408.464 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
