| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 12 | 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) | 2.32 | 7.52 | -32.5 | 1 | 1 | 1 | 4 | 209.14 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 5.12 | -1.6 | 0 | 1 | 0 | 3 | 208.132 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
