| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 21 | 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) | 1.53 | 3.84 | -12.21 | 3 | 6 | 0 | 94 | 278.271 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 1.23 | -45.21 | 2 | 6 | -1 | 97 | 277.263 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.53 | 4.32 | -39.65 | 4 | 6 | 1 | 95 | 279.279 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
