| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 17 | 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) | 2.16 | 5.6 | -32.05 | 1 | 3 | 1 | 17 | 241.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.16 | 3.71 | -1.84 | 0 | 3 | 0 | 16 | 240.391 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 7.87 | -100.38 | 2 | 3 | 2 | 18 | 242.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
