| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 23 | 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) | 1.43 | 4.75 | -19.4 | 3 | 6 | 0 | 86 | 347.469 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.43 | 6.54 | -87.89 | 5 | 6 | 2 | 92 | 349.485 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.43 | 5.15 | -41.48 | 4 | 6 | 1 | 87 | 348.477 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
