| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 20 | 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) | 3.30 | 6.78 | -9.14 | 1 | 4 | 0 | 59 | 265.316 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 4.9 | -48.73 | 0 | 4 | -1 | 62 | 264.308 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.30 | 7.23 | -45.55 | 2 | 4 | 1 | 60 | 266.324 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
