| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 19 | 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) | 1.82 | 7.94 | -45.68 | 3 | 4 | 1 | 48 | 259.377 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 5.76 | -7.93 | 2 | 4 | 0 | 47 | 258.369 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 8.43 | -96.98 | 4 | 4 | 2 | 50 | 260.385 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
