| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 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) | -0.25 | 6.58 | -116.73 | 3 | 5 | 2 | 52 | 237.351 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.25 | 5.41 | -41.04 | 2 | 5 | 1 | 47 | 236.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.25 | 2.9 | -10.43 | 1 | 5 | 0 | 46 | 235.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
