| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 18 | 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) | -0.18 | 1.47 | -10.59 | 3 | 7 | 0 | 97 | 250.306 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | 0.44 | -35.21 | 2 | 7 | -1 | 99 | 249.298 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.18 | 1.32 | -10.61 | 3 | 7 | 0 | 100 | 250.306 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
