| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 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) | 0.97 | 3.64 | -36.29 | 4 | 4 | 1 | 64 | 236.339 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 1.43 | -4.43 | 3 | 4 | 0 | 62 | 235.331 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.97 | 4.11 | -83.21 | 5 | 4 | 2 | 65 | 237.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
