| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 21 | 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) | 3.11 | 8.16 | -36.18 | 2 | 3 | 1 | 26 | 291.459 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 7.22 | -33.18 | 2 | 3 | 1 | 29 | 291.459 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 6.96 | -2.76 | 1 | 3 | 0 | 24 | 290.451 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
