| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 22 | 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) | 3.79 | 9.74 | -37.42 | 1 | 3 | 1 | 17 | 305.486 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.79 | 7.41 | -3.88 | 0 | 3 | 0 | 16 | 304.478 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 9.88 | -35.63 | 1 | 3 | 1 | 17 | 305.486 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
