| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | 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) | 1.17 | 6.29 | -83.58 | 5 | 4 | 2 | 59 | 268.792 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 4.23 | -4.45 | 3 | 4 | 0 | 56 | 266.776 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.17 | 6.25 | -41 | 4 | 4 | 1 | 58 | 267.784 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
