| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 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) | 1.91 | 2.74 | -46.58 | 3 | 3 | 1 | 40 | 263.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 2.34 | -4.92 | 2 | 3 | 0 | 38 | 262.378 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 5.26 | -122.59 | 4 | 3 | 2 | 41 | 264.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
