| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 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) | 2.01 | 5.35 | -40.23 | 2 | 5 | 1 | 59 | 292.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 4.11 | -8.45 | 1 | 5 | 0 | 54 | 291.395 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.69 | -98.57 | 3 | 5 | 2 | 60 | 293.411 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
