| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 15 | 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) | 1.69 | 3.04 | -13.44 | 1 | 5 | 0 | 72 | 240.675 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 1.32 | -55.53 | 0 | 5 | -1 | 75 | 239.667 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 2.72 | -30.93 | 1 | 5 | 0 | 72 | 240.675 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
