| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 37 | 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) | 4.14 | 11.56 | -13.24 | 0 | 8 | 0 | 67 | 498.583 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 13.34 | -22.34 | 1 | 8 | 0 | 77 | 498.583 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 15.67 | -73.72 | 2 | 8 | 1 | 78 | 499.591 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 11.21 | -42.84 | 2 | 8 | 1 | 78 | 499.591 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
