| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 18 | No |
| 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) | -0.19 | 5.59 | -42.51 | 1 | 4 | -1 | 65 | 259.31 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 6.34 | -30.59 | 2 | 4 | 0 | 70 | 260.318 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.19 | 6.78 | -66.37 | 3 | 4 | 1 | 71 | 261.326 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
