| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 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) | 2.09 | 5.76 | -46.8 | 1 | 5 | -1 | 78 | 244.274 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 5.91 | -48.89 | 2 | 5 | 0 | 79 | 245.282 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 3.93 | -31.35 | 3 | 5 | 1 | 76 | 246.29 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
