| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 14 | 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) | 1.10 | 0.22 | -9.03 | 2 | 5 | 0 | 78 | 191.19 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 1.51 | -47.35 | 1 | 5 | -1 | 80 | 190.182 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 1.51 | -50.93 | 1 | 5 | -1 | 80 | 190.182 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
