| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 4th, 2014 | 37 | 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) | 3.59 | 13.34 | -22.96 | 0 | 9 | 0 | 97 | 524.558 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 3.59 | 13.79 | -48.9 | 1 | 9 | 1 | 99 | 525.566 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.