| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 35 | 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) | 5.49 | 11.92 | -105.25 | 1 | 5 | -2 | 100 | 484.677 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.49 | 10.17 | -49.05 | 2 | 5 | -1 | 98 | 485.685 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 5.49 | 8.31 | -7.18 | 3 | 5 | 0 | 95 | 486.693 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.