| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2014 | 46 | 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) | 4.25 | 8.5 | -15.87 | 2 | 10 | 0 | 116 | 632.664 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.25 | 10.77 | -49.73 | 3 | 10 | 1 | 118 | 633.672 | 12 | ↓ |
No pre-computed analogs available. Try a structural similarity search.