| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 31 | 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) | 0.27 | 10.66 | -96.38 | 2 | 8 | 0 | 104 | 434.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.27 | 9.41 | -62.79 | 1 | 8 | -1 | 99 | 433.435 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.27 | 8.64 | -55.72 | 3 | 8 | 1 | 101 | 435.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
