| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2008 | 24 | 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) | 4.31 | 5.62 | -14.57 | 1 | 6 | 0 | 91 | 317.304 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.31 | 5.76 | -39.09 | 2 | 6 | 1 | 93 | 318.312 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.31 | 6.71 | -38.1 | 2 | 6 | 1 | 93 | 318.312 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
