| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 4th, 2010 | 23 | 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) | -5.53 | 9.33 | -77.9 | 0 | 6 | 2 | 37 | 318.469 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.53 | 9.56 | -75.46 | 1 | 6 | 0 | 38 | 319.477 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -5.53 | 9.72 | -24.94 | 2 | 6 | 0 | 40 | 320.485 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
