| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 31 | No |
Popular Name: fluoro-hydroxy-dimethyl-[(S)-methylsulfinyl]-propyl-BLAHone fluoro-hydroxy-dimethyl-[(S)-met…
| 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) | 2.94 | 6.38 | -22.16 | 1 | 5 | 0 | 73 | 452.588 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GCR-2-E | Glucocorticoid Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 3 | 0.38 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 3.2 | 0.38 | Binding ≤ 1μM |
| GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 3.2 | 0.38 | Binding ≤ 10μM |
