In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 34 | 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) | 4.61 | 10.89 | -17.91 | 1 | 5 | 0 | 81 | 500.579 | 6 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GCR-2-E | Glucocorticoid Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 5 | 0.34 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 5 | 0.34 | Binding ≤ 1μM |
GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 5 | 0.34 | Binding ≤ 10μM |