In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 38 | 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) | 3.78 | 12.3 | -22.59 | 1 | 7 | 0 | 107 | 553.067 | 10 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GCR-2-E | Glucocorticoid Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 10 | 0.29 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 9.68 | 0.30 | Binding ≤ 1μM |
GCR_RAT | P06536 | Glucocorticoid Receptor, Rat | 9.68 | 0.30 | Binding ≤ 10μM |