In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2010 | 34 | Yes |
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) | 3.48 | 9.15 | -19.36 | 2 | 8 | 0 | 98 | 477.952 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ACOD-1-E | Acyl-CoA Desaturase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 100 | 0.29 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ACOD_HUMAN | O00767 | Acyl-CoA Desaturase, Human | 100 | 0.29 | Binding ≤ 1μM |
ACOD_HUMAN | O00767 | Acyl-CoA Desaturase, Human | 100 | 0.29 | Binding ≤ 10μM |