In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2009 | 12 | 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) | 0.74 | -0.65 | -16.05 | 4 | 4 | 0 | 84 | 167.164 | 1 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
SUIS-3-E | Sucrase-isomaltase (cluster #3 Of 3), Eukaryotic | Eukaryotes | 5 | 0.97 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
SUIS_RAT | P23739 | Sucrase-isomaltase, Rat | 5 | 0.97 | Binding ≤ 1μM |
SUIS_RAT | P23739 | Sucrase-isomaltase, Rat | 3600 | 0.64 | Binding ≤ 10μM |