In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2009 | 20 | Yes |
None
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) | 3.82 | 2.95 | -8.73 | 3 | 3 | 0 | 61 | 288.472 | 12 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z100498-1-O | Hepatocytes (cluster #1 Of 2), Other | Other | 6400 | 0.36 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z100498 | Z100498 | Hepatocytes | 6400 | 0.36 | Functional ≤ 10μM |