In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 29 | Yes |
Popular Name: [2-butyl-5-chloro-3-[[5-[2-(2H-tetrazol-5-yl)phenyl]-2-thienyl]methyl]imidazol-4-yl]methanol [2-butyl-5-chloro-3-[[5-[2-(2H-t…
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) | 4.89 | 8.92 | -44.88 | 1 | 7 | -1 | 91 | 427.941 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.89 | 9.06 | -19.69 | 2 | 7 | 0 | 93 | 428.949 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592-3-O | Oryctolagus Cuniculus (cluster #3 Of 8), Other | Other | 328 | 0.31 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592 | Z50592 | Oryctolagus Cuniculus | 328 | 0.31 | Functional ≤ 10μM |