In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2009 | 32 | Yes |
Popular Name: [4,5-bis(4-methoxyphenyl)thiazol-2-yl]-[(2S)-2-(2-hydroxyethyl)-1-piperidyl]methanone [4,5-bis(4-methoxyphenyl)thiazol…
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) | 4.28 | 7.27 | -18.52 | 1 | 6 | 0 | 72 | 452.576 | 7 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592-3-O | Oryctolagus Cuniculus (cluster #3 Of 8), Other | Other | 45 | 0.32 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592 | Z50592 | Oryctolagus Cuniculus | 45 | 0.32 | Functional ≤ 10μM |