In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 28 | Yes |
Popular Name: 6-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one 6-[2-(3,4-diethoxyphenyl)thiazol…
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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) | 4.52 | 9.34 | -12.9 | 1 | 5 | 0 | 60 | 394.496 | 6 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50587-1-O | Homo Sapiens (cluster #1 Of 9), Other | Other | 80 | 0.35 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50587 | Z50587 | Homo Sapiens | 80 | 0.35 | Functional ≤ 10μM |