In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 20 | Yes |
Popular Name: 1,3-dimethoxy-5-[(Z)-2-(3-methoxyphenyl)vinyl]benzene 1,3-dimethoxy-5-[(Z)-2-(3-methox…
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) | 4.57 | 6.9 | -8.26 | 0 | 3 | 0 | 28 | 270.328 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80156-1-O | HL-60 (Promyeloblast Leukemia Cells) (cluster #1 Of 12), Other | Other | 5400 | 0.37 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80156 | Z80156 | HL-60 (Promyeloblast Leukemia Cells) | 2800 | 0.39 | Functional ≤ 10μM |