UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3-hydroxy-2-styryl-chromen-4-one 3-hydroxy-2-styryl-chromen-4-one

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50622-1-O Human Rhinovirus 1B (cluster #1 Of 2), Other Other 5130 0.37 Functional ≤ 10μM
Z50679-1-O Human Rhinovirus 14 (cluster #1 Of 2), Other Other 9760 0.35 Functional ≤ 10μM

Physical Representations

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) 4.14 7.94 -9.1 1 3 0 50 264.28 2 ↓
Mid Mid (pH 6-8) 4.14 8.73 -54.92 0 3 -1 53 263.272 2 ↓
Mid Mid (pH 6-8) 4.14 8.75 -55.48 0 3 -1 53 263.272 2 ↓

Analogs

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Popular Name: USAN) USAN)

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50078-1-O Human Rhinovirus 45 (cluster #1 Of 1), Other Other 250 0.37 Functional ≤ 10μM
Z50085-1-O Human Rhinovirus Sp. (cluster #1 Of 1), Other Other 40 0.41 Functional ≤ 10μM
Z50088-1-O Human Rhinovirus 9 (cluster #1 Of 1), Other Other 38 0.42 Functional ≤ 10μM
Z50091-1-O Human Rhinovirus 41 (cluster #1 Of 1), Other Other 27 0.42 Functional ≤ 10μM
Z50093-1-O Human Rhinovirus 63 (cluster #1 Of 1), Other Other 27 0.42 Functional ≤ 10μM
Z50094-1-O Human Rhinovirus 70 (cluster #1 Of 1), Other Other 110 0.39 Functional ≤ 10μM
Z50095-1-O Human Rhinovirus 86 (cluster #1 Of 1), Other Other 140 0.38 Functional ≤ 10μM
Z50130-1-O Human Rhinovirus 15 (cluster #1 Of 1), Other Other 42 0.41 Functional ≤ 10μM
Z50132-1-O Human Rhinovirus 39 (cluster #1 Of 1), Other Other 28 0.42 Functional ≤ 10μM
Z50135-1-O Human Rhinovirus 85 (cluster #1 Of 1), Other Other 33 0.42 Functional ≤ 10μM
Z50617-1-O Human Coxsackievirus B3 (cluster #1 Of 2), Other Other 700 0.34 Functional ≤ 10μM
Z50620-1-O Human Poliovirus 3 (cluster #1 Of 1), Other Other 40 0.41 Functional ≤ 10μM
Z50622-1-O Human Rhinovirus 1B (cluster #1 Of 2), Other Other 40 0.41 Functional ≤ 10μM
Z50670-1-O Human Poliovirus 2 (cluster #1 Of 1), Other Other 60 0.40 Functional ≤ 10μM
Z50674-1-O Human Rhinovirus 2 (cluster #1 Of 1), Other Other 26 0.42 Functional ≤ 10μM
Z50675-1-O Human Rhinovirus 89 (cluster #1 Of 1), Other Other 100 0.39 Functional ≤ 10μM
Z50679-2-O Human Rhinovirus 14 (cluster #2 Of 2), Other Other 110 0.39 Functional ≤ 10μM
Z50792-1-O Human Rhinovirus 29 (cluster #1 Of 1), Other Other 29 0.42 Functional ≤ 10μM
Z50793-1-O Human Rhinovirus 72 (cluster #1 Of 1), Other Other 720 0.34 Functional ≤ 10μM

Physical Representations

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) 2.57 5.22 -13.89 3 7 0 111 358.423 4 ↓
Ref Reference (pH 7) 2.57 5.22 -14.35 3 7 0 111 358.423 4 ↓

Analogs

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Popular Name: 2-Chloro-9-[(4-methylphenyl)methyl]-n-phenyl-purin-6-amine 2-Chloro-9-[(4-methylphenyl)meth…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50129-1-O Human Rhinovirus 4 (cluster #1 Of 1), Other Other 6400 0.29 Functional ≤ 10μM
Z50622-1-O Human Rhinovirus 1B (cluster #1 Of 2), Other Other 1000 0.34 Functional ≤ 10μM
Z50674-1-O Human Rhinovirus 2 (cluster #1 Of 1), Other Other 3900 0.30 Functional ≤ 10μM

Physical Representations

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) 5.85 -0.04 -11.66 1 5 0 55 349.825 4 ↓

Analogs

6103743
6103743

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Popular Name: BRD-K59777125-001-01-6 BRD-K59777125-001-01-6

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And 2 More

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50622-1-O Human Rhinovirus 1B (cluster #1 Of 2), Other Other 6190 0.38 Functional ≤ 10μM

Physical Representations

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) 4.44 9.73 -10.78 0 2 0 30 248.281 2 ↓

Parameters Provided:

annotation.name = Z50622
anotation.type = F10
page.format = summary
page.num = 1
filter.purchasability = purchasable

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN note AS n ON ci.sub_id_fk=n.sub_id_fk INNER JOIN annotation AS a ON n.anno_id_fk=a.anno_id  WHERE c.free = 1 AND a.short_desc LIKE 'Z50622' AND c.purchasable IN (1,2,4,5)    LIMIT 50

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