UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

38241520
38241520
38241522
38241522
4095725
4095725

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Popular Name: Hinokiflavone [19202-36-9]; (4',6"-Biapigenin) Hinokiflavone [19202-36-9]; (4',…

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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) -0.33 -8.47 -20.11 8 12 0 211 464.379 4 ↓

Analogs

38241520
38241520
38241522
38241522
4095725
4095725

Draw Identity 99% 90% 80% 70%

Popular Name: Hinokiflavone [19202-36-9]; (4',6"-Biapigenin) Hinokiflavone [19202-36-9]; (4',…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) -0.33 -8.85 -18.15 8 12 0 211 464.379 4 ↓

Analogs

4349271
4349271
4349275
4349275
4349277
4349277

Draw Identity 99% 90% 80% 70%

Popular Name: 6-Hydroxyflavone-b-D-Glucoside 6-Hydroxyflavone-b-D-Glucoside

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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) 1.45 -0.4 -14.74 4 8 0 130 400.383 4 ↓

Analogs

4349271
4349271
4349275
4349275
4349277
4349277

Draw Identity 99% 90% 80% 70%

Popular Name: 6-Hydroxyflavone-b-D-Glucoside 6-Hydroxyflavone-b-D-Glucoside

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.45 -0.87 -14.91 4 8 0 130 400.383 4 ↓

Parameters Provided:

ring.id = 145958
filter.purchasability = annotated
page.format = targets
page.num = 1

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 hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 145958 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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//zinc12.docking.org/results/combination?ring.id=145958&filter.purchasability=annotated

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