UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

9908889
9908889
9908891
9908891
9908892
9908892

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide N-(1,1-dioxothiolan-3-yl)-N-meth…

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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) 3.36 -3.57 -22 0 6 0 80 441.578 5 ↓

Analogs

9908889
9908889
9908891
9908891
9908892
9908892

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide N-(1,1-dioxothiolan-3-yl)-N-meth…

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) 3.36 -3.49 -20.95 0 6 0 80 441.578 5 ↓

Analogs

9908889
9908889
9908891
9908891
9908892
9908892

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide N-(1,1-dioxothiolan-3-yl)-N-meth…

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) 3.36 -3.57 -21.9 0 6 0 80 441.578 5 ↓

Analogs

9908889
9908889
9908891
9908891
9908892
9908892

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide N-(1,1-dioxothiolan-3-yl)-N-meth…

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) 3.36 -3.55 -21.95 0 6 0 80 441.578 5 ↓

Parameters Provided:

ring.id = 45273
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 = 45273 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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