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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

9561047
9561047
9561048
9561048
9561049
9561049
9560860
9560860
9560861
9560861

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-azepan-1-ylpropyl)-2-(2-methoxyethyl)-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-ca N-(3-azepan-1-ylpropyl)-2-(2-met…

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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) 3.29 14.25 -57.95 2 7 1 68 517.694 9 ↓

Analogs

9561048
9561048
9561049
9561049
9560920
9560920
9560921
9560921
9560922
9560922

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-azepan-1-ylpropyl)-2-(2-methoxyethyl)-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-ca N-(3-azepan-1-ylpropyl)-2-(2-met…

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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) 3.29 14.24 -52.24 2 7 1 68 517.694 9 ↓

Analogs

9561049
9561049
9560920
9560920
9560921
9560921
9560922
9560922
9560923
9560923

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-azepan-1-ylpropyl)-2-(2-methoxyethyl)-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-ca N-(3-azepan-1-ylpropyl)-2-(2-met…

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) 3.29 15.16 -51.91 2 7 1 68 517.694 9 ↓

Analogs

9560920
9560920
9560921
9560921
9560922
9560922
9560923
9560923
9561046
9561046

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-azepan-1-ylpropyl)-2-(2-methoxyethyl)-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-ca N-(3-azepan-1-ylpropyl)-2-(2-met…

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) 3.29 14.8 -51.68 2 7 1 68 517.694 9 ↓

Parameters Provided:

ring.id = 7701
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 = 7701 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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