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

Analogs

36540880
36540880
36542591
36542591
36542592
36542592
36542594
36542594
36542595
36542595

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-(tert-butylamino)-1-(2-methoxy-1-naphthyl)-2-oxo-ethyl]-N-(2-chlorophenyl)cyclohexanecarbo N-[(1R)-2-(tert-butylamino)-1-(2…

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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) 7.32 14.75 -13.73 1 5 0 59 507.074 7 ↓

Analogs

36542591
36542591
36542592
36542592
36542594
36542594
36542595
36542595
36540879
36540879

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2-(tert-butylamino)-1-(2-methoxy-1-naphthyl)-2-oxo-ethyl]-N-(2-chlorophenyl)cyclohexanecarbo N-[(1S)-2-(tert-butylamino)-1-(2…

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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) 7.32 15.07 -10.76 1 5 0 59 507.074 7 ↓

Analogs

36540884
36540884
36542596
36542596
36542597
36542597
36542598
36542598
36542599
36542599

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-(butylamino)-1-(2-methoxy-1-naphthyl)-2-oxo-ethyl]-N-(2-chlorophenyl)cyclohexanecarboxamid N-[(1R)-2-(butylamino)-1-(2-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) 7.57 16.94 -13.94 1 5 0 59 507.074 9 ↓

Analogs

36542596
36542596
36542597
36542597
36542598
36542598
36542599
36542599
36540881
36540881

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2-(butylamino)-1-(2-methoxy-1-naphthyl)-2-oxo-ethyl]-N-(2-chlorophenyl)cyclohexanecarboxamid N-[(1S)-2-(butylamino)-1-(2-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) 7.57 15.39 -11.35 1 5 0 59 507.074 9 ↓

Parameters Provided:

ring.id = 98129
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 = 98129 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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