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Analogs

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Popular Name: 4-tert-butyl-N-(oxoBLAHyl)benzamide 4-tert-butyl-N-(oxoBLAHyl)benzamide

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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) 5.06 10.64 -12.36 1 5 0 59 406.526 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-tert-butyl-N-(oxoBLAHyl)benzamide 4-tert-butyl-N-(oxoBLAHyl)benzamide

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) 5.06 10.65 -13.81 1 5 0 59 406.526 3 ↓

Analogs

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Popular Name: 4-acetamido-N-(oxoBLAHyl)benzamide 4-acetamido-N-(oxoBLAHyl)benzamide

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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) 2.57 7.22 -20.13 2 7 0 88 407.47 3 ↓

Analogs

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Popular Name: 4-acetamido-N-(oxoBLAHyl)benzamide 4-acetamido-N-(oxoBLAHyl)benzamide

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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) 2.57 7.21 -22.37 2 7 0 88 407.47 3 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-3,5-bis(trifluoromethyl)benzamide N-(oxoBLAHyl)-3,5-bis(trifluorom…

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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) 5.07 10.33 -18.62 1 5 0 59 486.412 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(oxoBLAHyl)-3,5-bis(trifluoromethyl)benzamide N-(oxoBLAHyl)-3,5-bis(trifluorom…

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) 5.07 10.31 -13.8 1 5 0 59 486.412 4 ↓

Parameters Provided:

ring.id = 577850
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 = 577850 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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