UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(cyclopentylmethyl)-2-(methylamino)imidazo[1,2-a]pyridine-3-sulfonamide N-(cyclopentylmethyl)-2-(methyla…

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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) 2.42 4.72 -12.61 2 6 0 76 308.407 5 ↓

Analogs

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Popular Name: 2-amino-N-(cyclopentylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide 2-amino-N-(cyclopentylmethyl)imi…

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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) 2.05 3.72 -12.16 3 6 0 89 294.38 4 ↓

Analogs

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Popular Name: 2-chloro-N-[(1S)-1-cyclopentylethyl]imidazo[1,2-a]pyridine-3-sulfonamide 2-chloro-N-[(1S)-1-cyclopentylet…

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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) 3.57 5.63 -12.85 1 5 0 63 327.837 4 ↓

Analogs

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Popular Name: 2-chloro-N-[(1R)-1-cyclopentylethyl]imidazo[1,2-a]pyridine-3-sulfonamide 2-chloro-N-[(1R)-1-cyclopentylet…

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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) 3.57 5.39 -12.89 1 5 0 63 327.837 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-N-[(1S)-1-cyclopentylethyl]imidazo[1,2-a]pyridine-3-sulfonamide 2-amino-N-[(1S)-1-cyclopentyleth…

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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) 2.38 4.35 -12.02 3 6 0 89 308.407 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-N-[(1R)-1-cyclopentylethyl]imidazo[1,2-a]pyridine-3-sulfonamide 2-amino-N-[(1R)-1-cyclopentyleth…

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) 2.38 3.9 -11.96 3 6 0 89 308.407 4 ↓

Parameters Provided:

ring.id = 11526
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 = 11526 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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