UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

48735824
48735824
48735827
48735827
28199525
28199525
28199523
28199523
28199524
28199524

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Popular Name: (3S)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)piperidine-3-carboxylic (3S)-1-(2-imidazo[2,1-b]thiazol-…

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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) 0.82 7.84 -67.23 0 6 -1 78 292.34 3 ↓

Analogs

48735824
48735824
48735827
48735827
28199525
28199525
28199523
28199523
28199524
28199524

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)piperidine-3-carboxylic (3R)-1-(2-imidazo[2,1-b]thiazol-…

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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) 0.82 7.8 -67.56 0 6 -1 78 292.34 3 ↓

Analogs

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Popular Name: (3R)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-N-propyl-piperidine-3-carboxamide (3R)-1-(2-imidazo[2,1-b]thiazol-…

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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) 1.56 7.06 -20.48 1 6 0 67 334.445 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-N-propyl-piperidine-3-carboxamide (3S)-1-(2-imidazo[2,1-b]thiazol-…

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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) 1.56 7.06 -20.93 1 6 0 67 334.445 5 ↓

Analogs

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Popular Name: 1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-4-methyl-piperidine-4-carboxylic 1-(2-imidazo[2,1-b]thiazol-6-yla…

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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) 1.07 8.13 -60.1 0 6 -1 78 306.367 3 ↓

Analogs

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Popular Name: (3S)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-3-methyl-piperidine-3-carboxylic (3S)-1-(2-imidazo[2,1-b]thiazol-…

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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) 1.07 8.55 -67.75 0 6 -1 78 306.367 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-3-methyl-piperidine-3-carboxylic (3R)-1-(2-imidazo[2,1-b]thiazol-…

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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) 1.07 8.57 -67.73 0 6 -1 78 306.367 3 ↓

Analogs

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Popular Name: (3S,6R)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-6-methyl-piperidine-3-carboxamide (3S,6R)-1-(2-imidazo[2,1-b]thiaz…

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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) 0.64 4.51 -23.58 2 6 0 81 306.391 3 ↓

Analogs

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Popular Name: (3S,6S)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-6-methyl-piperidine-3-carboxamide (3S,6S)-1-(2-imidazo[2,1-b]thiaz…

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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) 0.64 4.55 -22.61 2 6 0 81 306.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-6-methyl-piperidine-3-carboxamide (3R,6R)-1-(2-imidazo[2,1-b]thiaz…

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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) 0.64 4.57 -23.2 2 6 0 81 306.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6S)-1-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-6-methyl-piperidine-3-carboxamide (3R,6S)-1-(2-imidazo[2,1-b]thiaz…

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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) 0.64 4.79 -27.29 2 6 0 81 306.391 3 ↓

Parameters Provided:

ring.id = 128088
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 = 128088 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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