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

Analogs

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Popular Name: [2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-4-cyclopropyl-thiazol-5-yl]methanamine [2-[(1R,4S)-2-azabicyclo[2.2.1]h…

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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) 2.00 6.34 -47.28 3 3 1 44 250.391 3 ↓
Mid Mid (pH 6-8) 2.00 5.95 -6.96 2 3 0 42 249.383 3 ↓

Analogs

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Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]-2-methyl-propan-1- N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 3.49 10.55 -40.87 2 3 1 33 306.499 6 ↓
Hi High (pH 8-9.5) 3.49 9.32 -5.6 1 3 0 28 305.491 6 ↓

Analogs

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Popular Name: 1-[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]-N-methyl-methanamine 1-[2-[(1S,4R)-5-azabicyclo[2.2.1…

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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) 2.37 8.24 -41.4 2 3 1 33 264.418 4 ↓
Hi High (pH 8-9.5) 2.37 6.8 -6.17 1 3 0 28 263.41 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]ethanamine N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 2.75 9.1 -40.29 2 3 1 33 278.445 5 ↓
Hi High (pH 8-9.5) 2.75 7.73 -5.9 1 3 0 28 277.437 5 ↓

Analogs

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Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]propan-1-amine N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 3.25 9.85 -41 2 3 1 33 292.472 6 ↓
Hi High (pH 8-9.5) 3.25 8.49 -5.8 1 3 0 28 291.464 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]-2-methyl-propan-2- N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 3.56 10.05 -36.32 2 3 1 33 306.499 5 ↓
Hi High (pH 8-9.5) 3.56 8.83 -5.69 1 3 0 28 305.491 5 ↓

Analogs

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Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]-2-methoxy-ethanami N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 2.36 8.24 -40.81 2 4 1 42 308.471 7 ↓
Mid Mid (pH 6-8) 2.36 6.88 -7.17 1 4 0 37 307.463 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-cyclopropyl-thiazol-5-yl]methyl]propan-2-amine N-[[2-[(1S,4R)-5-azabicyclo[2.2.…

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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) 3.04 9.62 -38.24 2 3 1 33 292.472 5 ↓
Hi High (pH 8-9.5) 3.04 8.41 -5.84 1 3 0 28 291.464 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-4-cyclopropyl-thiazole-5-carbaldehyde 2-[(1R,4S)-2-azabicyclo[2.2.1]he…

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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) 2.60 8.03 -9.92 0 3 0 33 248.351 3 ↓

Analogs

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Popular Name: 2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-4-cyclopropyl-thiazole-5-carboxylic 2-[(1R,4S)-2-azabicyclo[2.2.1]he…

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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 8.84 -55.54 0 4 -1 56 263.342 3 ↓
Mid Mid (pH 6-8) 2.38 9.23 -38.71 1 4 0 58 264.35 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-4-cyclopropyl-thiazol-5-yl]methanol [2-[(1R,4S)-2-azabicyclo[2.2.1]h…

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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) 2.15 5.63 -9.03 1 3 0 36 250.367 3 ↓
Mid Mid (pH 6-8) 2.15 6.02 -21.84 2 3 1 38 251.375 3 ↓

Parameters Provided:

ring.id = 304918
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 = 304918 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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