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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

Draw Identity 99% 90% 80% 70%

Popular Name: tert-butyl tert-butyl

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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) 3.22 5.66 -9 1 5 0 68 324.446 5 ↓

Analogs

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Popular Name: 1-(2-cyclopentyl-4-methyl-thiazol-5-yl)ethanone 1-(2-cyclopentyl-4-methyl-thiazo…

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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) 2.34 6.24 -6.34 0 2 0 30 209.314 2 ↓

Analogs

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Popular Name: 1-(4-ethyl-5-methyl-thiazol-2-yl)-N-propyl-cyclopentanamine 1-(4-ethyl-5-methyl-thiazol-2-yl…

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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) 3.72 7.78 -32.09 2 2 1 29 253.435 5 ↓
Hi High (pH 8-9.5) 3.72 6.56 -4.39 1 2 0 25 252.427 5 ↓

Analogs

41195086
41195086
69382503
69382503
69382506
69382506
69382508
69382508
69382512
69382512

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Popular Name: 1-(4-isopropylthiazol-2-yl)-N-propyl-cyclopentanamine 1-(4-isopropylthiazol-2-yl)-N-pr…

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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) 3.98 7.68 -32.6 2 2 1 29 253.435 5 ↓
Hi High (pH 8-9.5) 3.98 6.48 -2.91 1 2 0 25 252.427 5 ↓

Analogs

69382503
69382503
69382506
69382506
69382508
69382508
69382512
69382512
41191442
41191442

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-tert-butylthiazol-2-yl)-N-propyl-cyclopentanamine 1-(4-tert-butylthiazol-2-yl)-N-p…

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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) 4.65 8.24 -32.54 2 2 1 29 267.462 5 ↓
Hi High (pH 8-9.5) 4.65 7.04 -2.49 1 2 0 25 266.454 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-ethyl-5-methyl-thiazol-2-yl)-N-isopropyl-cyclopentanamine 1-(4-ethyl-5-methyl-thiazol-2-yl…

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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) 3.51 6.85 -32.99 2 2 1 29 253.435 4 ↓
Hi High (pH 8-9.5) 3.51 6.1 -4.89 1 2 0 25 252.427 4 ↓

Analogs

41197587
41197587
69382564
69382564
69382567
69382567
69382571
69382571
69382577
69382577

Draw Identity 99% 90% 80% 70%

Popular Name: N-isopropyl-1-(4-isopropylthiazol-2-yl)cyclopentanamine N-isopropyl-1-(4-isopropylthiazo…

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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) 3.78 6.68 -35.09 2 2 1 29 253.435 4 ↓
Hi High (pH 8-9.5) 3.78 5.88 -2.5 1 2 0 25 252.427 4 ↓

Analogs

69382564
69382564
69382567
69382567
69382571
69382571
69382577
69382577
41197379
41197379

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-tert-butylthiazol-2-yl)-N-isopropyl-cyclopentanamine 1-(4-tert-butylthiazol-2-yl)-N-i…

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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) 4.44 7.08 -34.91 2 2 1 29 267.462 4 ↓
Hi High (pH 8-9.5) 4.44 6.61 -2.05 1 2 0 25 266.454 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]acetamide 2-[(2-cyclopentylthiazol-4-yl)me…

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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) 0.32 0.26 -26.8 2 5 0 90 288.394 5 ↓

Analogs

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Popular Name: 2-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]-N-ethyl-acetamide 2-[(2-cyclopentylthiazol-4-yl)me…

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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 2.59 -26.29 1 5 0 76 316.448 6 ↓

Analogs

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Popular Name: (2S)-2-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]-N-methyl-propanamide (2S)-2-[(2-cyclopentylthiazol-4-…

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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) 1.06 2.52 -26.16 1 5 0 76 316.448 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]-N-methyl-propanamide (2R)-2-[(2-cyclopentylthiazol-4-…

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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) 1.06 2.77 -25.16 1 5 0 76 316.448 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]-N-methyl-propanamide 3-[(2-cyclopentylthiazol-4-yl)me…

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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) 0.97 2.26 -17.42 1 5 0 76 316.448 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]propanamide 3-[(2-cyclopentylthiazol-4-yl)me…

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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) 0.59 0.78 -17.43 2 5 0 90 302.421 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-cyclopentylthiazol-4-yl)methylsulfonyl]-N-methyl-acetamide 2-[(2-cyclopentylthiazol-4-yl)me…

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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) 0.70 1.74 -26.82 1 5 0 76 302.421 5 ↓

Parameters Provided:

ring.id = 294764
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 = 294764 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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