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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
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Analogs

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Popular Name: 4-(azetidin-3-yloxymethyl)-2-methyl-thiazole 4-(azetidin-3-yloxymethyl)-2-met…

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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) 0.41 1.7 -40.67 2 3 1 39 185.272 3 ↓
Hi High (pH 8-9.5) 0.41 0 -4.54 1 3 0 34 184.264 3 ↓

Analogs

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Popular Name: 4-(azetidin-3-yloxymethyl)thiazole 4-(azetidin-3-yloxymethyl)thiazole

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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 0.96 -39.63 2 3 1 39 171.245 3 ↓
Hi High (pH 8-9.5) 0.70 -0.74 -5.67 1 3 0 34 170.237 3 ↓

Analogs

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Popular Name: 4-(azetidin-3-yloxymethyl)-2-isopropyl-thiazole 4-(azetidin-3-yloxymethyl)-2-iso…

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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) 1.47 3.07 -40.33 2 3 1 39 213.326 4 ↓
Hi High (pH 8-9.5) 1.47 1.37 -4.17 1 3 0 34 212.318 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(azetidin-3-yloxymethyl)-2-ethyl-thiazole 4-(azetidin-3-yloxymethyl)-2-eth…

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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) 0.98 2.46 -40.46 2 3 1 39 199.299 4 ↓
Hi High (pH 8-9.5) 0.98 0.76 -4.24 1 3 0 34 198.291 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(azetidin-3-yloxymethyl)-2-propyl-thiazole 4-(azetidin-3-yloxymethyl)-2-pro…

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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) 1.49 3.23 -40.25 2 3 1 39 213.326 5 ↓
Hi High (pH 8-9.5) 1.49 1.53 -4.01 1 3 0 34 212.318 5 ↓

Parameters Provided:

ring.id = 277372
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 = 277372 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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