UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-(1H-benzimidazol-2-yl)-4-methyl-thiazole 5-(1H-benzimidazol-2-yl)-4-methy…

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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) 2.82 5.14 -9.34 1 3 0 42 215.281 1 ↓

Analogs

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Popular Name: 2-[2-(4-methyl-1,3-thiazol-5-yl)-1H-1,3-benzodiazol-1-yl]acetic acid 2-[2-(4-methyl-1,3-thiazol-5-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) 2.13 7.7 -49.66 0 5 -1 71 272.309 3 ↓
Lo Low (pH 4.5-6) 2.13 7.82 -36.51 1 5 0 72 273.317 3 ↓

Analogs

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Popular Name: 1-methyl-2-(4-methylthiazol-5-yl)benzimidazole-5-carboxylic 1-methyl-2-(4-methylthiazol-5-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) 2.78 7.17 -56.69 0 5 -1 71 272.309 2 ↓

Analogs

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Popular Name: 2-(2,4-dimethylthiazol-5-yl)-3H-benzimidazole-5-carboxylic 2-(2,4-dimethylthiazol-5-yl)-3H-…

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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 6.43 -49.07 1 5 -1 82 272.309 2 ↓

Parameters Provided:

ring.id = 123945
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 = 123945 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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