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

Analogs

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Popular Name: 2-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(3-thienyl)-5H-pyrrol-1-yl]-1,3-benzothiazole-6-c 2-[(5R)-4-(cyclopropanecarbonyl)…

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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) 3.00 10.46 -99.19 0 7 -2 113 424.459 5 ↓
Mid Mid (pH 6-8) 2.42 9.49 -56.79 0 7 -1 107 425.467 5 ↓
Mid Mid (pH 6-8) 3.00 8.15 -62.3 1 7 -1 111 425.467 4 ↓

Analogs

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Popular Name: 2-[(5S)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(3-thienyl)-5H-pyrrol-1-yl]-1,3-benzothiazole-6-c 2-[(5S)-4-(cyclopropanecarbonyl)…

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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) 3.00 10.45 -99.8 0 7 -2 113 424.459 5 ↓
Mid Mid (pH 6-8) 2.42 9.61 -58.32 0 7 -1 107 425.467 5 ↓
Mid Mid (pH 6-8) 3.00 8.27 -63.76 1 7 -1 111 425.467 4 ↓

Parameters Provided:

ring.id = 130601
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 = 130601 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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