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

Draw Identity 99% 90% 80% 70%

Popular Name: (8S)-2-amino-8-(4-imidazol-1-ylphenyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8S)-2-amino-8-(4-imidazol-1-ylp…

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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) 0.86 5.75 -13.56 3 6 0 86 325.397 2 ↓
Lo Low (pH 4.5-6) 0.86 6.69 -85.66 5 6 2 88 327.413 2 ↓
Lo Low (pH 4.5-6) 0.86 6.27 -41.44 4 6 1 87 326.405 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (8R)-2-amino-8-(4-imidazol-1-ylphenyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8R)-2-amino-8-(4-imidazol-1-ylp…

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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) 0.86 5.75 -13.53 3 6 0 86 325.397 2 ↓
Lo Low (pH 4.5-6) 0.86 6.69 -85.66 5 6 2 88 327.413 2 ↓
Lo Low (pH 4.5-6) 0.86 6.26 -41.4 4 6 1 87 326.405 2 ↓

Parameters Provided:

ring.id = 419419
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 = 419419 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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