UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11813567
11813567
4184769
4184769

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Popular Name: (2,4-dimethylthiazol-5-yl)-[(1R)-1-(m-tolyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methanone (2,4-dimethylthiazol-5-yl)-[(1R)…

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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) 4.51 -0.63 -11.38 1 4 0 49 401.535 2 ↓

Analogs

4184769
4184769
11813565
11813565

Draw Identity 99% 90% 80% 70%

Popular Name: (2,4-dimethylthiazol-5-yl)-[(1S)-1-(m-tolyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methanone (2,4-dimethylthiazol-5-yl)-[(1S)…

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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) 4.51 -0.6 -11.54 1 4 0 49 401.535 2 ↓

Parameters Provided:

ring.id = 46653
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 = 46653 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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