UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-1-(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)-N-methyl-methanami N-[(2-chloro-6-fluoro-phenyl)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) 3.23 10.2 -16 0 4 0 33 332.81 4 ↓

Analogs

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Popular Name: N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-[(3-fluorophenyl)methyl]ethanamine N-[(5,7-dimethylimidazo[1,2-a]py…

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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 13.24 -42.03 1 4 1 35 313.4 5 ↓
Mid Mid (pH 6-8) 3.00 10.63 -15.98 0 4 0 33 312.392 5 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.34 11.01 -22.24 0 6 0 60 338.411 7 ↓
Lo Low (pH 4.5-6) 2.34 13.28 -39.24 1 6 1 61 339.419 7 ↓

Parameters Provided:

ring.id = 159925
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 = 159925 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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