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

Analogs

36615750
36615750

Draw Identity 99% 90% 80% 70%

Popular Name: (1,5-dimethylpyrazol-4-yl)-dimethyl-BLAHcarboxylic (1,5-dimethylpyrazol-4-yl)-dimet…

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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) 2.10 7.89 -67.06 0 8 -1 101 335.347 2 ↓

Analogs

36615750
36615750

Draw Identity 99% 90% 80% 70%

Popular Name: methyl-(trifluoromethyl)-(1,3,5-trimethylpyrazol-4-yl)BLAHcarboxylic methyl-(trifluoromethyl)-(1,3,5-…

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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 8.54 -59.48 0 8 -1 101 403.344 3 ↓

Analogs

36615750
36615750

Draw Identity 99% 90% 80% 70%

Popular Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)-dimethyl-BLAHcarboxylic (1-ethyl-3,5-dimethyl-pyrazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.70 9.16 -64.69 0 8 -1 101 363.401 3 ↓

Parameters Provided:

ring.id = 74604
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 = 74604 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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