UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (2,6-difluorophenyl)-N-(3-(tert-butyl)-1-methyl-4-oxoindeno[2,3-d]pyrazol-6-yl)formamide (2,6-difluorophenyl)-N-(3-(tert-…

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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) 4.82 9.82 -22.7 1 5 0 64 395.409 3 ↓

Analogs

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Popular Name: N-(3-(tert-butyl)-1-methyl-4-oxoindeno[2,3-d]pyrazol-6-yl)((3-(trifluoromethyl)phenyl)amino)formamide N-(3-(tert-butyl)-1-methyl-4-oxo…

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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) 5.77 10.06 -20.78 2 6 0 76 442.441 4 ↓

Analogs

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Popular Name: 3-(tert-butyl)-1-methyl-6-((((4-nitrophenyl)amino)thioxomethyl)amino)indeno[2,3-d]pyrazol-4-one 3-(tert-butyl)-1-methyl-6-((((4-…

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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) 4.13 11.82 -28.62 2 8 0 105 435.509 6 ↓

Analogs

8536356
8536356
13492117
13492117

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Popular Name: 3-(3,4-dimethoxyphenyl)indeno[2,3-d]pyrazol-4-one, 98% 3-(3,4-dimethoxyphenyl)indeno[2,…

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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) 3.02 6.97 -12.34 1 5 0 64 306.321 3 ↓
Ref Reference (pH 7) 3.02 6.89 -13.67 1 5 0 64 306.321 3 ↓

Parameters Provided:

ring.id = 18718
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 = 18718 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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