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Popular Name: 4-[(N'Z)-N'-[3-methyl-1-(morpholinomethyl)-5-oxo-pyrazol-4-ylidene]hydrazino]benzoic 4-[(N'Z)-N'-[3-methyl-1-(morphol…

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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) 1.22 3.97 -49.25 1 9 -1 112 344.351 5 ↓
Lo Low (pH 4.5-6) 1.22 6.36 -73.8 2 9 0 113 345.359 5 ↓

Analogs

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Popular Name: (4Z)-5-methyl-2-(morpholinomethyl)-4-[(2,4,5-trichlorophenyl)hydrazono]pyrazol-3-one (4Z)-5-methyl-2-(morpholinomethy…

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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) 3.20 4.92 -7.39 1 7 0 72 404.685 4 ↓
Lo Low (pH 4.5-6) 3.20 7.31 -36.82 2 7 1 73 405.693 4 ↓

Parameters Provided:

ring.id = 136333
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 = 136333 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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