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

Analogs

33780914
33780914
33780916
33780916
33780918
33780918
12463159
12463159
8816942
8816942

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-9-methyl-2-(phenethylamino) 3-[(Z)-[3-(3-methoxypropyl)-4-ox…

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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) 3.38 13.61 -15.93 1 7 0 78 494.642 9 ↓

Analogs

12463158
12463158
1166246
1166246
1251487
1251487

Draw Identity 99% 90% 80% 70%

Popular Name: (5Z)-5-[[4-keto-7-methyl-2-(phenethylamino)pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-methyl-2-thioxo- (5Z)-5-[[4-keto-7-methyl-2-(phen…

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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) 3.12 -1.42 -14.2 1 6 0 68 436.562 5 ↓

Analogs

6581283
6581283
16805835
16805835
1826491
1826491
1826492
1826492

Draw Identity 99% 90% 80% 70%

Popular Name: (5Z)-5-[[4-keto-2-(phenethylamino)pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-(2-methoxyethyl)-2-thioxo (5Z)-5-[[4-keto-2-(phenethylamin…

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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) 2.70 -1.78 -16.76 0 1 0 77 466.588 7 ↓

Parameters Provided:

ring.id = 133768
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 = 133768 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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