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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

33785497
33785497

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Popular Name: (5E)-5-[(4,5-dibromo-2-furyl)methylene]-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-5-[(4,5-dibromo-2-furyl)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) 3.53 8.84 -38.78 0 5 -1 71 473.097 2 ↓
Lo Low (pH 4.5-6) 3.07 9.91 -10.43 1 5 0 68 474.105 2 ↓

Analogs

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Popular Name: (5Z)-5-(2-furylmethylene)-1-(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione (5Z)-5-(2-furylmethylene)-1-(p-t…

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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) 2.14 7.28 -49.12 0 5 -1 71 311.342 2 ↓
Lo Low (pH 4.5-6) 1.68 9.25 -11.73 1 5 0 68 312.35 2 ↓

Analogs

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Popular Name: (5Z)-5-[(5-methyl-2-furyl)methylene]-1-(m-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione (5Z)-5-[(5-methyl-2-furyl)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) 2.55 8.1 -50.56 0 5 -1 71 325.369 2 ↓
Lo Low (pH 4.5-6) 2.09 10.06 -12.1 1 5 0 68 326.377 2 ↓

Analogs

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Popular Name: (5Z)-1-(3-chlorophenyl)-5-(2-furylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione (5Z)-1-(3-chlorophenyl)-5-(2-fur…

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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) 2.56 7.12 -46.72 0 5 -1 71 331.76 2 ↓
Lo Low (pH 4.5-6) 2.10 9.09 -11.43 1 5 0 68 332.768 2 ↓

Parameters Provided:

ring.id = 112314
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 = 112314 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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