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

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Popular Name: 6-methyl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine- 6-methyl-2-[[5-methyl-4-(m-tolyl…

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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) 1.96 10.3 -64.33 1 9 -1 130 410.435 5 ↓
Mid Mid (pH 6-8) 2.42 7.84 -131.39 0 9 -2 133 409.427 5 ↓

Analogs

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Popular Name: 6-methyl-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine-5-carboxy 6-methyl-2-[[4-(o-tolyl)-1,2,4-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) 1.85 10.08 -63.6 1 9 -1 130 396.408 5 ↓
Mid Mid (pH 6-8) 2.31 7.61 -129.95 0 9 -2 133 395.4 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methyl-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine- 6-methyl-2-[[5-methyl-4-(o-tolyl…

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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) 1.94 10.45 -64.09 1 9 -1 130 410.435 5 ↓
Mid Mid (pH 6-8) 2.40 7.99 -130.98 0 9 -2 133 409.427 5 ↓

Analogs

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Popular Name: 6-methyl-4-oxo-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-furo[5,4-d]pyrimidine-5-carboxylic 6-methyl-4-oxo-2-[(4-phenyl-1,2,…

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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) 1.24 9.73 -64.24 1 9 -1 130 382.381 5 ↓
Mid Mid (pH 6-8) 1.70 7.27 -131.05 0 9 -2 133 381.373 5 ↓

Analogs

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Popular Name: 6-methyl-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine- 6-methyl-2-[[5-methyl-4-(p-tolyl…

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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) 1.78 10.25 -64.09 1 9 -1 130 410.435 5 ↓
Mid Mid (pH 6-8) 2.23 7.78 -131.23 0 9 -2 133 409.427 5 ↓

Analogs

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Popular Name: 6-methyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine-5-c 6-methyl-2-[(5-methyl-4-phenyl-1…

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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) 1.33 9.71 -64.53 1 9 -1 130 396.408 5 ↓
Mid Mid (pH 6-8) 1.78 7.24 -131.19 0 9 -2 133 395.4 5 ↓

Parameters Provided:

ring.id = 136127
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 = 136127 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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