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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: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyri 2-[[5-(4-chlorophenyl)-4-phenyl-…

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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) 4.03 12.75 -63.82 1 9 -1 130 492.924 6 ↓
Mid Mid (pH 6-8) 4.49 10.29 -130.01 0 9 -2 133 491.916 6 ↓

Analogs

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Popular Name: 2-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidi 2-[[4,5-bis(4-fluorophenyl)-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) 3.68 12.37 -63.04 1 9 -1 130 494.459 6 ↓
Mid Mid (pH 6-8) 4.14 9.9 -127.56 0 9 -2 133 493.451 6 ↓

Analogs

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

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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) 4.25 13.51 -65.07 1 9 -1 130 486.533 6 ↓
Mid Mid (pH 6-8) 4.71 11.04 -132.87 0 9 -2 133 485.525 6 ↓

Analogs

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

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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) 4.39 13.38 -65.36 1 9 -1 130 486.533 6 ↓
Mid Mid (pH 6-8) 4.85 10.91 -133.62 0 9 -2 133 485.525 6 ↓

Analogs

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

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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) 3.52 12.3 -64.22 1 9 -1 130 476.469 6 ↓
Mid Mid (pH 6-8) 3.98 9.83 -130.27 0 9 -2 133 475.461 6 ↓

Analogs

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

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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) 3.82 10.67 -70.1 1 9 -1 130 494.459 6 ↓

Analogs

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

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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) 3.35 12.23 -65.75 1 9 -1 130 458.479 6 ↓
Mid Mid (pH 6-8) 3.81 9.76 -133.35 0 9 -2 133 457.471 6 ↓

Analogs

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

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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) 3.41 11.53 -65.54 1 10 -1 139 488.505 7 ↓
Mid Mid (pH 6-8) 3.87 9.06 -132.54 0 10 -2 142 487.497 7 ↓

Analogs

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

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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) 3.92 13.08 -68.17 1 9 -1 130 490.496 6 ↓
Mid Mid (pH 6-8) 4.38 10.61 -135.81 0 9 -2 133 489.488 6 ↓

Parameters Provided:

ring.id = 117189
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 = 117189 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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