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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: 3-(7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propanoic 3-(7-phenyl-[1,2,4]triazolo[1,5-…

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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) 1.32 0.45 -61.88 0 6 -1 83 267.268 4 ↓

Analogs

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Popular Name: 3-[7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanoic 3-[7-(4-fluorophenyl)-[1,2,4]tri…

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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) 1.48 1.19 -61.7 0 6 -1 83 285.258 4 ↓

Analogs

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Popular Name: 3-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanoic 3-[7-(4-methoxyphenyl)-[1,2,4]tr…

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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) 1.37 0.48 -61.53 0 7 -1 92 297.294 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[7-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanoic 3-[7-(3,4-dimethoxyphenyl)-[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) 0.96 0.81 -61.95 0 8 -1 102 327.32 6 ↓

Analogs

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Popular Name: 7-(3-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine 7-(3-chlorophenyl)[1,2,4]triazol…

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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) 1.97 9.28 -13.56 2 5 0 69 245.673 1 ↓

Analogs

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Popular Name: 7-(2,4-dichlorophenyl)-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine 7-(2,4-dichlorophenyl)-2-(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) 3.72 -0.07 -11.46 0 4 0 43 311.197 2 ↓

Analogs

4019059
4019059

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(methylsulfanyl)-7-phenyl-5-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine 2-(methylsulfanyl)-7-phenyl-5-(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) 3.79 10.42 -9.85 0 4 0 43 310.304 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine 7-(4-methoxyphenyl)-[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) 1.57 8.38 -14.32 0 5 0 52 226.239 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-(m-tolyl)-[1,2,4]triazolo[1,5-a]pyrimidine 7-(m-tolyl)-[1,2,4]triazolo[1,5-…

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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 9.85 -14.41 0 4 0 43 210.24 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-(3-nitrophenyl)-2,6,7,9-tetrazabicyclo[4.3.0]nona-2,4,7,9-tetraene 5-(3-nitrophenyl)-2,6,7,9-tetraz…

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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) 1.45 9.85 -14.62 0 7 0 89 241.21 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-(4-methoxyphenyl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine 7-(4-methoxyphenyl)-2-(trifluoro…

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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) 2.57 8.52 -14.84 0 5 0 52 294.236 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(methoxymethyl)-7-(2-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine 2-(methoxymethyl)-7-(2-methoxyph…

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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) 1.58 7.25 -16.81 0 6 0 62 270.292 4 ↓

Parameters Provided:

ring.id = 99590
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 = 99590 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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