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

Analogs

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Popular Name: 1-ethyl-3-methyl-7-(4-methylsulfonylpiperazin-1-yl)pyrazolo[4,3-d]pyrimidine 1-ethyl-3-methyl-7-(4-methylsulf…

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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) 0.18 3.92 -12.53 0 8 0 84 324.41 3 ↓

Analogs

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Popular Name: 1-ethyl-3-methyl-7-(4-methylpiperazin-1-yl)pyrazolo[4,3-d]pyrimidine 1-ethyl-3-methyl-7-(4-methylpipe…

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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) 0.80 7.28 -44.9 1 6 1 51 261.353 2 ↓
Mid Mid (pH 6-8) 0.80 4.94 -6.52 0 6 0 50 260.345 2 ↓

Analogs

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Popular Name: 1-ethyl-3-methyl-7-(4-propylpiperazin-1-yl)pyrazolo[4,3-d]pyrimidine 1-ethyl-3-methyl-7-(4-propylpipe…

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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) 1.68 8.7 -44.27 1 6 1 51 289.407 4 ↓
Hi High (pH 8-9.5) 1.68 6.48 -6.26 0 6 0 50 288.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-7-(4-ethylpiperazin-1-yl)-3-methyl-pyrazolo[4,3-d]pyrimidine 1-ethyl-7-(4-ethylpiperazin-1-yl…

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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) 1.18 7.94 -43.45 1 6 1 51 275.38 3 ↓
Mid Mid (pH 6-8) 1.18 5.73 -6.36 0 6 0 50 274.372 3 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 1.25 7.08 -9.69 0 8 0 76 318.381 4 ↓

Analogs

41528120
41528120

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Popular Name: 1H-Pyrazolo[4,3-d]pyrimidine, 3-methyl-7-(4-methyl-1-piperazinyl)- 1H-Pyrazolo[4,3-d]pyrimidine, 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) 0.36 4.81 -41.34 2 6 1 62 233.299 1 ↓
Mid Mid (pH 6-8) 0.36 3.36 -9.13 1 6 0 61 232.291 1 ↓

Analogs

41528117
41528117

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Popular Name: 1H-Pyrazolo[4,3-d]pyrimidine, 7-(4-ethyl-1-piperazinyl)-3-methyl- 1H-Pyrazolo[4,3-d]pyrimidine, 7-…

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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) 0.73 5.47 -39.96 2 6 1 62 247.326 2 ↓
Hi High (pH 8-9.5) 0.73 4.17 -8.85 1 6 0 61 246.318 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-Piperazinecarboxylic acid, 4-(3-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl)-, ethyl ester 1-Piperazinecarboxylic acid, 4-(…

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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) 0.81 4.62 -9.01 1 8 0 87 290.327 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1H-Pyrazolo[4,3-d]pyrimidine, 3-methyl-7-[4-(methylsulfonyl)-1-piperazinyl]- 1H-Pyrazolo[4,3-d]pyrimidine, 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) -0.27 1.45 -12.11 1 8 0 95 296.356 2 ↓

Parameters Provided:

ring.id = 170925
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 = 170925 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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