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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-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-5,6-dimethyl-pyrimidin-4-yl]hydrazine [2-(5-chloro-2,3-dihydro-1,4-ben…

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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) 2.62 5.35 -10.56 3 6 0 82 306.753 2 ↓

Analogs

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Popular Name: [2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-5,6-dimethyl-pyrimidin-4-yl]hydrazine [2-(5-bromo-2,3-dihydro-1,4-benz…

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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) 2.75 5.47 -10.53 3 6 0 82 351.204 2 ↓

Analogs

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Popular Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,6-dimethyl-pyrimidin-4-yl]hydrazine [2-(2,3-dihydro-1,4-benzodioxin-…

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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) 1.82 4.81 -11.31 3 6 0 82 272.308 2 ↓

Analogs

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Popular Name: 4-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-isopropyl-pyrimidine 4-chloro-2-(2,3-dihydro-1,4-benz…

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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) 3.93 7.21 -7.79 0 4 0 44 290.75 2 ↓

Analogs

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Popular Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-chloro-6-isopropyl-pyrimidine 2-(5-bromo-2,3-dihydro-1,4-benzo…

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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) 4.87 7.87 -6.92 0 4 0 44 369.646 2 ↓

Analogs

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Popular Name: 4-chloro-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-6-isopropyl-pyrimidine 4-chloro-2-(5-chloro-2,3-dihydro…

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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) 4.74 7.75 -6.94 0 4 0 44 325.195 2 ↓

Analogs

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Popular Name: 4-tert-butyl-6-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine 4-tert-butyl-6-chloro-2-(2,3-dih…

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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) 4.60 7.96 -7.63 0 4 0 44 304.777 2 ↓

Analogs

38004053
38004053

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Popular Name: 4-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-pyrimidine 4-chloro-2-(2,3-dihydro-1,4-benz…

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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) 3.45 6.78 -8.19 0 4 0 44 276.723 2 ↓

Analogs

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Popular Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-chloro-6-ethyl-pyrimidine 2-(5-bromo-2,3-dihydro-1,4-benzo…

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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) 4.38 7.44 -7.4 0 4 0 44 355.619 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-6-ethyl-pyrimidine 4-chloro-2-(5-chloro-2,3-dihydro…

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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 7.32 -7.41 0 4 0 44 311.168 2 ↓

Parameters Provided:

ring.id = 17090
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 = 17090 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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