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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: (2R)-1-(6-chloropyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2R)-1-(6-chloropyrimidin-4-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) 3.80 8.55 -5.26 0 3 0 29 259.74 1 ↓

Analogs

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Popular Name: (2S)-1-(6-chloropyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2S)-1-(6-chloropyrimidin-4-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) 3.80 8.93 -5.22 0 3 0 29 259.74 1 ↓

Analogs

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Popular Name: 1-(6-chloropyrimidin-4-yl)-6-methyl-3,4-dihydro-2H-quinoline 1-(6-chloropyrimidin-4-yl)-6-met…

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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) 3.89 9.06 -5.31 0 3 0 29 259.74 1 ↓

Analogs

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Popular Name: (2S)-1-(2-chloro-6-methyl-pyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2S)-1-(2-chloro-6-methyl-pyrimi…

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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) 4.21 8.92 -7.32 0 3 0 29 273.767 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-(2-chloro-6-methyl-pyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2R)-1-(2-chloro-6-methyl-pyrimi…

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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) 4.21 8.5 -7.37 0 3 0 29 273.767 1 ↓

Analogs

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Popular Name: 1-(2-chloro-6-methyl-pyrimidin-4-yl)-6-methyl-3,4-dihydro-2H-quinoline 1-(2-chloro-6-methyl-pyrimidin-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) 4.31 9.06 -7.33 0 3 0 29 273.767 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-chloro-6-methyl-pyrimidin-4-yl)-3,4-dihydro-2H-quinoline 1-(2-chloro-6-methyl-pyrimidin-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) 3.88 8.39 -7.33 0 3 0 29 259.74 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-(6-chloro-2-methyl-pyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2S)-1-(6-chloro-2-methyl-pyrimi…

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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) 3.88 8.87 -5.41 0 3 0 29 273.767 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-(6-chloro-2-methyl-pyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline (2R)-1-(6-chloro-2-methyl-pyrimi…

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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) 3.88 8.46 -5.54 0 3 0 29 273.767 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(6-chloro-2-methyl-pyrimidin-4-yl)-6-methyl-3,4-dihydro-2H-quinoline 1-(6-chloro-2-methyl-pyrimidin-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) 3.98 9.01 -5.52 0 3 0 29 273.767 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(6-chloro-2-methyl-pyrimidin-4-yl)-3,4-dihydro-2H-quinoline 1-(6-chloro-2-methyl-pyrimidin-4…

Find On: PubMed — Wikipedia — Google

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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) 3.55 8.34 -5.51 0 3 0 29 259.74 1 ↓

Parameters Provided:

ring.id = 21758
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 = 21758 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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