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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

4227639
4227639

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Popular Name: 2-(4-chlorophenyl)-8-methyl-cinchonin-p-tolyl-ester 2-(4-chlorophenyl)-8-methyl-cinc…

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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) 7.12 3.1 -8.44 0 3 0 39 387.866 4 ↓

Analogs

2578183
2578183
2078927
2078927

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Popular Name: 2-(4-chlorophenyl)-8-methyl-cinchonin-(4-chlorophenyl)-ester 2-(4-chlorophenyl)-8-methyl-cinc…

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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) 7.35 2.61 -7.42 0 3 0 39 408.284 4 ↓

Analogs

2667045
2667045
2079365
2079365
2079400
2079400

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Popular Name: 6-methyl-2-(p-tolyl)cinchonin-(2,3-dimethylphenyl)-ester 6-methyl-2-(p-tolyl)cinchonin-(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) 7.27 3.62 -9.55 0 3 0 39 381.475 4 ↓

Analogs

4227639
4227639

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Popular Name: phenyl 2-(4-chlorophenyl)-8-methyl-4-quinolinecarboxylate phenyl 2-(4-chlorophenyl)-8-meth…

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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) 6.67 2.76 -8.48 0 3 0 39 373.839 4 ↓

Analogs

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Popular Name: 2-(4-bromophenyl)-8-methyl-cinchonin-(4-bromophenyl)-ester 2-(4-bromophenyl)-8-methyl-cinch…

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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) 7.61 1.39 -7.26 0 3 0 39 497.186 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methyl-2-phenyl-cinchonin-o-tolyl-ester 6-methyl-2-phenyl-cinchonin-o-to…

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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) 6.42 3.07 -9.51 0 3 0 39 353.421 4 ↓

Analogs

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Popular Name: 8-methyl-2-(p-tolyl)cinchonin-(4-nitrophenyl)-ester 8-methyl-2-(p-tolyl)cinchonin-(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) 6.40 3.77 -10.39 0 6 0 85 398.418 5 ↓

Analogs

2078925
2078925

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Popular Name: 3-methylphenyl 6-methyl-2-phenyl-4-quinolinecarboxylate 3-methylphenyl 6-methyl-2-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) 6.44 3.07 -9.36 0 3 0 39 353.421 4 ↓

Analogs

2079369
2079369
2079462
2079462

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Popular Name: 2-(4-chlorophenyl)-8-methyl-cinchonin-(2,4-dichlorophenyl)-ester 2-(4-chlorophenyl)-8-methyl-cinc…

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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) 7.96 2.49 -7.85 0 3 0 39 442.729 4 ↓

Analogs

2079412
2079412

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Popular Name: 2-(4-bromophenyl)-6-methyl-cinchonin-(2-isopropyl-5-methyl-phenyl)-ester 2-(4-bromophenyl)-6-methyl-cinch…

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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) 8.24 3.08 -8.5 0 3 0 39 474.398 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-chlorophenyl)-6-methyl-cinchonin-(4-bromophenyl)-ester 2-(4-chlorophenyl)-6-methyl-cinc…

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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) 7.51 1.86 -7.47 0 3 0 39 452.735 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethylphenyl 2-(4-chlorophenyl)-6-methyl-4-quinolinecarboxylate 2,3-dimethylphenyl 2-(4-chloroph…

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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) 7.50 3.15 -8.76 0 3 0 39 401.893 4 ↓

Parameters Provided:

ring.id = 233781
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 = 233781 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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