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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: (4S)-3-phenyl-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6 (4S)-3-phenyl-5-[[(2S)-tetrahydr…

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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) 3.28 8.31 -9.74 1 5 0 58 365.458 4 ↓

Analogs

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Popular Name: (4R)-3-phenyl-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6 (4R)-3-phenyl-5-[[(2S)-tetrahydr…

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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) 3.28 8.6 -12.82 1 5 0 58 365.458 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3-phenyl-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6 (4S)-3-phenyl-5-[[(2R)-tetrahydr…

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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) 3.28 8.32 -12.5 1 5 0 58 365.458 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-phenyl-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6 (4R)-3-phenyl-5-[[(2R)-tetrahydr…

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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) 3.28 8.19 -13.19 1 5 0 58 365.458 4 ↓

Analogs

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Popular Name: (4S)-3-(4-chlorophenyl)-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c (4S)-3-(4-chlorophenyl)-5-[[(2S)…

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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) 3.96 8.38 -11.48 1 5 0 58 399.903 4 ↓

Analogs

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Popular Name: (4R)-3-(4-chlorophenyl)-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c (4R)-3-(4-chlorophenyl)-5-[[(2S)…

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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) 3.96 9.12 -12.02 1 5 0 58 399.903 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3-(4-chlorophenyl)-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c (4S)-3-(4-chlorophenyl)-5-[[(2R)…

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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) 3.96 8.85 -11.52 1 5 0 58 399.903 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-(4-chlorophenyl)-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c (4R)-3-(4-chlorophenyl)-5-[[(2R)…

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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) 3.96 9.19 -8.66 1 5 0 58 399.903 4 ↓

Analogs

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Popular Name: (4S)-3-(4-methoxyphenyl)-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4- (4S)-3-(4-methoxyphenyl)-5-[[(2S…

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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) 3.34 7.61 -9.97 1 6 0 67 395.484 5 ↓

Analogs

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Popular Name: (4R)-3-(4-methoxyphenyl)-5-[[(2S)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4- (4R)-3-(4-methoxyphenyl)-5-[[(2S…

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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) 3.34 7.89 -13.05 1 6 0 67 395.484 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3-(4-methoxyphenyl)-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4- (4S)-3-(4-methoxyphenyl)-5-[[(2R…

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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) 3.34 7.62 -12.68 1 6 0 67 395.484 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-(4-methoxyphenyl)-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thienyl)-1,4-dihydropyrrolo[3,4- (4R)-3-(4-methoxyphenyl)-5-[[(2R…

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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) 3.34 7.49 -13.5 1 6 0 67 395.484 5 ↓

Parameters Provided:

ring.id = 20747
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 = 20747 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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