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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: 3-[(5S)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]benzoic 3-[(5S)-4-(cyclopropanecarbonyl)…

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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) 4.65 13.98 -135.29 0 6 -2 101 437.451 6 ↓
Mid Mid (pH 6-8) 4.07 12.98 -81.39 0 6 -1 95 438.459 6 ↓
Mid Mid (pH 6-8) 4.65 11.66 -88.48 1 6 -1 98 438.459 5 ↓

Analogs

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Popular Name: 3-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]benzoic 3-[(5R)-4-(cyclopropanecarbonyl)…

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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) 4.65 14.03 -135.36 0 6 -2 101 437.451 6 ↓
Mid Mid (pH 6-8) 4.07 13.14 -80.78 0 6 -1 95 438.459 6 ↓
Mid Mid (pH 6-8) 4.65 11.98 -87.97 1 6 -1 98 438.459 5 ↓

Analogs

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Popular Name: 4-chloro-3-[(5S)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]benzoic 4-chloro-3-[(5S)-4-(cyclopropane…

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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) 5.28 14.73 -111.22 0 6 -2 101 471.896 6 ↓
Mid Mid (pH 6-8) 4.70 13.77 -54.57 0 6 -1 95 472.904 6 ↓
Mid Mid (pH 6-8) 5.28 12.25 -60.91 1 6 -1 98 472.904 5 ↓

Analogs

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Popular Name: 4-chloro-3-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]benzoic 4-chloro-3-[(5R)-4-(cyclopropane…

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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) 5.28 15.06 -119.06 0 6 -2 101 471.896 6 ↓
Mid Mid (pH 6-8) 4.70 14.07 -64.7 0 6 -1 95 472.904 6 ↓
Mid Mid (pH 6-8) 5.28 12.93 -70.53 1 6 -1 98 472.904 5 ↓

Analogs

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Popular Name: 3-[(5S)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]-4-methyl-benzoic 3-[(5S)-4-(cyclopropanecarbonyl)…

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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) 5.05 15.32 -126.39 0 6 -2 101 451.478 6 ↓
Mid Mid (pH 6-8) 4.47 14.3 -71.86 0 6 -1 95 452.486 6 ↓
Mid Mid (pH 6-8) 5.05 13.16 -78.9 1 6 -1 98 452.486 5 ↓

Analogs

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Popular Name: 3-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]-4-methyl-benzoic 3-[(5R)-4-(cyclopropanecarbonyl)…

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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) 5.05 15.4 -128.2 0 6 -2 101 451.478 6 ↓
Mid Mid (pH 6-8) 4.47 14.41 -73.55 0 6 -1 95 452.486 6 ↓
Mid Mid (pH 6-8) 5.05 13.11 -81.09 1 6 -1 98 452.486 5 ↓

Analogs

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Popular Name: 2-[4-[(5S)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]phenyl]acetic 2-[4-[(5S)-4-(cyclopropanecarbon…

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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) 4.19 14.76 -112.57 0 6 -2 101 451.478 7 ↓
Mid Mid (pH 6-8) 3.60 13.84 -66.79 0 6 -1 95 452.486 7 ↓
Mid Mid (pH 6-8) 4.19 12.51 -71.89 1 6 -1 98 452.486 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[4-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(4-phenylphenyl)-5H-pyrrol-1-yl]phenyl]acetic 2-[4-[(5R)-4-(cyclopropanecarbon…

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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) 4.19 14.79 -115.24 0 6 -2 101 451.478 7 ↓
Mid Mid (pH 6-8) 3.60 13.92 -62.92 0 6 -1 95 452.486 7 ↓
Mid Mid (pH 6-8) 4.19 12.69 -68.5 1 6 -1 98 452.486 6 ↓

Parameters Provided:

ring.id = 129248
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 = 129248 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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