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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: (2S)-2-(bromomethyl)-5-(p-tolyl)-3,4-dihydro-2H-pyrrole (2S)-2-(bromomethyl)-5-(p-tolyl)…

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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) 3.42 6.8 -5.36 0 1 0 12 252.155 2 ↓

Analogs

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Popular Name: (2R)-2-(bromomethyl)-5-(p-tolyl)-3,4-dihydro-2H-pyrrole (2R)-2-(bromomethyl)-5-(p-tolyl)…

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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) 3.42 6.79 -5.37 0 1 0 12 252.155 2 ↓

Analogs

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Popular Name: (2R)-2-(bromomethyl)-4,4-difluoro-2-methoxy-5-(p-tolyl)-3H-pyrrole (2R)-2-(bromomethyl)-4,4-difluor…

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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) 3.83 4.62 -5.44 0 2 0 22 318.161 3 ↓

Analogs

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Popular Name: (2S)-2-(bromomethyl)-4,4-difluoro-2-methoxy-5-(p-tolyl)-3H-pyrrole (2S)-2-(bromomethyl)-4,4-difluor…

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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) 3.83 4.64 -5.44 0 2 0 22 318.161 3 ↓

Analogs

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Popular Name: (2R)-2-(bromomethyl)-4,4-difluoro-5-(3-fluoro-4-methoxy-phenyl)-2-methoxy-3H-pyrrole (2R)-2-(bromomethyl)-4,4-difluor…

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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) 3.53 3.33 -7.31 0 3 0 31 352.15 4 ↓

Analogs

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Popular Name: (2S)-2-(bromomethyl)-4,4-difluoro-5-(3-fluoro-4-methoxy-phenyl)-2-methoxy-3H-pyrrole (2S)-2-(bromomethyl)-4,4-difluor…

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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) 3.53 3.34 -7.3 0 3 0 31 352.15 4 ↓

Analogs

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Popular Name: (2S)-2-(bromomethyl)-5-(4-chlorophenyl)-4,4-difluoro-2,3-dihydropyrrole (2S)-2-(bromomethyl)-5-(4-chloro…

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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) 4.02 6.71 -4.57 0 1 0 12 308.553 2 ↓

Analogs

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Popular Name: (2R)-2-(bromomethyl)-5-(4-chlorophenyl)-4,4-difluoro-2,3-dihydropyrrole (2R)-2-(bromomethyl)-5-(4-chloro…

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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) 4.02 6.71 -4.53 0 1 0 12 308.553 2 ↓

Analogs

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Popular Name: (2S)-2-(bromomethyl)-4,4-difluoro-5-(3-fluoro-4-methoxy-phenyl)-2,3-dihydropyrrole (2S)-2-(bromomethyl)-4,4-difluor…

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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) 3.49 5.57 -7.47 0 2 0 22 322.124 3 ↓

Analogs

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Popular Name: (2R)-2-(bromomethyl)-4,4-difluoro-5-(3-fluoro-4-methoxy-phenyl)-2,3-dihydropyrrole (2R)-2-(bromomethyl)-4,4-difluor…

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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) 3.49 5.57 -7.45 0 2 0 22 322.124 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(bromomethyl)-4,4-difluoro-2-methoxy-5-phenyl-3H-pyrrole (2S)-2-(bromomethyl)-4,4-difluor…

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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) 3.38 3.97 -5.6 0 2 0 22 304.134 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(bromomethyl)-4,4-difluoro-2-methoxy-5-phenyl-3H-pyrrole (2R)-2-(bromomethyl)-4,4-difluor…

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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) 3.38 3.94 -5.6 0 2 0 22 304.134 3 ↓

Parameters Provided:

ring.id = 102655
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 = 102655 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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