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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: (4R)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2-chlorophenyl)-1-methyl-4,7-dihydro-3H-pyrrolo[3 (4R)-6-[(1S)-1-benzyl-2-morpholi…

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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 11.19 -21.69 1 8 0 82 494.979 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2-chlorophenyl)-1-methyl-4,7-dihydro-3H-pyrrolo[3 (4S)-6-[(1S)-1-benzyl-2-morpholi…

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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 10.53 -24.48 1 8 0 82 494.979 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2-chlorophenyl)-1-methyl-4,7-dihydro-3H-pyrrolo[3 (4R)-6-[(1R)-1-benzyl-2-morpholi…

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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 11.23 -22.2 1 8 0 82 494.979 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2-chlorophenyl)-1-methyl-4,7-dihydro-3H-pyrrolo[3 (4S)-6-[(1R)-1-benzyl-2-morpholi…

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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 10.84 -23.76 1 8 0 82 494.979 5 ↓

Analogs

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Popular Name: (4S)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-1-ethyl-4-(3-nitrophenyl)-4,7-dihydro-3H-pyrrolo[3,4 (4S)-6-[(1S)-1-benzyl-2-morpholi…

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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) 3.07 12.37 -27.42 1 11 0 128 519.558 7 ↓

Analogs

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Popular Name: (4R)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-1-ethyl-4-(3-nitrophenyl)-4,7-dihydro-3H-pyrrolo[3,4 (4R)-6-[(1S)-1-benzyl-2-morpholi…

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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) 3.07 12.38 -27.98 1 11 0 128 519.558 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-1-ethyl-4-(3-nitrophenyl)-4,7-dihydro-3H-pyrrolo[3,4 (4S)-6-[(1R)-1-benzyl-2-morpholi…

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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) 3.07 12.41 -28.47 1 11 0 128 519.558 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-1-ethyl-4-(3-nitrophenyl)-4,7-dihydro-3H-pyrrolo[3,4 (4R)-6-[(1R)-1-benzyl-2-morpholi…

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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) 3.07 12.42 -27.48 1 11 0 128 519.558 7 ↓

Analogs

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Popular Name: (4R)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2,4-dimethylphenyl)-1-methyl-4,7-dihydro-3H-pyrro (4R)-6-[(1S)-1-benzyl-2-morpholi…

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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) 3.58 11.46 -24.63 1 8 0 82 488.588 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6-[(1S)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2,4-dimethylphenyl)-1-methyl-4,7-dihydro-3H-pyrro (4S)-6-[(1S)-1-benzyl-2-morpholi…

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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) 3.58 11.51 -24.61 1 8 0 82 488.588 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2,4-dimethylphenyl)-1-methyl-4,7-dihydro-3H-pyrro (4R)-6-[(1R)-1-benzyl-2-morpholi…

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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) 3.58 11.57 -24.75 1 8 0 82 488.588 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6-[(1R)-1-benzyl-2-morpholino-2-oxo-ethyl]-4-(2,4-dimethylphenyl)-1-methyl-4,7-dihydro-3H-pyrro (4S)-6-[(1R)-1-benzyl-2-morpholi…

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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) 3.58 11.29 -24.66 1 8 0 82 488.588 5 ↓

Parameters Provided:

ring.id = 20280
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 = 20280 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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