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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: 1-[2-oxo-2-[[(1S)-1-(3-thienyl)ethyl]amino]ethyl]cyclopentanecarboxylic 1-[2-oxo-2-[[(1S)-1-(3-thienyl)e…

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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) 1.96 7.8 -59.62 1 4 -1 69 280.369 5 ↓
Lo Low (pH 4.5-6) 1.96 5.33 -13.89 2 4 0 66 281.377 5 ↓

Analogs

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Popular Name: 1-[2-oxo-2-[[(1R)-1-(3-thienyl)ethyl]amino]ethyl]cyclopentanecarboxylic 1-[2-oxo-2-[[(1R)-1-(3-thienyl)e…

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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) 1.96 7.8 -58.55 1 4 -1 69 280.369 5 ↓
Lo Low (pH 4.5-6) 1.96 5.33 -14.08 2 4 0 66 281.377 5 ↓

Analogs

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Popular Name: 2-[1-[2-oxo-2-[[(1S)-1-(3-thienyl)ethyl]amino]ethyl]cyclopentyl]acetic 2-[1-[2-oxo-2-[[(1S)-1-(3-thieny…

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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) 2.23 7.58 -47.4 1 4 -1 69 294.396 6 ↓
Lo Low (pH 4.5-6) 2.23 5.59 -6.42 2 4 0 66 295.404 6 ↓

Analogs

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Popular Name: 2-[1-[2-oxo-2-[[(1R)-1-(3-thienyl)ethyl]amino]ethyl]cyclopentyl]acetic 2-[1-[2-oxo-2-[[(1R)-1-(3-thieny…

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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) 2.23 7.58 -48.2 1 4 -1 69 294.396 6 ↓
Lo Low (pH 4.5-6) 2.23 5.59 -6.55 2 4 0 66 295.404 6 ↓

Analogs

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Popular Name: 2-cyclopentyl-N-(2-methoxyethyl)-N-(3-thienylmethyl)acetamide 2-cyclopentyl-N-(2-methoxyethyl)…

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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) 2.69 8.55 -9.85 0 3 0 30 281.421 7 ↓

Analogs

42931063
42931063

Draw Identity 99% 90% 80% 70%

Popular Name: 2-cyclopentyl-N-(3-thienylmethyl)acetamide 2-cyclopentyl-N-(3-thienylmethyl…

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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) 2.46 5.87 -6.51 1 2 0 29 223.341 4 ↓

Parameters Provided:

ring.id = 211887
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 = 211887 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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