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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: 6-[(2S)-2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2S)-2-(4-methoxyphenyl)pyrro…

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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) 1.56 8.2 -22.52 0 6 0 64 355.419 3 ↓
Lo Low (pH 4.5-6) 1.56 8.67 -54.03 1 6 1 65 356.427 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2R)-2-(4-methoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2R)-2-(4-methoxyphenyl)pyrro…

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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) 1.56 8.2 -22.3 0 6 0 64 355.419 3 ↓
Lo Low (pH 4.5-6) 1.56 8.66 -53.68 1 6 1 65 356.427 3 ↓

Analogs

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Popular Name: 6-[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2S)-2-(2,5-dimethoxyphenyl)p…

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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) 1.54 7.46 -24.25 0 7 0 73 385.445 4 ↓
Lo Low (pH 4.5-6) 1.54 7.98 -52.94 1 7 1 74 386.453 4 ↓

Analogs

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Popular Name: 6-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2R)-2-(2,5-dimethoxyphenyl)p…

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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) 1.54 7.55 -24.22 0 7 0 73 385.445 4 ↓
Lo Low (pH 4.5-6) 1.54 8.07 -53.36 1 7 1 74 386.453 4 ↓

Analogs

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Popular Name: 6-[(2S)-2-(2,4-dimethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2S)-2-(2,4-dimethoxyphenyl)p…

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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) 1.54 7.48 -24.29 0 7 0 73 385.445 4 ↓
Lo Low (pH 4.5-6) 1.54 7.99 -57.74 1 7 1 74 386.453 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2R)-2-(2,4-dimethoxyphenyl)p…

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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) 1.54 7.57 -24.23 0 7 0 73 385.445 4 ↓
Lo Low (pH 4.5-6) 1.54 8.08 -57.38 1 7 1 74 386.453 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2S)-2-(4-ethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2S)-2-(4-ethoxyphenyl)pyrrol…

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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) 1.93 9.12 -22.28 0 6 0 64 369.446 4 ↓
Lo Low (pH 4.5-6) 1.93 9.6 -53.86 1 6 1 65 370.454 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2R)-2-(4-ethoxyphenyl)pyrrolidine-1-carbonyl]thiazolo[3,2-a]pyrimidin-5-one 6-[(2R)-2-(4-ethoxyphenyl)pyrrol…

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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) 1.93 9.12 -22.13 0 6 0 64 369.446 4 ↓
Lo Low (pH 4.5-6) 1.93 9.59 -53.49 1 6 1 65 370.454 4 ↓

Parameters Provided:

ring.id = 184677
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 = 184677 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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