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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-[(6R)-4-(4-fluorophenyl)-3-propyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6R)-4-(4-fluorophenyl)-3-pro…

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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) 3.52 9.38 -13.7 1 4 0 45 375.494 5 ↓

Analogs

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Popular Name: 1-[(6S)-4-(4-fluorophenyl)-3-propyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6S)-4-(4-fluorophenyl)-3-pro…

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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) 3.52 10.23 -10.57 1 4 0 45 375.494 5 ↓

Analogs

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Popular Name: 1-[(6S)-4-(4-fluorophenyl)-3-methyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6S)-4-(4-fluorophenyl)-3-met…

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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) 2.64 8.83 -11.25 1 4 0 45 347.44 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(6R)-4-(4-fluorophenyl)-3-methyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6R)-4-(4-fluorophenyl)-3-met…

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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) 2.64 7.78 -14.32 1 4 0 45 347.44 3 ↓

Analogs

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Popular Name: 1-[(6S)-4-(4-chlorophenyl)-3-methyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6S)-4-(4-chlorophenyl)-3-met…

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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) 3.15 9.28 -10.78 1 4 0 45 363.895 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(6R)-4-(4-chlorophenyl)-3-methyl-6-thiazol-4-yl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone 1-[(6R)-4-(4-chlorophenyl)-3-met…

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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) 3.15 8.23 -13.83 1 4 0 45 363.895 3 ↓

Analogs

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Popular Name: 1-[(4S)-6-(4-bromophenyl)-4-thiazol-4-yl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone 1-[(4S)-6-(4-bromophenyl)-4-thia…

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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) 3.04 7.96 -12.35 2 4 0 54 394.319 3 ↓
Hi High (pH 8-9.5) 3.96 6.04 -42.42 1 4 -1 60 393.311 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(4R)-6-(4-bromophenyl)-4-thiazol-4-yl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone 1-[(4R)-6-(4-bromophenyl)-4-thia…

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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) 3.04 7.21 -14.01 2 4 0 54 394.319 3 ↓
Hi High (pH 8-9.5) 3.96 6.03 -42.75 1 4 -1 60 393.311 2 ↓

Parameters Provided:

ring.id = 451889
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 = 451889 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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