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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(4-methoxyphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(4-methoxyphenyl)piperazin-1-…

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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) 2.19 5.56 -11.88 0 5 0 46 303.387 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(m-tolyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(m-tolyl)piperazin-1-yl]-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) 2.56 6.93 -10.53 0 4 0 36 287.388 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(3-methoxyphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(3-methoxyphenyl)piperazin-1-…

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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) 2.17 5.56 -12.11 0 5 0 46 303.387 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2-chlorophenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(2-chlorophenyl)piperazin-1-y…

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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) 2.76 7.46 -10.28 0 4 0 36 307.806 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(4-chlorophenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(4-chlorophenyl)piperazin-1-y…

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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) 2.81 6.79 -10.29 0 4 0 36 307.806 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2-fluorophenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(2-fluorophenyl)piperazin-1-y…

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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) 2.25 6.77 -11.54 0 4 0 36 291.351 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(o-tolyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(o-tolyl)piperazin-1-yl]-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) 2.54 7.75 -9.35 0 4 0 36 287.388 2 ↓
Mid Mid (pH 6-8) 2.54 7.64 -34.15 1 4 1 38 288.396 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(4-hydroxyphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(4-hydroxyphenyl)piperazin-1-…

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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) 1.66 3.41 -11.93 1 5 0 57 289.36 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2-hydroxyphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(2-hydroxyphenyl)piperazin-1-…

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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) 1.87 3.92 -11.15 1 5 0 57 289.36 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-phenylpiperazin-1-yl)-thiazol-4-yl-methanone (4-phenylpiperazin-1-yl)-thiazol…

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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) 2.13 6.27 -10.42 0 4 0 36 273.361 2 ↓

Analogs

34669078
34669078
34682450
34682450

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(4-fluorophenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(4-fluorophenyl)piperazin-1-y…

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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) 2.30 6.33 -10.96 0 4 0 36 291.351 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2-methoxyphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(2-methoxyphenyl)piperazin-1-…

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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) 2.14 6.09 -11.58 0 5 0 46 303.387 3 ↓

Analogs

34669052
34669052

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(3-chlorophenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(3-chlorophenyl)piperazin-1-y…

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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) 2.79 6.78 -10.63 0 4 0 36 307.806 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-thiazol-4-yl-methanone [4-(2,3-dimethylphenyl)piperazin…

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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) 2.94 8.3 -9.46 0 4 0 36 301.415 2 ↓

Analogs

34685409
34685409
34685408
34685408
34685407
34685407
34685406
34685406
34685401
34685401

Draw Identity 99% 90% 80% 70%

Popular Name: (2-methylthiazol-4-yl)-(4-phenylpiperazin-1-yl)methanone (2-methylthiazol-4-yl)-(4-phenyl…

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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) 1.85 6.99 -9.53 0 4 0 36 287.388 2 ↓

Analogs

34685409
34685409
34685408
34685408
34685401
34685401
34685397
34685397
34685389
34685389

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]thiazole-2-carboxamide N-ethyl-4-[4-(2-fluorophenyl)pip…

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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) 1.55 5.98 -14.68 1 6 0 66 362.43 4 ↓

Analogs

34685473
34685473
34685409
34685409
34685408
34685408
34685406
34685406
34685403
34685403

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-4-[4-(m-tolyl)piperazine-1-carbonyl]thiazole-2-carboxamide N-ethyl-4-[4-(m-tolyl)piperazine…

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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) 1.86 6.14 -13.02 1 6 0 66 358.467 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: thiazol-4-yl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone thiazol-4-yl-[4-[3-(trifluoromet…

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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) 3.01 7.29 -10.66 0 4 0 36 341.358 3 ↓

Parameters Provided:

ring.id = 172840
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 = 172840 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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