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Analogs

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Popular Name: 6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole-5-carbaldehyde 6-[4-[(1R)-1-methylpropyl]pipera…

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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) 2.39 8.85 -41.7 1 5 1 42 293.416 4 ↓
Hi High (pH 8-9.5) 2.39 7 -9.31 0 5 0 41 292.408 4 ↓

Analogs

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Popular Name: 6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole-5-carbaldehyde 6-[4-[(1S)-1-methylpropyl]pipera…

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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) 2.39 8.87 -41.7 1 5 1 42 293.416 4 ↓
Hi High (pH 8-9.5) 2.39 7.03 -9.28 0 5 0 41 292.408 4 ↓

Analogs

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Popular Name: 6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole-5-carboxylic 6-[4-[(1R)-1-methylpropyl]pipera…

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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 8.58 -58.69 1 6 0 65 308.407 4 ↓
Hi High (pH 8-9.5) 2.17 6.82 -56.97 0 6 -1 64 307.399 4 ↓

Analogs

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Popular Name: 6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole-5-carboxylic 6-[4-[(1S)-1-methylpropyl]pipera…

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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 8.57 -58.61 1 6 0 65 308.407 4 ↓
Hi High (pH 8-9.5) 2.17 6.73 -56.93 0 6 -1 64 307.399 4 ↓

Analogs

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Popular Name: [6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanol [6-[4-[(1R)-1-methylpropyl]piper…

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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) 1.94 6.46 -37.62 2 5 1 45 295.432 4 ↓
Hi High (pH 8-9.5) 1.94 4.62 -11.32 1 5 0 44 294.424 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanol [6-[4-[(1S)-1-methylpropyl]piper…

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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) 1.94 6.49 -37.58 2 5 1 45 295.432 4 ↓
Hi High (pH 8-9.5) 1.94 4.64 -11.36 1 5 0 44 294.424 4 ↓

Analogs

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Popular Name: 5-(chloromethyl)-6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole 5-(chloromethyl)-6-[4-[(1R)-1-me…

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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) 3.18 10.43 -35.85 1 4 1 25 313.878 4 ↓
Hi High (pH 8-9.5) 3.18 8.67 -8.75 0 4 0 24 312.87 4 ↓

Analogs

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Popular Name: 5-(chloromethyl)-6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazole 5-(chloromethyl)-6-[4-[(1S)-1-me…

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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) 3.18 10.43 -35.76 1 4 1 25 313.878 4 ↓
Hi High (pH 8-9.5) 3.18 8.61 -8.69 0 4 0 24 312.87 4 ↓

Analogs

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Popular Name: [6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanamine [6-[4-[(1R)-1-methylpropyl]piper…

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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) 1.79 7.18 -105.87 4 5 2 53 295.456 4 ↓
Hi High (pH 8-9.5) 1.79 4.93 -9.25 2 5 0 50 293.44 4 ↓
Hi High (pH 8-9.5) 1.79 5.36 -53.66 3 5 1 51 294.448 4 ↓

Analogs

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Popular Name: [6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanamine [6-[4-[(1S)-1-methylpropyl]piper…

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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) 1.79 7.2 -106.26 4 5 2 53 295.456 4 ↓
Hi High (pH 8-9.5) 1.79 4.96 -9.22 2 5 0 50 293.44 4 ↓
Hi High (pH 8-9.5) 1.79 5.39 -53.6 3 5 1 51 294.448 4 ↓

Analogs

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Popular Name: N-methyl-1-[6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanamine N-methyl-1-[6-[4-[(1R)-1-methylp…

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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) 2.16 9.06 -99.75 3 5 2 42 309.483 5 ↓
Hi High (pH 8-9.5) 2.16 5.87 -8.42 1 5 0 36 307.467 5 ↓
Hi High (pH 8-9.5) 2.16 7.31 -47.42 2 5 1 40 308.475 5 ↓

Analogs

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Popular Name: N-methyl-1-[6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanamine N-methyl-1-[6-[4-[(1S)-1-methylp…

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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) 2.16 9.07 -100.14 3 5 2 42 309.483 5 ↓
Hi High (pH 8-9.5) 2.16 5.79 -8.58 1 5 0 36 307.467 5 ↓
Hi High (pH 8-9.5) 2.16 7.26 -47.56 2 5 1 40 308.475 5 ↓

Analogs

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Popular Name: 6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazole-5-carbaldehyde 6-(4-isobutylpiperazin-1-yl)imid…

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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) 2.31 9.21 -43.43 1 5 1 42 293.416 4 ↓
Hi High (pH 8-9.5) 2.31 7.28 -9.44 0 5 0 41 292.408 4 ↓

Analogs

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Popular Name: 6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazole-5-carboxylic 6-(4-isobutylpiperazin-1-yl)imid…

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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) 2.09 8.92 -60.65 1 6 0 65 308.407 4 ↓
Hi High (pH 8-9.5) 2.09 6.99 -56.8 0 6 -1 64 307.399 4 ↓

Analogs

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Popular Name: [6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]methanol [6-(4-isobutylpiperazin-1-yl)imi…

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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 6.83 -39.23 2 5 1 45 295.432 4 ↓
Hi High (pH 8-9.5) 1.85 4.9 -11.57 1 5 0 44 294.424 4 ↓

Analogs

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Popular Name: 5-(chloromethyl)-6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazole 5-(chloromethyl)-6-(4-isobutylpi…

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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) 3.09 10.78 -37.36 1 4 1 25 313.878 4 ↓
Hi High (pH 8-9.5) 3.09 8.87 -8.95 0 4 0 24 312.87 4 ↓

Analogs

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Popular Name: [6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]methanamine [6-(4-isobutylpiperazin-1-yl)imi…

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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) 1.70 7.58 -106.89 4 5 2 53 295.456 4 ↓
Hi High (pH 8-9.5) 1.70 7.14 -36.16 3 5 1 51 294.448 4 ↓
Hi High (pH 8-9.5) 1.70 5.24 -8.8 2 5 0 50 293.44 4 ↓

Analogs

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Popular Name: 1-[6-(4-isobutylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]-N-methyl-methanamine 1-[6-(4-isobutylpiperazin-1-yl)i…

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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) 2.07 9.45 -100.78 3 5 2 42 309.483 5 ↓
Hi High (pH 8-9.5) 2.07 7.52 -48.3 2 5 1 40 308.475 5 ↓
Hi High (pH 8-9.5) 2.07 6.05 -8.61 1 5 0 36 307.467 5 ↓

Analogs

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Popular Name: 6-(4-tert-butylpiperazin-1-yl)imidazo[2,1-b]thiazole-5-carbaldehyde 6-(4-tert-butylpiperazin-1-yl)im…

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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) 2.37 8.49 -40.65 1 5 1 42 293.416 3 ↓

Analogs

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Popular Name: 6-(4-tert-butylpiperazin-1-yl)imidazo[2,1-b]thiazole-5-carboxylic 6-(4-tert-butylpiperazin-1-yl)im…

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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) 2.15 8.2 -57.16 1 6 0 65 308.407 3 ↓
Mid Mid (pH 6-8) 2.15 6.14 -57.09 0 6 -1 64 307.399 3 ↓

Analogs

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Popular Name: [6-(4-tert-butylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]methanol [6-(4-tert-butylpiperazin-1-yl)i…

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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) 1.92 6.11 -36.94 2 5 1 45 295.432 3 ↓

Analogs

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Popular Name: 6-(4-tert-butylpiperazin-1-yl)-5-(chloromethyl)imidazo[2,1-b]thiazole 6-(4-tert-butylpiperazin-1-yl)-5…

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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 10.07 -35.3 1 4 1 25 313.878 3 ↓

Analogs

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Popular Name: [6-(4-tert-butylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]methanamine [6-(4-tert-butylpiperazin-1-yl)i…

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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) 1.76 6.86 -104.57 4 5 2 53 295.456 3 ↓

Analogs

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Popular Name: 1-[6-(4-tert-butylpiperazin-1-yl)imidazo[2,1-b]thiazol-5-yl]-N-methyl-methanamine 1-[6-(4-tert-butylpiperazin-1-yl…

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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 8.73 -98.51 3 5 2 42 309.483 4 ↓

Parameters Provided:

ring.id = 392222
filter.purchasability = annotated
page.format = targets
page.num = 1

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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 = 392222 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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