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Analogs

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Popular Name: 6-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazole-5-carbaldehyde 6-[[(3R)-1,1-dioxothiolan-3-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) 0.81 3.9 -19.13 0 6 0 72 299.377 3 ↓

Analogs

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Popular Name: 6-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazole-5-carbaldehyde 6-[[(3S)-1,1-dioxothiolan-3-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) 0.81 3.92 -18.57 0 6 0 72 299.377 3 ↓

Analogs

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Popular Name: 6-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazole-5-carboxylic 6-[[(3R)-1,1-dioxothiolan-3-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) 0.59 3.62 -62.16 0 7 -1 95 314.368 3 ↓

Analogs

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Popular Name: 6-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazole-5-carboxylic 6-[[(3S)-1,1-dioxothiolan-3-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) 0.59 3.61 -62.18 0 7 -1 95 314.368 3 ↓

Analogs

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Popular Name: [6-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazol-5-yl]methanol [6-[[(3R)-1,1-dioxothiolan-3-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) 0.36 1.53 -21.41 1 6 0 75 301.393 3 ↓

Analogs

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Popular Name: [6-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]imidazo[2,1-b]thiazol-5-yl]methanol [6-[[(3S)-1,1-dioxothiolan-3-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) 0.36 1.55 -18.66 1 6 0 75 301.393 3 ↓

Analogs

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Popular Name: 5-(chloromethyl)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-imidazo[2,1-b]thiazol-6-amine 5-(chloromethyl)-N-[(3R)-1,1-dio…

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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) 1.60 5.4 -17.1 0 5 0 55 319.839 3 ↓

Analogs

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Popular Name: 5-(chloromethyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-imidazo[2,1-b]thiazol-6-amine 5-(chloromethyl)-N-[(3S)-1,1-dio…

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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) 1.60 5.39 -19.42 0 5 0 55 319.839 3 ↓

Analogs

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Popular Name: 5-(aminomethyl)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-imidazo[2,1-b]thiazol-6-amine 5-(aminomethyl)-N-[(3R)-1,1-diox…

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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) 0.21 2.19 -66.28 3 6 1 82 301.417 3 ↓

Analogs

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Popular Name: 5-(aminomethyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-imidazo[2,1-b]thiazol-6-amine 5-(aminomethyl)-N-[(3S)-1,1-diox…

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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) 0.21 2.18 -72.55 3 6 1 82 301.417 3 ↓

Analogs

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Popular Name: N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b]thiazol-6-amine N-[(3R)-1,1-dioxothiolan-3-yl]-N…

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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) 0.58 4.13 -60.26 2 6 1 71 315.444 4 ↓

Analogs

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Popular Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b]thiazol-6-amine N-[(3S)-1,1-dioxothiolan-3-yl]-N…

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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) 0.58 4.11 -65.7 2 6 1 71 315.444 4 ↓

Analogs

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Popular Name: N-[(3R)-1,1-dioxothiolan-3-yl]-5-(ethylaminomethyl)-N-methyl-imidazo[2,1-b]thiazol-6-amine N-[(3R)-1,1-dioxothiolan-3-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) 0.96 4.98 -59.14 2 6 1 71 329.471 5 ↓

Analogs

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Popular Name: N-[(3S)-1,1-dioxothiolan-3-yl]-5-(ethylaminomethyl)-N-methyl-imidazo[2,1-b]thiazol-6-amine N-[(3S)-1,1-dioxothiolan-3-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) 0.96 4.98 -64.8 2 6 1 71 329.471 5 ↓

Parameters Provided:

ring.id = 117798
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 = 117798 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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