UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]imidazo[2,1-b]thiazole-5-carbaldehyde 6-[methyl-[(1-methylpyrazol-4-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) 1.07 7.05 -14.01 0 6 0 55 275.337 4 ↓

Analogs

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Popular Name: 6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]imidazo[2,1-b]thiazole-5-carboxylic 6-[methyl-[(1-methylpyrazol-4-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) 0.85 6.77 -56.81 0 7 -1 78 290.328 4 ↓

Analogs

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Popular Name: [6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]imidazo[2,1-b]thiazol-5-yl]methanol [6-[methyl-[(1-methylpyrazol-4-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) 0.62 4.74 -14.39 1 6 0 59 277.353 4 ↓

Analogs

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Popular Name: 5-(chloromethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]imidazo[2,1-b]thiazol-6-amine 5-(chloromethyl)-N-methyl-N-[(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) 1.85 8.41 -11.83 0 5 0 38 295.799 4 ↓

Analogs

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Popular Name: 5-(aminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]imidazo[2,1-b]thiazol-6-amine 5-(aminomethyl)-N-methyl-N-[(1-m…

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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) 0.46 5.32 -52.52 3 6 1 66 277.377 4 ↓

Analogs

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Popular Name: N-methyl-5-(methylaminomethyl)-N-[(1-methylpyrazol-4-yl)methyl]imidazo[2,1-b]thiazol-6-amine N-methyl-5-(methylaminomethyl)-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) 0.84 7.29 -54.57 2 6 1 55 291.404 5 ↓

Analogs

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Popular Name: 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]imidazo[2,1-b]thiazol-6-amine 5-(ethylaminomethyl)-N-methyl-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) 1.21 8.15 -53.46 2 6 1 55 305.431 6 ↓

Parameters Provided:

ring.id = 542780
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 = 542780 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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