UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-oxo-N-(p-tolylmethyl)-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide 5-oxo-N-(p-tolylmethyl)-2,3-dihy…

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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) 2.85 8.22 -14.35 1 5 0 64 351.431 3 ↓

Analogs

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Popular Name: N-[(2-methoxyphenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(2-methoxyphenyl)methyl]-5-ox…

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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) 2.41 6.88 -15.78 1 6 0 73 367.43 4 ↓

Analogs

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Popular Name: N-[(4-methoxyphenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(4-methoxyphenyl)methyl]-5-ox…

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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) 2.46 6.84 -15.74 1 6 0 73 367.43 4 ↓

Analogs

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Popular Name: N-[(3,4-dimethoxyphenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(3,4-dimethoxyphenyl)methyl]-…

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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) 2.05 6.74 -17.91 1 7 0 82 397.456 5 ↓

Analogs

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Popular Name: N-[(4-methylsulfanylphenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(4-methylsulfanylphenyl)methy…

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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) 2.83 8.56 -15.27 1 5 0 64 383.498 4 ↓

Analogs

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Popular Name: N-[(2-fluorophenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(2-fluorophenyl)methyl]-5-oxo…

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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) 2.52 7.56 -15.76 1 5 0 64 355.394 3 ↓

Analogs

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Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-5-oxo-2,3-dihydrothiazolo[2,3-b]quinazoline-8-carboxamide N-[(3-chloro-4-fluoro-phenyl)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) 3.17 8.1 -16.08 1 5 0 64 389.839 3 ↓

Parameters Provided:

ring.id = 563132
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 = 563132 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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