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

Analogs

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Popular Name: N-methyl-4-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoylamino]benzamide N-methyl-4-[3-(4-oxo-2-thioxo-1H…

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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) 1.31 6.43 -23.89 3 7 0 96 382.445 5 ↓
Mid Mid (pH 6-8) 2.03 6.01 -47.64 2 7 -1 93 381.437 5 ↓

Analogs

55641371
55641371

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Popular Name: N-[4-[(1R)-1-methylpropoxy]phenyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide N-[4-[(1R)-1-methylpropoxy]pheny…

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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) 3.41 9.85 -16.37 2 6 0 76 397.5 7 ↓
Mid Mid (pH 6-8) 4.14 9.55 -44.05 1 6 -1 73 396.492 7 ↓

Analogs

55641369
55641369

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Popular Name: N-[4-[(1S)-1-methylpropoxy]phenyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide N-[4-[(1S)-1-methylpropoxy]pheny…

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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) 3.41 9.9 -17.14 2 6 0 76 397.5 7 ↓
Mid Mid (pH 6-8) 4.14 9.6 -45.09 1 6 -1 73 396.492 7 ↓

Analogs

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Popular Name: N-(5-chloro-2-hydroxy-phenyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide N-(5-chloro-2-hydroxy-phenyl)-3-…

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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) 2.50 5.97 -16.18 3 6 0 87 375.837 4 ↓
Mid Mid (pH 6-8) 3.23 5.68 -43.35 2 6 -1 84 374.829 4 ↓

Parameters Provided:

ring.id = 82773
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 = 82773 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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