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

Analogs

25145782
25145782
25523144
25523144
39292239
39292239
39292241
39292241

Draw Identity 99% 90% 80% 70%

Popular Name: 2-phenyl-4-[4-(2-pyridyl)piperazin-1-yl]quinazoline 2-phenyl-4-[4-(2-pyridyl)piperaz…

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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) 4.57 13.91 -78.16 2 5 2 48 369.472 3 ↓
Mid Mid (pH 6-8) 4.57 13.24 -10.54 0 5 0 45 367.456 3 ↓
Mid Mid (pH 6-8) 4.57 13.92 -68.73 2 5 2 48 369.472 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(p-tolyl)-4-[4-(2-pyridyl)piperazin-1-yl]quinazoline 2-(p-tolyl)-4-[4-(2-pyridyl)pipe…

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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) 5.02 14.58 -78.2 2 5 2 48 383.499 3 ↓
Hi High (pH 8-9.5) 5.02 13.93 -10.45 0 5 0 45 381.483 3 ↓
Mid Mid (pH 6-8) 5.02 14.59 -68.73 2 5 2 48 383.499 3 ↓

Analogs

25150268
25150268
25150732
25150732

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-fluorophenyl)-4-[4-(2-pyridyl)piperazin-1-yl]quinazoline 2-(2-fluorophenyl)-4-[4-(2-pyrid…

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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) 4.68 14.17 -82.13 2 5 2 48 387.462 3 ↓
Mid Mid (pH 6-8) 4.68 14.19 -68.96 2 5 2 48 387.462 3 ↓
Mid Mid (pH 6-8) 4.68 13.51 -12.69 0 5 0 45 385.446 3 ↓

Parameters Provided:

ring.id = 239684
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 = 239684 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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