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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
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Analogs

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Popular Name: N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide N-[(2S)-2-(3,4-dimethoxyphenyl)-…

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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) 1.52 7 -21.97 2 9 0 98 498.605 9 ↓
Mid Mid (pH 6-8) 2.25 6.58 -47.18 1 9 -1 95 497.597 9 ↓
Lo Low (pH 4.5-6) 1.52 8.93 -55.59 3 9 1 99 499.613 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide N-[(2R)-2-(3,4-dimethoxyphenyl)-…

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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) 1.52 7.27 -22.86 2 9 0 98 498.605 9 ↓
Mid Mid (pH 6-8) 2.25 6.85 -48.36 1 9 -1 95 497.597 9 ↓
Lo Low (pH 4.5-6) 1.52 9.37 -57.75 3 9 1 99 499.613 9 ↓

Parameters Provided:

ring.id = 109786
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 = 109786 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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