UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: methyl 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) 4.53 10.71 -16.21 1 6 0 77 378.428 6 ↓

Analogs

55640466
55640466

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Popular Name: 2-(1-methylene-3-oxo-isoindolin-2-yl)-N-[4-[(1S)-1-methylpropoxy]phenyl]acetamide 2-(1-methylene-3-oxo-isoindolin-…

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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) 4.03 9.51 -19.62 1 5 0 60 350.418 6 ↓

Analogs

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Popular Name: 2-chloro-4-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]-N-propyl-benzamide 2-chloro-4-[[2-(1-methylene-3-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) 3.41 8.22 -28.89 2 6 0 80 397.862 6 ↓

Analogs

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Popular Name: N-tert-butyl-2-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]benzamide N-tert-butyl-2-[[2-(1-methylene-…

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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) 3.06 8.78 -18.95 2 6 0 80 377.444 5 ↓

Analogs

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Popular Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(1-methylene-3-oxo-isoindolin-2-yl)acetamide N-[4-fluoro-3-(trifluoromethyl)p…

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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) 3.72 8.87 -17.59 1 4 0 51 364.298 4 ↓

Analogs

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Popular Name: N-[2-methyl-3-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]phenyl]butanamide N-[2-methyl-3-[[2-(1-methylene-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) 3.70 9.36 -25.31 2 6 0 80 377.444 6 ↓

Analogs

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Popular Name: N-isopropyl-2-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]benzamide N-isopropyl-2-[[2-(1-methylene-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) 2.55 8.28 -19.58 2 6 0 80 363.417 5 ↓

Parameters Provided:

ring.id = 48565
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 = 48565 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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