UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (3E)-6-benzyl-3-benzylidene-2-(2-hydroxyphenyl)isoindolin-5-ol (3E)-6-benzyl-3-benzylidene-2-(2…

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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) 6.89 12.09 -8.14 2 3 0 44 405.497 4 ↓

Analogs

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Popular Name: 2-[(1Z)-5-benzyl-1-benzylidene-6-methoxy-isoindolin-2-yl]phenol 2-[(1Z)-5-benzyl-1-benzylidene-6…

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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) 6.96 13.62 -8.74 1 3 0 33 419.524 5 ↓

Analogs

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Popular Name: 2-[(1Z)-5-benzyl-1-benzylidene-6-methylsulfanyl-isoindolin-2-yl]phenol 2-[(1Z)-5-benzyl-1-benzylidene-6…

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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) 7.33 14.88 -8.37 1 2 0 23 435.592 5 ↓

Analogs

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Popular Name: 2-[(1Z)-5-benzyl-1-benzylidene-6-isopropylsulfonyl-isoindolin-2-yl]phenol 2-[(1Z)-5-benzyl-1-benzylidene-6…

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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) 6.95 13.16 -14.47 1 4 0 58 495.644 6 ↓

Parameters Provided:

ring.id = 607070
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 = 607070 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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