UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[(4-but-2-ynoxyphenyl)methyl]-N-cyclopentyl-2,3,4-trimethoxy-benzamide N-[(4-but-2-ynoxyphenyl)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) 5.11 3.41 -15.53 0 6 0 57 437.536 9 ↓

Analogs

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Popular Name: N-cyclopentyl-N-[(3-isopropoxy-4-methoxy-phenyl)methyl]-2-methoxy-benzamide N-cyclopentyl-N-[(3-isopropoxy-4…

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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) 4.64 2.3 -14.07 0 5 0 48 397.515 8 ↓

Analogs

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Popular Name: N-cyclopentyl-N-[(3-isopropoxy-4-methoxy-phenyl)methyl]-4-methoxy-benzamide N-cyclopentyl-N-[(3-isopropoxy-4…

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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) 4.14 1.92 -10.93 0 5 0 48 397.515 8 ↓

Analogs

34947119
34947119
34947121
34947121
34971209
34971209
34971210
34971210

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Popular Name: 3-chloro-N-cyclopentyl-N-[(3-isopropoxy-4-methoxy-phenyl)methyl]benzamide 3-chloro-N-cyclopentyl-N-[(3-iso…

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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) 4.74 1.6 -10.62 0 4 0 39 401.934 7 ↓

Analogs

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Popular Name: N-cyclopentyl-N-[(3-isopropoxy-4-methoxy-phenyl)methyl]-2,4-dimethoxy-benzamide N-cyclopentyl-N-[(3-isopropoxy-4…

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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 2.31 -12.83 0 6 0 57 427.541 9 ↓

Analogs

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Popular Name: N-cyclopentyl-N-[(2,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)benzamide N-cyclopentyl-N-[(2,5-dimethoxyp…

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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) 3.08 6.83 -10.71 1 5 0 59 369.461 7 ↓

Parameters Provided:

ring.id = 59217
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 = 59217 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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