UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

38588958
38588958
38588975
38588975
9227610
9227610

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Popular Name: N-[benzamido-(3-benzyloxy-4-methoxy-phenyl)methyl]benzamide N-[benzamido-(3-benzyloxy-4-meth…

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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) 4.76 12.55 -21.57 2 6 0 77 466.537 9 ↓

Analogs

3408034
3408034

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(2-methylbenzoyl)amino]methyl]-2-methyl-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 5.56 13.89 -18.84 2 6 0 77 494.591 9 ↓

Analogs

3408070
3408070

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(3-methylbenzoyl)amino]methyl]-3-methyl-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 5.61 13.88 -21.77 2 6 0 77 494.591 9 ↓

Analogs

38588944
38588944
1792840
1792840

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(4-methylbenzoyl)amino]methyl]-4-methyl-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 5.66 13.9 -21.23 2 6 0 77 494.591 9 ↓

Analogs

34965627
34965627

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(2-fluorobenzoyl)amino]methyl]-2-fluoro-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 4.99 12.7 -30.84 2 6 0 77 502.517 9 ↓

Analogs

39859556
39859556

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(4-fluorobenzoyl)amino]methyl]-4-fluoro-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 5.09 12.69 -20.06 2 6 0 77 502.517 9 ↓

Analogs

8858744
8858744

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(3-methoxybenzoyl)amino]methyl]-3-methoxy-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 4.83 11.15 -27.49 2 8 0 95 526.589 11 ↓

Analogs

38588944
38588944
8858685
8858685

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Popular Name: N-[(3-benzyloxy-4-methoxy-phenyl)-[(4-methoxybenzoyl)amino]methyl]-4-methoxy-benzamide N-[(3-benzyloxy-4-methoxy-phenyl…

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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) 4.87 11.17 -21.58 2 8 0 95 526.589 11 ↓

Parameters Provided:

ring.id = 594184
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 = 594184 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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