UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

2578299
2578299
2584820
2584820

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Popular Name: N-[(4-benzyloxyphenyl)methyleneamino]-2-(3-chlorophenoxy)acetamide N-[(4-benzyloxyphenyl)methylenea…

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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) 5.37 11.71 -19.44 1 5 0 60 394.858 8 ↓

Analogs

12579967
12579967
40950846
40950846

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Popular Name: N'-[4-(benzyloxy)benzylidene]-2-(2-bromo-4-tert-butylphenoxy)acetohydrazide N'-[4-(benzyloxy)benzylidene]-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) 7.16 0.71 -20.1 1 5 0 60 495.417 9 ↓

Analogs

2584831
2584831
2597251
2597251
2597254
2597254
4372642
4372642
40911144
40911144

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Popular Name: N-[(E)-(4-benzoxy-3-methoxy-benzylidene)amino]-2-(2,4,6-trichlorophenoxy)acetamide N-[(E)-(4-benzoxy-3-methoxy-benz…

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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) 6.20 0.31 -17.34 1 6 0 69 493.774 9 ↓

Analogs

4347204
4347204

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Popular Name: N'-[4-(benzyloxy)benzylidene]-2-(5-isopropyl-2-methylphenoxy)acetohydrazide N'-[4-(benzyloxy)benzylidene]-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) 6.61 1.44 -17.66 1 5 0 59 416.521 9 ↓

Analogs

4372810
4372810
12464973
12464973
32581114
32581114
2078364
2078364
2077076
2077076

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Popular Name: N-[(E)-[4-(4-chlorobenzyl)oxy-3-ethoxy-benzylidene]amino]-2-(4-chlorophenoxy)acetamide N-[(E)-[4-(4-chlorobenzyl)oxy-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) 6.04 0.29 -19.62 1 6 0 69 473.356 10 ↓

Analogs

2795228
2795228

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Popular Name: N-[(E)-[4-(4-chlorobenzyl)oxy-3-ethoxy-benzylidene]amino]-2-(4-fluorophenoxy)acetamide N-[(E)-[4-(4-chlorobenzyl)oxy-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) 5.53 1.17 -20.21 1 6 0 69 456.901 10 ↓

Analogs

9905834
9905834
40853235
40853235
1193810
1193810

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Popular Name: N-[(E)-[4-(4-chlorobenzyl)oxy-3-ethoxy-benzylidene]amino]-2-(2-nitrophenoxy)acetamide N-[(E)-[4-(4-chlorobenzyl)oxy-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) 5.27 1.29 -31.88 1 9 0 114 483.908 11 ↓

Analogs

2575865
2575865

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Popular Name: 2-(4-chlorophenoxy)-N-[(E)-[3-ethoxy-4-(4-fluorobenzyl)oxy-benzylidene]amino]acetamide 2-(4-chlorophenoxy)-N-[(E)-[3-et…

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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) 5.53 12.29 -22.36 1 6 0 69 456.901 10 ↓

Parameters Provided:

ring.id = 12015
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 = 12015 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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