UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (2Z)-2-hydroxyimino-N-(3-methoxyphenyl)chromene-3-carboxamide (2Z)-2-hydroxyimino-N-(3-methoxy…

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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) 3.26 2.78 -33.78 3 6 1 86 311.317 3 ↓
Ref Reference (pH 7) 3.26 4.23 -32.58 3 6 1 86 311.317 3 ↓

Analogs

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Popular Name: 7-diethylamino-N-(2,3-dimethylphenyl)-2-hydroxyimino-chromene-3-carboxamide 7-diethylamino-N-(2,3-dimethylph…

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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) 4.86 8.66 -30.53 3 6 1 80 380.468 5 ↓

Analogs

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Popular Name: 2-hydroxyimino-N-(4-methoxyphenyl)-chromene-3-carboxamide 2-hydroxyimino-N-(4-methoxypheny…

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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) 3.28 4.22 -34.26 3 6 1 86 311.317 3 ↓

Analogs

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Popular Name: 2-hydroxyimino-8-methoxy-N-phenyl-chromene-3-carboxamide 2-hydroxyimino-8-methoxy-N-pheny…

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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) 3.23 4.72 -32.96 3 6 1 86 311.317 3 ↓

Analogs

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Popular Name: 6-bromo-N-(3-chlorophenyl)-2-imino-chromene-3-carboxamide 6-bromo-N-(3-chlorophenyl)-2-imi…

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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) 3.17 6.18 -37.61 3 4 1 68 378.633 2 ↓

Analogs

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Popular Name: 6-bromo-N-(4-ethoxyphenyl)-2-imino-chromene-3-carboxamide 6-bromo-N-(4-ethoxyphenyl)-2-imi…

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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) 2.95 5.89 -37.39 3 5 1 77 388.241 4 ↓

Analogs

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Popular Name: 6-bromo-N-(3,4-dimethylphenyl)-2-imino-chromene-3-carboxamide 6-bromo-N-(3,4-dimethylphenyl)-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) 3.34 6.9 -35.01 3 4 1 68 372.242 2 ↓

Parameters Provided:

ring.id = 42481
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 = 42481 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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