UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (2Z)-6-bromo-2-[2-chloro-5-(trifluoromethyl)phenyl]imino-chromene-3-carboxamide (2Z)-6-bromo-2-[2-chloro-5-(trif…

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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) 5.46 6.91 -30.01 3 4 1 70 446.63 3 ↓

Analogs

194685
194685
194688
194688

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Popular Name: (2Z)-8-methoxy-2-[(2-methoxyphenyl)imino]-2H-chromene-3-carboxamide (2Z)-8-methoxy-2-[(2-methoxyphen…

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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) 3.19 3.92 -29.53 3 6 1 89 325.344 4 ↓

Analogs

194685
194685
194688
194688

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Popular Name: (2Z)-2-[(2,5-dimethoxyphenyl)imino]-7-hydroxy-2H-chromene-3-carboxamide (2Z)-2-[(2,5-dimethoxyphenyl)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) 2.71 0.52 -31.33 4 7 1 109 341.343 4 ↓

Analogs

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Popular Name: N-acetyl-7-(diethylamino)-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-chromene-3-carboxamide N-acetyl-7-(diethylamino)-2-{[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) 4.70 9.8 -37.92 2 7 1 86 462.448 7 ↓
Ref Reference (pH 7) 4.70 8.74 -38.68 2 7 1 86 462.448 7 ↓
Lo Low (pH 4.5-6) 4.70 9.89 -36.18 3 7 0 87 463.456 7 ↓

Analogs

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Popular Name: (2Z)-2-(3-fluorophenyl)imino-6-hexyl-7-hydroxy-chromene-3-carboxamide (2Z)-2-(3-fluorophenyl)imino-6-h…

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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) 6.08 6.53 -32.13 4 5 1 90 383.443 7 ↓

Analogs

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Popular Name: N-acetyl-6-methoxy-2-(3-nitrophenyl)imino-chromene-3-carboxamide N-acetyl-6-methoxy-2-(3-nitrophe…

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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) 2.87 7.62 -46.52 2 9 1 128 382.352 4 ↓

Analogs

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Popular Name: 2-(3-methoxyphenyl)iminochromene-3-carboxamide 2-(3-methoxyphenyl)iminochromene…

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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) 3.20 -2.63 -22.4 2 5 0 77 294.31 3 ↓

Analogs

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Popular Name: N-acetyl-2-(3-chlorophenyl)imino-8-methoxy-chromene-3-carboxamide N-acetyl-2-(3-chlorophenyl)imino…

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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) 3.57 -0.39 -33.58 1 6 0 80 370.792 3 ↓

Analogs

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Popular Name: N-acetyl-6-bromo-2-phenylimino-chromene-3-carboxamide N-acetyl-6-bromo-2-phenylimino-c…

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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) 3.69 -1.27 -28.29 1 5 0 71 385.217 2 ↓

Parameters Provided:

ring.id = 74347
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 = 74347 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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