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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-(cyclopentylsulfanyl)quinoline-3-carboxylic acid 4-(cyclopentylsulfanyl)quinoline…

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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) 3.56 8.99 -52.25 0 3 -1 53 272.349 3 ↓
Lo Low (pH 4.5-6) 3.56 9.4 -39.88 1 3 0 54 273.357 3 ↓

Analogs

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Popular Name: 6-bromo-4-cyclopentylsulfanyl-quinolin-3-amine 6-bromo-4-cyclopentylsulfanyl-qu…

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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) 4.42 7.1 -5.05 2 2 0 39 323.259 2 ↓

Analogs

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Popular Name: 4-cyclopentylsulfanylquinoline-3-carbonitrile 4-cyclopentylsulfanylquinoline-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) 3.74 8.86 -6.1 0 2 0 37 254.358 2 ↓

Analogs

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Popular Name: 4-cyclopentylsulfanyl-N'-hydroxy-quinoline-3-carboxamidine 4-cyclopentylsulfanyl-N'-hydroxy…

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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) 2.30 5.01 -8.16 3 4 0 72 287.388 3 ↓

Analogs

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Popular Name: 4-cyclopentylsulfanylquinoline-3-carboxamidine 4-cyclopentylsulfanylquinoline-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) 2.37 6.02 -32.93 4 3 1 65 272.397 3 ↓

Analogs

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Popular Name: (4-cyclopentylsulfanyl-3-quinolyl)methanamine (4-cyclopentylsulfanyl-3-quinoly…

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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 6.55 -46 3 2 1 41 259.398 3 ↓
Hi High (pH 8-9.5) 3.17 6.17 -5.78 2 2 0 39 258.39 3 ↓

Parameters Provided:

ring.id = 284235
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 = 284235 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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