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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: 5-bromo-N-(1-cyanocyclobutyl)pyridine-3-carboxamide 5-bromo-N-(1-cyanocyclobutyl)pyr…

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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) 1.36 3.85 -14.48 1 4 0 66 280.125 2 ↓

Analogs

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Popular Name: N-(3-aminocyclobutyl)-2-methoxy-pyridine-3-carboxamide N-(3-aminocyclobutyl)-2-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) -0.51 0.31 -58.32 4 5 1 79 222.268 3 ↓

Analogs

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Popular Name: N-(1-cyanocyclobutyl)-6-ethoxy-N-methyl-pyridine-3-carboxamide N-(1-cyanocyclobutyl)-6-ethoxy-N…

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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) 0.96 4.06 -17.23 0 5 0 66 259.309 4 ↓

Analogs

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Popular Name: N-(1-cyanocyclobutyl)-6-isopropoxy-N-methyl-pyridine-3-carboxamide N-(1-cyanocyclobutyl)-6-isopropo…

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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) 1.32 4.96 -16.97 0 5 0 66 273.336 4 ↓

Analogs

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Popular Name: N-(1-cyanocyclobutyl)-6-(dimethylamino)-N-methyl-pyridine-3-carboxamide N-(1-cyanocyclobutyl)-6-(dimethy…

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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) 0.63 6.22 -18.9 0 5 0 60 258.325 3 ↓

Analogs

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Popular Name: N-(1-cyanocyclobutyl)-N-methyl-pyridine-3-carboxamide N-(1-cyanocyclobutyl)-N-methyl-p…

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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) 0.18 4.54 -15.08 0 4 0 57 215.256 2 ↓

Analogs

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Popular Name: N5-(1-cyanocyclobutyl)-N5-methyl-pyridine-2,5-dicarboxamide N5-(1-cyanocyclobutyl)-N5-methyl…

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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) -0.93 1.47 -17.92 2 6 0 100 258.281 3 ↓

Parameters Provided:

ring.id = 4623
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 = 4623 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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