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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]pyridine-4-carboxylic 2-[(2,2-difluoro-1,3-benzodioxol…

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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) 3.41 4.56 -54.96 1 6 -1 84 293.205 3 ↓
Lo Low (pH 4.5-6) 3.41 5.02 -68.53 2 6 0 85 294.213 3 ↓

Analogs

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Popular Name: N2-(1,3-benzodioxol-5-yl)-6-propoxy-pyridine-2,5-diamine N2-(1,3-benzodioxol-5-yl)-6-prop…

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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) 3.63 3.83 -8.03 3 6 0 79 287.319 5 ↓

Analogs

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Popular Name: N2-(1,3-benzodioxol-5-yl)-6-isopropoxy-pyridine-2,5-diamine N2-(1,3-benzodioxol-5-yl)-6-isop…

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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) 3.49 3.84 -7.72 3 6 0 79 287.319 4 ↓

Analogs

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Popular Name: N2-(1,3-benzodioxol-5-yl)-6-ethoxy-pyridine-2,5-diamine N2-(1,3-benzodioxol-5-yl)-6-etho…

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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) 3.13 3.03 -8.15 3 6 0 79 273.292 4 ↓

Analogs

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Popular Name: N2-(1,3-benzodioxol-5-yl)-6-methoxy-pyridine-2,5-diamine N2-(1,3-benzodioxol-5-yl)-6-meth…

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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) 2.75 2.08 -8.24 3 6 0 79 259.265 3 ↓

Analogs

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Popular Name: N2-(2,2-difluoro-1,3-benzodioxol-5-yl)-6-methoxy-pyridine-2,5-diamine N2-(2,2-difluoro-1,3-benzodioxol…

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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) 3.38 2.52 -7.14 3 6 0 79 295.245 3 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-5-yl)-6-bromo-pyridin-2-amine N-(1,3-benzodioxol-5-yl)-6-bromo…

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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) 4.07 5.81 -8.33 1 4 0 43 293.12 2 ↓

Analogs

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Popular Name: 6-bromo-N-(2,2-difluoro-1,3-benzodioxol-5-yl)pyridin-2-amine 6-bromo-N-(2,2-difluoro-1,3-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) 4.70 6.24 -7.32 1 4 0 43 329.1 2 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-5-yl)-6-chloro-3-nitro-pyridin-2-amine N-(1,3-benzodioxol-5-yl)-6-chlor…

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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) 3.85 6.78 -7.72 1 7 0 89 293.666 3 ↓

Analogs

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Popular Name: 5-amino-2-(1,3-benzodioxol-5-ylamino)pyridine-3-carboxamide 5-amino-2-(1,3-benzodioxol-5-yla…

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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 0.58 -13.34 5 7 0 113 272.264 3 ↓
Lo Low (pH 4.5-6) 1.32 -0.4 -43.58 6 7 1 114 273.272 3 ↓

Parameters Provided:

ring.id = 34453
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 = 34453 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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