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

Analogs

6663572
6663572
6663573
6663573

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-(2-pyridylmethyl)quinoxaline-6-carboxamide 2,3-dimethyl-N-(2-pyridylmethyl)…

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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) 1.57 4.34 -14.33 1 5 0 68 292.342 3 ↓
Mid Mid (pH 6-8) 1.64 2.11 -37.26 2 5 1 73 293.35 3 ↓
Mid Mid (pH 6-8) 1.64 3.09 -38.72 2 5 1 73 293.35 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-methoxy-1-(2-pyridyl)ethyl]-2,3-dimethyl-quinoxaline-6-carboxamide N-[(1R)-2-methoxy-1-(2-pyridyl)e…

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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) 1.74 4.55 -13.25 1 6 0 77 336.395 5 ↓
Lo Low (pH 4.5-6) 1.74 4.81 -43.33 2 6 1 78 337.403 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2-methoxy-1-(2-pyridyl)ethyl]-2,3-dimethyl-quinoxaline-6-carboxamide N-[(1S)-2-methoxy-1-(2-pyridyl)e…

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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) 1.74 4.77 -12.91 1 6 0 77 336.395 5 ↓
Lo Low (pH 4.5-6) 1.74 4.81 -43.32 2 6 1 78 337.403 5 ↓

Parameters Provided:

ring.id = 66848
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 = 66848 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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