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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-hydroxy-N-methyl-N-[(1R)-1-methyl-2-(4-methyl-2-pyridyl)ethyl]pyrazine-2-carboxamide 5-hydroxy-N-methyl-N-[(1R)-1-met…

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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) 1.11 4.81 -12.63 1 6 0 79 286.335 4 ↓
Hi High (pH 8-9.5) 1.56 2.69 -44.8 0 6 -1 82 285.327 4 ↓
Mid Mid (pH 6-8) 1.11 5.18 -35.73 2 6 1 80 287.343 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-hydroxy-N-methyl-N-[(1S)-1-methyl-2-(4-methyl-2-pyridyl)ethyl]pyrazine-2-carboxamide 5-hydroxy-N-methyl-N-[(1S)-1-met…

Find On: PubMed — Wikipedia — Google

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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) 1.11 5.63 -11.72 1 6 0 79 286.335 4 ↓
Hi High (pH 8-9.5) 1.56 3.53 -46.82 0 6 -1 82 285.327 4 ↓
Mid Mid (pH 6-8) 1.11 5.41 -36.92 2 6 1 80 287.343 4 ↓

Parameters Provided:

ring.id = 387478
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 = 387478 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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