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

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-[methyl-(6-methylpyridazin-3-yl)amino]-1-piperidyl]-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl) [4-[methyl-(6-methylpyridazin-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) 1.42 7.72 -37.05 2 7 1 79 341.439 3 ↓
Mid Mid (pH 6-8) 1.42 7.28 -37.88 2 7 1 79 341.439 3 ↓
Mid Mid (pH 6-8) 1.42 7.16 -13.75 1 7 0 78 340.431 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-[(6-methylpyridazin-3-yl)amino]-1-piperidyl]-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methano [4-[(6-methylpyridazin-3-yl)amin…

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) 1.17 5.95 -38.12 3 7 1 88 327.412 3 ↓
Mid Mid (pH 6-8) 1.17 5.39 -16.19 2 7 0 87 326.404 3 ↓
Mid Mid (pH 6-8) 1.17 5.56 -40.62 3 7 1 88 327.412 3 ↓

Parameters Provided:

ring.id = 404102
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 = 404102 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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