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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-(2-pyridylmethylamino)cinnoline-3-carbonitrile 4-(2-pyridylmethylamino)cinnolin…

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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) 1.94 4.6 -11.76 1 5 0 74 261.288 3 ↓
Lo Low (pH 4.5-6) 1.94 5.01 -43.14 2 5 1 76 262.296 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methyl-4-(2-pyridylmethylamino)cinnoline-3-carbonitrile 6-methyl-4-(2-pyridylmethylamino…

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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) 2.36 5.26 -11.08 1 5 0 74 275.315 3 ↓
Lo Low (pH 4.5-6) 2.36 5.66 -42.31 2 5 1 76 276.323 3 ↓

Parameters Provided:

ring.id = 544427
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 = 544427 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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