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

Analogs

40747109
40747109
40747147
40747147
40748093
40748093
40748137
40748137
40748461
40748461

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-methyl-amino]-N-cyclopropyl-N-methyl-acetamide 2-[[(1R,5S)-8-azabicyclo[3.2.1]o…

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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) 0.61 3.54 -43.3 2 4 1 40 252.382 4 ↓
Mid Mid (pH 6-8) 0.61 5.94 -104.73 3 4 2 41 253.39 4 ↓

Analogs

40747109
40747109
40747147
40747147
40748093
40748093
40748137
40748137
40748461
40748461

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-ethyl-amino]-N-cyclopropyl-N-methyl-acetamide 2-[[(1R,5S)-8-azabicyclo[3.2.1]o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.99 4.38 -47.73 2 4 1 40 266.409 5 ↓
Mid Mid (pH 6-8) 0.99 6.32 -103.14 3 4 2 41 267.417 5 ↓

Analogs

40747109
40747109
40747147
40747147
40748093
40748093
40748137
40748137
40748461
40748461

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-propyl-amino]-N-cyclopropyl-N-methyl-acetamide 2-[[(1R,5S)-8-azabicyclo[3.2.1]o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.49 5.04 -48.04 2 4 1 40 280.436 6 ↓
Mid Mid (pH 6-8) 1.49 7.07 -104.83 3 4 2 41 281.444 6 ↓

Parameters Provided:

ring.id = 549525
filter.purchasability = annotated
page.format = targets
page.num = 1
rolex-org.lang = ja

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 = 549525 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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