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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: 3-(benzylsulfanyl)azetidine hydrochloride 3-(benzylsulfanyl)azetidine hydr…

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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) 2.07 5.87 -40.13 2 1 1 17 180.296 3 ↓
Hi High (pH 8-9.5) 2.07 4.18 -2.77 1 1 0 12 179.288 3 ↓

Analogs

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Popular Name: 3-(o-tolylmethylsulfanyl)azetidine 3-(o-tolylmethylsulfanyl)azetidine

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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) 2.47 6.4 -40.56 2 1 1 17 194.323 3 ↓
Hi High (pH 8-9.5) 2.47 4.71 -2.79 1 1 0 12 193.315 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(m-tolylmethylsulfanyl)azetidine 3-(m-tolylmethylsulfanyl)azetidine

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) 2.49 6.54 -40.23 2 1 1 17 194.323 3 ↓
Hi High (pH 8-9.5) 2.49 4.85 -2.85 1 1 0 12 193.315 3 ↓

Parameters Provided:

ring.id = 371137
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 = 371137 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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