UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-[(Z)-(1-benzyl-3-piperidylidene)amino]oxyacetic 2-[(Z)-(1-benzyl-3-piperidyliden…

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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) 1.28 6.79 -53.16 0 5 -1 65 261.301 5 ↓
Lo Low (pH 4.5-6) 1.28 9.05 -68.53 1 5 0 66 262.309 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(Z)-(1-benzyl-3-piperidylidene)amino]urea [(Z)-(1-benzyl-3-piperidylidene)…

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) 1.12 1.9 -9.19 3 5 0 71 246.314 3 ↓
Lo Low (pH 4.5-6) 1.12 4.16 -48 4 5 1 72 247.322 3 ↓

Parameters Provided:

ring.id = 265368
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 = 265368 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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