UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

36782319
36782319
36782403
36782403
36782404
36782404
36782415
36782415
7141748
7141748

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Popular Name: N-cyclopropyl-2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazin-1-yl]acetamide N-cyclopropyl-2-[4-[(2-hydroxy-1…

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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) 2.70 5.07 -36.71 3 5 1 57 340.447 5 ↓
Hi High (pH 8-9.5) 2.71 3.02 -14.06 2 5 0 56 339.439 5 ↓

Analogs

7141751
7141751

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Popular Name: 2-[4-[(6-bromo-2-hydroxy-1-naphthyl)methyl]piperazin-1-yl]-N-cyclopropyl-acetamide 2-[4-[(6-bromo-2-hydroxy-1-napht…

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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) 3.49 6.28 -42.53 3 5 1 57 419.343 5 ↓
Hi High (pH 8-9.5) 3.49 4.15 -11.76 2 5 0 56 418.335 5 ↓

Analogs

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Popular Name: N-cyclopropyl-2-[4-[(2-hydroxy-7-methoxy-1-naphthyl)methyl]piperazin-1-yl]acetamide N-cyclopropyl-2-[4-[(2-hydroxy-7…

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) 2.74 4.97 -37.95 3 6 1 66 370.473 6 ↓
Hi High (pH 8-9.5) 2.74 2.87 -13.7 2 6 0 65 369.465 6 ↓

Parameters Provided:

ring.id = 126509
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 = 126509 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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