UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

19831720
19831720

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Popular Name: 1-(aminomethyl)-N-cyclopentyl-N-methyl-4-phenyl-cyclohexanamine 1-(aminomethyl)-N-cyclopentyl-N-…

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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) 3.62 9.31 -124.31 4 2 2 32 288.479 4 ↓
Mid Mid (pH 6-8) 3.62 7.47 -44.72 3 2 1 31 287.471 4 ↓

Analogs

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Popular Name: [1-(cyclopentylamino)-4-phenyl-cyclohexyl]methanol [1-(cyclopentylamino)-4-phenyl-c…

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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) 3.93 6.86 -34.63 3 2 1 37 274.428 4 ↓

Parameters Provided:

ring.id = 139801
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 = 139801 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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