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

Analogs

35766319
35766319
37092805
37092805
37505067
37505067
37504747
37504747
37504748
37504748

Draw Identity 99% 90% 80% 70%

Popular Name: (1-aminocyclohexyl)-[(2S)-2-cyclohexylpyrrolidin-1-yl]methanone (1-aminocyclohexyl)-[(2S)-2-cycl…

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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) 3.73 7.02 -47.86 3 3 1 48 279.448 2 ↓
Hi High (pH 8-9.5) 3.73 7.19 -6.73 2 3 0 46 278.44 2 ↓

Analogs

35766319
35766319
37092805
37092805
37505067
37505067
37504747
37504747
37504748
37504748

Draw Identity 99% 90% 80% 70%

Popular Name: (1-aminocyclohexyl)-[(2R)-2-cyclohexylpyrrolidin-1-yl]methanone (1-aminocyclohexyl)-[(2R)-2-cycl…

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) 3.73 6.47 -46.77 3 3 1 48 279.448 2 ↓
Hi High (pH 8-9.5) 3.73 6.53 -5.04 2 3 0 46 278.44 2 ↓

Analogs

39104223
39104223
59540034
59540034
62192318
62192318
62192321
62192321

Draw Identity 99% 90% 80% 70%

Popular Name: (4-aminocyclohexyl)-[(2S)-2-cyclohexylpyrrolidin-1-yl]methanone (4-aminocyclohexyl)-[(2S)-2-cycl…

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) 2.52 7.42 -51.49 3 3 1 48 279.448 2 ↓

Analogs

39104223
39104223
59540034
59540034
62192318
62192318
62192321
62192321

Draw Identity 99% 90% 80% 70%

Popular Name: (4-aminocyclohexyl)-[(2R)-2-cyclohexylpyrrolidin-1-yl]methanone (4-aminocyclohexyl)-[(2R)-2-cycl…

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) 2.52 6.87 -37.74 3 3 1 48 279.448 2 ↓

Parameters Provided:

ring.id = 577572
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 = 577572 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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