UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11839283
11839283
39677106
39677106
39677107
39677107
39677134
39677134
39677135
39677135

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Popular Name: N-[(2-chlorophenyl)methyl]-3-[(3S)-1-(3-methylthiophene-2-carbonyl)-3-piperidyl]propanamide N-[(2-chlorophenyl)methyl]-3-[(3…

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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) 4.10 -1.71 -11.85 1 4 0 49 404.963 6 ↓

Analogs

39677106
39677106
39677107
39677107
39677134
39677134
39677135
39677135
39695150
39695150

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Popular Name: N-[(2-chlorophenyl)methyl]-3-[(3R)-1-(3-methylthiophene-2-carbonyl)-3-piperidyl]propanamide N-[(2-chlorophenyl)methyl]-3-[(3…

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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) 4.10 -1.65 -12 1 4 0 49 404.963 6 ↓

Analogs

12228152
12228152

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Popular Name: N-[(3,4-difluorophenyl)methyl]-3-[(3S)-1-[5-(methoxymethyl)thiophene-2-carbonyl]-3-piperidyl]propana N-[(3,4-difluorophenyl)methyl]-3…

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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) 3.54 -0.88 -14.36 1 5 0 59 436.524 8 ↓

Analogs

12228143
12228143

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Popular Name: N-[(3,4-difluorophenyl)methyl]-3-[(3R)-1-[5-(methoxymethyl)thiophene-2-carbonyl]-3-piperidyl]propana N-[(3,4-difluorophenyl)methyl]-3…

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) 3.54 -0.85 -14.08 1 5 0 59 436.524 8 ↓

Parameters Provided:

ring.id = 58201
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 = 58201 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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