UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

42924443
42924443

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Popular Name: N-butyl-1-[1-(3-chlorophenyl)cyclopentanecarbonyl]piperidine-4-carboxamide N-butyl-1-[1-(3-chlorophenyl)cyc…

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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) 4.71 10.46 -11.16 1 4 0 49 390.955 6 ↓

Analogs

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Popular Name: N-[(3R)-1-[1-(4-methoxyphenyl)cyclopentanecarbonyl]-3-piperidyl]acetamide N-[(3R)-1-[1-(4-methoxyphenyl)cy…

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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) 2.33 7.21 -14.51 1 5 0 59 344.455 4 ↓

Analogs

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Popular Name: N-[(3S)-1-[1-(4-methoxyphenyl)cyclopentanecarbonyl]-3-piperidyl]acetamide N-[(3S)-1-[1-(4-methoxyphenyl)cy…

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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) 2.33 7.01 -14.34 1 5 0 59 344.455 4 ↓

Analogs

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Popular Name: N-methyl-N-[1-[1-(m-tolyl)cyclopentanecarbonyl]-4-piperidyl]ethanesulfonamide N-methyl-N-[1-[1-(m-tolyl)cyclop…

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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) 3.34 8.87 -15.49 0 5 0 58 392.565 5 ↓

Analogs

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Popular Name: N-ethyl-N-[1-[1-(m-tolyl)cyclopentanecarbonyl]-4-piperidyl]methanesulfonamide N-ethyl-N-[1-[1-(m-tolyl)cyclope…

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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) 3.34 8.55 -15.42 0 5 0 58 392.565 5 ↓

Analogs

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Popular Name: N-methyl-N-[1-[1-(m-tolyl)cyclopentanecarbonyl]-4-piperidyl]acetamide N-methyl-N-[1-[1-(m-tolyl)cyclop…

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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) 2.95 10.13 -12.57 0 4 0 41 342.483 3 ↓

Analogs

42928728
42928728
34866868
34866868

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Popular Name: 1-[1-(2-fluorophenyl)cyclopentanecarbonyl]piperidine-4-carboxamide 1-[1-(2-fluorophenyl)cyclopentan…

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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) 2.36 5.96 -12.89 2 4 0 63 318.392 3 ↓

Analogs

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Popular Name: [4-hydroxy-4-(hydroxymethyl)-1-piperidyl]-[1-(4-methoxyphenyl)cyclopentyl]methanone [4-hydroxy-4-(hydroxymethyl)-1-p…

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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) 1.99 3.13 -10.64 2 5 0 70 333.428 4 ↓

Parameters Provided:

ring.id = 65801
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 = 65801 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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