UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11982813
11982813

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-3-[(2S)-5-oxo-2-(p-tolylmethyl)pyrrolidin-2-yl]propanamide N-[2-(2-chlorophenyl)ethyl]-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) 4.21 -1.16 -15.76 2 4 0 58 398.934 8 ↓

Analogs

11982808
11982808

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-3-[(2R)-5-oxo-2-(p-tolylmethyl)pyrrolidin-2-yl]propanamide N-[2-(2-chlorophenyl)ethyl]-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) 4.21 -1.65 -16.03 2 4 0 58 398.934 8 ↓

Analogs

12036082
12036082

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Popular Name: N-[2-(3-fluorophenyl)ethyl]-3-[(2S)-2-[(4-methoxyphenyl)methyl]-5-oxo-pyrrolidin-2-yl]propanamide N-[2-(3-fluorophenyl)ethyl]-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) 3.33 -0.58 -19.31 2 5 0 67 398.478 9 ↓

Analogs

12036075
12036075

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Popular Name: N-[2-(3-fluorophenyl)ethyl]-3-[(2R)-2-[(4-methoxyphenyl)methyl]-5-oxo-pyrrolidin-2-yl]propanamide N-[2-(3-fluorophenyl)ethyl]-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) 3.33 -0.66 -17.07 2 5 0 67 398.478 9 ↓

Analogs

12037159
12037159

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Popular Name: 3-[(2R)-2-[(4-chlorophenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamid 3-[(2R)-2-[(4-chlorophenyl)methy…

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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) 3.46 -1.22 -19.59 2 6 0 77 444.959 10 ↓

Analogs

12037152
12037152

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Popular Name: 3-[(2S)-2-[(4-chlorophenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamid 3-[(2S)-2-[(4-chlorophenyl)methy…

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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) 3.46 -1.14 -21.72 2 6 0 77 444.959 10 ↓

Analogs

12039769
12039769

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-3-[(2S)-2-[(2-fluoro-4-methoxy-phenyl)methyl]-5-oxo-pyrrolidin-2-yl]prop N-[2-(2-chlorophenyl)ethyl]-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) 3.91 -0.75 -17.92 2 5 0 67 432.923 9 ↓

Analogs

12039761
12039761

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-3-[(2R)-2-[(2-fluoro-4-methoxy-phenyl)methyl]-5-oxo-pyrrolidin-2-yl]prop N-[2-(2-chlorophenyl)ethyl]-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) 3.91 -1.14 -16.31 2 5 0 67 432.923 9 ↓

Analogs

12041910
12041910
12099802
12099802
12099803
12099803

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Popular Name: 3-[(2R)-2-[(4-fluorophenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide 3-[(2R)-2-[(4-fluorophenyl)methy…

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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) 3.36 -1.08 -20.34 2 5 0 67 398.478 9 ↓

Analogs

12099802
12099802
12099803
12099803
12041908
12041908

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Popular Name: 3-[(2S)-2-[(4-fluorophenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide 3-[(2S)-2-[(4-fluorophenyl)methy…

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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) 3.36 -0.58 -20.02 2 5 0 67 398.478 9 ↓

Analogs

12217395
12217395
34970014
34970014
34970015
34970015

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Popular Name: (2S)-2-[3-[(2S)-2-[(3,4-dimethoxyphenyl)methyl]-5-oxo-pyrrolidin-2-yl]propanoylamino]-3-phenyl-propa (2S)-2-[3-[(2S)-2-[(3,4-dimethox…

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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) 2.06 -3.09 -24.12 4 8 0 120 453.539 11 ↓

Analogs

34970014
34970014
34970015
34970015
12217394
12217394

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Popular Name: (2S)-2-[3-[(2R)-2-[(3,4-dimethoxyphenyl)methyl]-5-oxo-pyrrolidin-2-yl]propanoylamino]-3-phenyl-propa (2S)-2-[3-[(2R)-2-[(3,4-dimethox…

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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) 2.06 -3.05 -22.24 4 8 0 120 453.539 11 ↓

Parameters Provided:

ring.id = 64663
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 = 64663 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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