UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12232889
12232889
14008125
14008125
14008127
14008127
14008128
14008128
14008129
14008129

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Popular Name: (2-oxo-2-pyrrolidin-1-yl-ethyl)-phenyl-BLAHone (2-oxo-2-pyrrolidin-1-yl-ethyl)-…

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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) 1.67 -1.2 -12.66 0 7 0 73 381.461 3 ↓

Analogs

14008125
14008125
14008127
14008127
14008128
14008128
14008129
14008129
12232886
12232886

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Popular Name: (2-oxo-2-pyrrolidin-1-yl-ethyl)-phenyl-BLAHone (2-oxo-2-pyrrolidin-1-yl-ethyl)-…

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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) 1.67 -1.2 -12.63 0 7 0 73 381.461 3 ↓

Analogs

12233282
12233282
14012305
14012305
14012307
14012307
14012309
14012309
14012311
14012311

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Popular Name: (4-fluorophenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (4-fluorophenyl)-(2-oxo-2-pyrrol…

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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) 1.83 -0.46 -11.03 0 7 0 73 399.451 3 ↓

Analogs

14012305
14012305
14012307
14012307
14012309
14012309
14012311
14012311
12233278
12233278

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Popular Name: (4-fluorophenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (4-fluorophenyl)-(2-oxo-2-pyrrol…

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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) 1.83 -0.46 -11.06 0 7 0 73 399.451 3 ↓

Analogs

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Popular Name: (4-chlorophenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (4-chlorophenyl)-(2-oxo-2-pyrrol…

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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) 2.35 10.27 -10.75 0 7 0 73 415.906 3 ↓

Analogs

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Popular Name: (4-chlorophenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (4-chlorophenyl)-(2-oxo-2-pyrrol…

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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) 2.35 10.27 -10.76 0 7 0 73 415.906 3 ↓

Analogs

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Popular Name: (3,4-dimethylphenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (3,4-dimethylphenyl)-(2-oxo-2-py…

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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) 2.70 10.96 -12.58 0 7 0 73 409.515 3 ↓

Analogs

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Popular Name: (3,4-dimethylphenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (3,4-dimethylphenyl)-(2-oxo-2-py…

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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) 2.70 10.97 -12.67 0 7 0 73 409.515 3 ↓

Analogs

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Popular Name: (2,4-dimethylphenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (2,4-dimethylphenyl)-(2-oxo-2-py…

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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) 2.70 11.63 -12.12 0 7 0 73 409.515 3 ↓

Analogs

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Popular Name: (2,4-dimethylphenyl)-(2-oxo-2-pyrrolidin-1-yl-ethyl)BLAHone (2,4-dimethylphenyl)-(2-oxo-2-py…

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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) 2.70 11.22 -12.3 0 7 0 73 409.515 3 ↓

Analogs

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Popular Name: (2-oxo-2-pyrrolidin-1-yl-ethyl)-(p-tolyl)BLAHone (2-oxo-2-pyrrolidin-1-yl-ethyl)-…

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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) 2.12 10.43 -12.33 0 7 0 73 395.488 3 ↓

Analogs

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Popular Name: (2-oxo-2-pyrrolidin-1-yl-ethyl)-(p-tolyl)BLAHone (2-oxo-2-pyrrolidin-1-yl-ethyl)-…

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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) 2.12 10.43 -12.4 0 7 0 73 395.488 3 ↓

Parameters Provided:

ring.id = 97533
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 = 97533 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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