UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (3S)-3-methyl-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[[(3R)-2-oxo-3-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) 0.03 2.28 -61.88 2 7 -1 102 268.293 2 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[[(3R)-2-oxo-3-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) 0.03 2.39 -70.89 2 7 -1 102 268.293 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[[(3S)-2-oxo-3-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) 0.03 2.28 -64.79 2 7 -1 102 268.293 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[[(3S)-2-oxo-3-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) 0.03 2.38 -64.99 2 7 -1 102 268.293 2 ↓

Analogs

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Popular Name: (3S)-3-ethyl-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[[(3R)-2-oxo-3-pi…

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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) 0.37 2.84 -56.22 2 7 -1 102 282.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-ethyl-1-[[(3R)-2-oxo-3-pi…

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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) 0.37 2.86 -70.48 2 7 -1 102 282.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-ethyl-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[[(3S)-2-oxo-3-pi…

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) 0.37 2.84 -59.43 2 7 -1 102 282.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-ethyl-1-[[(3S)-2-oxo-3-pi…

Find On: PubMed — Wikipedia — Google

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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) 0.37 2.87 -64.36 2 7 -1 102 282.32 3 ↓

Analogs

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Popular Name: (3S)-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3S)-1-[[(3R)-2-oxo-3-piperidyl]…

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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) 0.93 3.6 -56.6 2 7 -1 102 296.347 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[[(3R)-2-oxo-3-piperidyl]carbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3R)-1-[[(3R)-2-oxo-3-piperidyl]…

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) 0.93 3.64 -70.96 2 7 -1 102 296.347 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3S)-1-[[(3S)-2-oxo-3-piperidyl]…

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) 0.93 3.6 -59.92 2 7 -1 102 296.347 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[[(3S)-2-oxo-3-piperidyl]carbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3R)-1-[[(3S)-2-oxo-3-piperidyl]…

Find On: PubMed — Wikipedia — Google

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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) 0.93 3.64 -64.8 2 7 -1 102 296.347 4 ↓

Parameters Provided:

ring.id = 311249
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 = 311249 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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