UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12025791
12025791

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Popular Name: 1,1-dioxo-2-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2-thiazolidin-3-one 1,1-dioxo-2-[3-(pyrrolidine-1-ca…

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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) 0.21 -4.49 -26.59 0 6 0 75 308.359 2 ↓

Analogs

12002666
12002666
12026375
12026375

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Popular Name: (4S)-4-methyl-1,1-dioxo-2-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2-thiazolidin-3-one (4S)-4-methyl-1,1-dioxo-2-[3-(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) 0.69 -4.11 -23.57 0 6 0 75 322.386 2 ↓

Analogs

12026375
12026375
12002662
12002662

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Popular Name: (4R)-4-methyl-1,1-dioxo-2-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2-thiazolidin-3-one (4R)-4-methyl-1,1-dioxo-2-[3-(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) 0.69 -4.18 -20.23 0 6 0 75 322.386 2 ↓

Analogs

12003307
12003307

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Popular Name: 2-[2-chloro-5-(pyrrolidine-1-carbonyl)phenyl]-1,1-dioxo-1,2-thiazolidin-3-one 2-[2-chloro-5-(pyrrolidine-1-car…

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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) 0.84 -4.38 -25.09 0 6 0 75 342.804 2 ↓

Analogs

12005023
12005023
12005026
12005026
12005039
12005039
12005042
12005042
12005299
12005299

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Popular Name: 2-[4-chloro-3-(pyrrolidine-1-carbonyl)phenyl]-4,4-dimethyl-1,1-dioxo-1,2-thiazolidin-3-one 2-[4-chloro-3-(pyrrolidine-1-car…

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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) 1.73 -3.88 -18.99 0 6 0 75 370.858 2 ↓

Analogs

12003739
12003739
12003753
12003753
12003757
12003757
12004031
12004031
12004044
12004044

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Popular Name: (4S)-2-[2-chloro-5-(pyrrolidine-1-carbonyl)phenyl]-4-methyl-1,1-dioxo-1,2-thiazolidin-3-one (4S)-2-[2-chloro-5-(pyrrolidine-…

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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) 1.32 -4.07 -18.31 0 6 0 75 356.831 2 ↓

Analogs

12003753
12003753
12003757
12003757
12004031
12004031
12004044
12004044
12003732
12003732

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Popular Name: (4R)-2-[2-chloro-5-(pyrrolidine-1-carbonyl)phenyl]-4-methyl-1,1-dioxo-1,2-thiazolidin-3-one (4R)-2-[2-chloro-5-(pyrrolidine-…

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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) 1.32 -4.09 -23.83 0 6 0 75 356.831 2 ↓

Analogs

12004044
12004044
12003732
12003732
12003739
12003739
12003753
12003753

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Popular Name: 2-[2-chloro-5-(pyrrolidine-1-carbonyl)phenyl]-4,4-dimethyl-1,1-dioxo-1,2-thiazolidin-3-one 2-[2-chloro-5-(pyrrolidine-1-car…

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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) 1.73 -3.69 -23.17 0 6 0 75 370.858 2 ↓

Analogs

12004803
12004803

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Popular Name: 2-[4-chloro-3-(pyrrolidine-1-carbonyl)phenyl]-1,1-dioxo-1,2-thiazolidin-3-one 2-[4-chloro-3-(pyrrolidine-1-car…

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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) 0.84 -4.34 -21.22 0 6 0 75 342.804 2 ↓

Analogs

12005026
12005026
12005039
12005039
12005042
12005042
12005299
12005299
12003541
12003541

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Popular Name: (4S)-2-[4-chloro-3-(pyrrolidine-1-carbonyl)phenyl]-4-methyl-1,1-dioxo-1,2-thiazolidin-3-one (4S)-2-[4-chloro-3-(pyrrolidine-…

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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) 1.32 -4.3 -20.05 0 6 0 75 356.831 2 ↓

Analogs

12005039
12005039
12005042
12005042
12005299
12005299
12003541
12003541
12005023
12005023

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Popular Name: (4R)-2-[4-chloro-3-(pyrrolidine-1-carbonyl)phenyl]-4-methyl-1,1-dioxo-1,2-thiazolidin-3-one (4R)-2-[4-chloro-3-(pyrrolidine-…

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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) 1.32 -4.12 -18.88 0 6 0 75 356.831 2 ↓

Parameters Provided:

ring.id = 68122
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 = 68122 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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