UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12002672
12002672
12002678
12002678
12002683
12002683
15858574
15858574
15858576
15858576

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Popular Name: N-cyclopentyl-3-[(4S)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide N-cyclopentyl-3-[(4S)-4-methyl-1…

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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) 1.91 -4.52 -23.7 1 6 0 84 336.413 3 ↓

Analogs

12002678
12002678
12002683
12002683
15858574
15858574
15858576
15858576
12002668
12002668

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Popular Name: N-cyclopentyl-3-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide N-cyclopentyl-3-[(4R)-4-methyl-1…

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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) 1.91 -4.52 -23.68 1 6 0 84 336.413 3 ↓

Analogs

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Popular Name: 4-chloro-N-cyclopentyl-3-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide 4-chloro-N-cyclopentyl-3-(1,1,3-…

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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) 2.07 -4.89 -23.67 1 6 0 84 356.831 3 ↓

Analogs

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Popular Name: 2-chloro-N-cyclopentyl-5-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide 2-chloro-N-cyclopentyl-5-(1,1,3-…

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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) 2.07 -4.91 -19.09 1 6 0 84 356.831 3 ↓

Analogs

12003553
12003553
12005031
12005031
12005035
12005035
12005044
12005044
12005045
12005045

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Popular Name: 2-chloro-N-cyclopentyl-5-(4,4-dimethyl-1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide 2-chloro-N-cyclopentyl-5-(4,4-di…

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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) 2.96 -4.51 -16.5 1 6 0 84 384.885 3 ↓

Analogs

12003748
12003748
12004036
12004036
12004048
12004048
32536838
32536838
32536839
32536839

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-cyclopentyl-3-[(4S)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 4-chloro-N-cyclopentyl-3-[(4S)-4…

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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) 2.54 -4.61 -22.48 1 6 0 84 370.858 3 ↓

Analogs

12004036
12004036
12004048
12004048
32536838
32536838
32536839
32536839
12003745
12003745

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-cyclopentyl-3-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 4-chloro-N-cyclopentyl-3-[(4R)-4…

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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) 2.54 -4.59 -22.39 1 6 0 84 370.858 3 ↓

Analogs

12004048
12004048
32536838
32536838
32536839
32536839
12003745
12003745
12003748
12003748

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-cyclopentyl-3-(4,4-dimethyl-1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide 4-chloro-N-cyclopentyl-3-(4,4-di…

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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) 2.96 -4.25 -21.44 1 6 0 84 384.885 3 ↓

Analogs

12005035
12005035
12005044
12005044
12005045
12005045
12003548
12003548
12003553
12003553

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-cyclopentyl-5-[(4S)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 2-chloro-N-cyclopentyl-5-[(4S)-4…

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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) 2.54 -4.84 -17.5 1 6 0 84 370.858 3 ↓

Analogs

12005044
12005044
12005045
12005045
12003548
12003548
12003553
12003553

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-cyclopentyl-5-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 2-chloro-N-cyclopentyl-5-[(4R)-4…

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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) 2.54 -4.83 -17.64 1 6 0 84 370.858 3 ↓

Parameters Provided:

ring.id = 71195
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 = 71195 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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