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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-cyclopropyl-4-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide N-cyclopropyl-4-(1,1,3-trioxo-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) 0.43 -5.29 -21 1 6 0 84 294.332 3 ↓

Analogs

12020982
12020982
12022384
12022384

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Popular Name: N-cyclopropyl-4-[(4S)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide N-cyclopropyl-4-[(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) 0.90 -5.01 -19.45 1 6 0 84 308.359 3 ↓

Analogs

12022384
12022384
12020977
12020977

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclopropyl-4-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide N-cyclopropyl-4-[(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) 0.90 -5 -19.5 1 6 0 84 308.359 3 ↓

Analogs

12020977
12020977
12020982
12020982

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Popular Name: N-cyclopropyl-4-(4,4-dimethyl-1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide N-cyclopropyl-4-(4,4-dimethyl-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) 1.32 -4.6 -18.43 1 6 0 84 322.386 3 ↓

Analogs

12023119
12023119
12023123
12023123

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Popular Name: 2-chloro-N-cyclopropyl-4-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide 2-chloro-N-cyclopropyl-4-(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) 1.03 -5.41 -22.4 1 6 0 84 328.777 3 ↓

Analogs

12024022
12024022
12024038
12024038
12024043
12024043
12024046
12024046
12024050
12024050

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-cyclopropyl-4-[(4S)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 2-chloro-N-cyclopropyl-4-[(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) 1.51 -5.13 -20.73 1 6 0 84 342.804 3 ↓

Analogs

12024038
12024038
12024043
12024043
12024046
12024046
12024050
12024050
12024018
12024018

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-cyclopropyl-4-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]benzamide 2-chloro-N-cyclopropyl-4-[(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) 1.51 -4.91 -20.22 1 6 0 84 342.804 3 ↓

Parameters Provided:

ring.id = 68757
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 = 68757 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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