UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

9344802
9344802
5239721
5239721

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Popular Name: N-benzothiazol-2-yl-2-(1,3-dioxoisoindolin-2-yl)-N-ethyl-acetamide N-benzothiazol-2-yl-2-(1,3-dioxo…

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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) 3.51 0.48 -23.98 0 6 0 72 365.414 4 ↓

Analogs

10463382
10463382

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Popular Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(1,3-dioxoisoindolin-2-yl)acetamide N-(6-bromo-1,3-benzothiazol-2-yl…

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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) 4.70 12.92 -52.43 1 7 1 77 516.441 8 ↓

Analogs

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Popular Name: N-[3-(dimethylamino)propyl]-2-(1,3-dioxoisoindolin-2-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamid N-[3-(dimethylamino)propyl]-2-(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) 3.46 11.01 -55.76 1 8 1 86 453.544 8 ↓

Analogs

14241525
14241525
21588105
21588105
21588108
21588108
21598757
21598757
21598759
21598759

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Popular Name: (2S)-N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanamide (2S)-N-(1,3-benzothiazol-2-yl)-2…

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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 6.95 -28.15 1 8 0 115 443.506 6 ↓

Analogs

21588105
21588105
21588108
21588108
21598757
21598757
21598759
21598759
14241524
14241524

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Popular Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanamide (2R)-N-(1,3-benzothiazol-2-yl)-2…

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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 6.95 -28.18 1 8 0 115 443.506 6 ↓

Analogs

14244439
14244439

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Popular Name: (2S)-N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-N-methyl-propanamide (2S)-N-(1,3-benzothiazol-2-yl)-2…

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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) 3.49 9.86 -19.32 0 6 0 72 365.414 3 ↓

Analogs

14244438
14244438

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Popular Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-N-methyl-propanamide (2R)-N-(1,3-benzothiazol-2-yl)-2…

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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) 3.49 9.84 -19.34 0 6 0 72 365.414 3 ↓

Analogs

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Popular Name: (2R)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)-2-phthalimido-butyramide (2R)-N-(6-methyl-1,3-benzothiazo…

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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) 4.09 -0.33 -21.56 1 6 0 81 425.535 6 ↓

Analogs

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Popular Name: (2S)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)-2-phthalimido-butyramide (2S)-N-(6-methyl-1,3-benzothiazo…

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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) 4.09 -0.32 -21.58 1 6 0 81 425.535 6 ↓

Parameters Provided:

ring.id = 6288
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 = 6288 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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