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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

6603634
6603634

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Popular Name: (2S)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)propionamide (2S)-N-(6-nitro-1,3-benzothiazol…

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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) 5.45 12.84 -18.55 1 7 0 97 419.462 6 ↓

Analogs

6603634
6603634

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Popular Name: (2R)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)propionamide (2R)-N-(6-nitro-1,3-benzothiazol…

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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) 5.45 12.81 -18.55 1 7 0 97 419.462 6 ↓

Analogs

14462106
14462106
14462108
14462108

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Popular Name: (2S)-N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)propionamide (2S)-N-(6-mesyl-1,3-benzothiazol…

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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) 4.36 -3.64 -25.87 1 6 0 85 452.557 6 ↓

Analogs

14462106
14462106
14462108
14462108

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)propionamide (2R)-N-(6-mesyl-1,3-benzothiazol…

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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) 4.36 -3.7 -25.87 1 6 0 85 452.557 6 ↓

Analogs

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Popular Name: acetamide, 2-([1,1'-biphenyl]-4-yloxy)-N-(6-chloro-2-benzothiazolyl)- acetamide, 2-([1,1'-biphenyl]-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) 5.80 12.08 -17.84 1 4 0 51 394.883 5 ↓

Analogs

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Popular Name: propanamide, 2-([1,1'-biphenyl]-4-yloxy)-N-(6-chloro-2-benzothiazolyl)- propanamide, 2-([1,1'-biphenyl]-…

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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) 6.17 12.66 -17.19 1 4 0 51 408.91 5 ↓

Analogs

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Popular Name: propanamide, 2-([1,1'-biphenyl]-4-yloxy)-N-(6-chloro-2-benzothiazolyl)- propanamide, 2-([1,1'-biphenyl]-…

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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) 6.17 12.66 -17.18 1 4 0 51 408.91 5 ↓

Analogs

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Popular Name: acetamide, 2-[(3-bromo[1,1'-biphenyl]-4-yl)oxy]-N-(6-chloro-2-benzothiazolyl)- acetamide, 2-[(3-bromo[1,1'-biph…

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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) 6.54 12.72 -19.97 1 4 0 51 473.779 5 ↓

Analogs

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Popular Name: butanamide, 2-([1,1'-biphenyl]-4-yloxy)-N-(6-chloro-2-benzothiazolyl)- butanamide, 2-([1,1'-biphenyl]-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) 6.67 13.25 -16.69 1 4 0 51 422.937 6 ↓

Analogs

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Popular Name: butanamide, 2-([1,1'-biphenyl]-4-yloxy)-N-(6-chloro-2-benzothiazolyl)- butanamide, 2-([1,1'-biphenyl]-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) 6.67 13.26 -16.73 1 4 0 51 422.937 6 ↓

Parameters Provided:

ring.id = 229725
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 = 229725 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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