UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

8061656
8061656

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Popular Name: N-(4-fluoro-2-methyl-phenyl)-3-phenyl-thiophene-2-carboxamide N-(4-fluoro-2-methyl-phenyl)-3-p…

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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) 4.99 10.07 -9.22 1 2 0 29 311.381 3 ↓

Analogs

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Popular Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-3-(p-tolyl)thiophene-2-carboxamide N-[3-(2-amino-2-oxo-ethoxy)pheny…

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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) 3.66 7.13 -26.48 3 5 0 81 366.442 6 ↓

Analogs

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Popular Name: N-(3-acetamido-2-methyl-phenyl)-3-(p-tolyl)thiophene-2-carboxamide N-(3-acetamido-2-methyl-phenyl)-…

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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) 4.47 9.65 -19.87 2 4 0 58 364.47 4 ↓

Analogs

26500833
26500833

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Popular Name: N-(5-acetamido-2-fluoro-phenyl)-3-(p-tolyl)thiophene-2-carboxamide N-(5-acetamido-2-fluoro-phenyl)-…

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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) 4.21 8.73 -13.77 2 4 0 58 368.433 4 ↓

Analogs

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Popular Name: N-[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]-3-(4-fluorophenyl)thiophene-2-carboxamide N-[5-(diethylsulfamoyl)-2,3-dime…

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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) 5.43 10.25 -18.56 1 5 0 66 460.596 7 ↓

Analogs

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Popular Name: N-(2-chlorophenyl)-3-phenyl-thiophene-2-carboxamide N-(2-chlorophenyl)-3-phenyl-thio…

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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) 5.08 9.73 -7.75 1 2 0 29 313.809 3 ↓

Analogs

8061721
8061721

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Popular Name: N-[4-(diethylcarbamoyl)phenyl]-3-phenyl-thiophene-2-carboxamide N-[4-(diethylcarbamoyl)phenyl]-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) 4.17 10.8 -16.65 1 4 0 49 378.497 6 ↓

Analogs

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Popular Name: N-(o-tolyl)-3-phenyl-thiophene-2-carboxamide N-(o-tolyl)-3-phenyl-thiophene-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) 4.85 10 -9.65 1 2 0 29 293.391 3 ↓

Analogs

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Popular Name: N-(3-methoxyphenyl)-3-phenyl-thiophene-2-carboxamide N-(3-methoxyphenyl)-3-phenyl-thi…

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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) 4.48 8.41 -9.68 1 3 0 38 309.39 4 ↓

Analogs

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Popular Name: 3-(p-tolyl)-N-[4-(ureidomethyl)phenyl]thiophene-2-carboxamide 3-(p-tolyl)-N-[4-(ureidomethyl)p…

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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) 3.73 6 -15.44 4 5 0 84 365.458 5 ↓

Analogs

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Popular Name: 3-phenyl-N-[4-(ureidomethyl)phenyl]thiophene-2-carboxamide 3-phenyl-N-[4-(ureidomethyl)phen…

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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) 3.29 5.32 -15.37 4 5 0 84 351.431 5 ↓

Analogs

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Popular Name: N-[3-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl]-3-phenyl-thiophene-2-carboxamide N-[3-[(2-amino-2-oxo-ethyl)carba…

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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) 2.35 4.41 -14.96 4 6 0 101 379.441 6 ↓

Parameters Provided:

ring.id = 55044
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 = 55044 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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