UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(4-chloro-3-methyl-phenyl)-N-(2-cyanoethyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetam N-(4-chloro-3-methyl-phenyl)-N-(…

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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) 3.02 -0.54 -16.57 0 7 0 96 413.89 7 ↓

Analogs

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Popular Name: (2R)-N-ethyl-N-phenyl-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide (2R)-N-ethyl-N-phenyl-2-[[5-(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) 3.25 4.94 -11.07 0 6 0 72 354.435 6 ↓

Analogs

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Popular Name: (2S)-N-ethyl-N-phenyl-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide (2S)-N-ethyl-N-phenyl-2-[[5-(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) 3.25 4.89 -11.15 0 6 0 72 354.435 6 ↓

Analogs

4889693
4889693
6100105
6100105
6100416
6100416
6301555
6301555
6500966
6500966

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Popular Name: N-(2,4-dimethylphenyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide N-(2,4-dimethylphenyl)-2-[[5-(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) 3.09 3.45 -12.39 1 6 0 81 340.408 5 ↓

Analogs

6100191
6100191

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Popular Name: methyl methyl

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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) 2.43 2.55 -15.47 1 8 0 107 370.39 7 ↓

Analogs

6100105
6100105
6301555
6301555
6500966
6500966
4889545
4889545

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Popular Name: 2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)-acetamide 2-[[5-(3-pyridyl)-1,3,4-oxadiazo…

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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) 2.53 -2.47 -11.64 1 6 0 80 354.435 5 ↓

Analogs

6100380
6100380

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Popular Name: N-(2-fluorophenyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide N-(2-fluorophenyl)-2-[[5-(3-pyri…

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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) 2.38 2.02 -11.19 1 6 0 81 330.344 5 ↓

Analogs

6100416
6100416
34889574
34889574

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Popular Name: 2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[2-(trifluoromethyl)phenyl]-acetamide 2-[[5-(3-pyridyl)-1,3,4-oxadiazo…

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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) 3.11 -1.26 -10.43 1 6 0 80 380.351 6 ↓

Analogs

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Popular Name: N-(2-nitrophenyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide N-(2-nitrophenyl)-2-[[5-(3-pyrid…

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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) 2.17 -2.76 -13.35 1 9 0 126 357.351 6 ↓

Analogs

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Popular Name: N-(3-methylsulfanylphenyl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide N-(3-methylsulfanylphenyl)-2-[[5…

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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) 2.67 -4.04 -12.12 1 6 0 80 358.448 6 ↓

Parameters Provided:

ring.id = 72523
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 = 72523 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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