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

Analogs

23359534
23359534

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Popular Name: (2R)-N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2R)-N-(5-butyl-1,3,4-thiadiazol…

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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) 3.58 9.21 -20 2 6 0 84 396.516 8 ↓
Hi High (pH 8-9.5) 3.77 8.14 -45.35 1 6 -1 90 395.508 8 ↓

Analogs

23359531
23359531

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Popular Name: (2S)-N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2S)-N-(5-butyl-1,3,4-thiadiazol…

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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) 3.58 9.21 -20.1 2 6 0 84 396.516 8 ↓
Hi High (pH 8-9.5) 3.77 8.14 -45.94 1 6 -1 90 395.508 8 ↓

Analogs

14227944
14227944

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Popular Name: (2R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2R)-N-(5-ethyl-1,3,4-thiadiazol…

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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) 2.52 7.7 -18.3 2 6 0 84 368.462 6 ↓

Analogs

14227941
14227941

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Popular Name: (2S)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2S)-N-(5-ethyl-1,3,4-thiadiazol…

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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) 2.52 7.71 -18.39 2 6 0 84 368.462 6 ↓

Analogs

14240698
14240698

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Popular Name: (2S)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanamide (2S)-N-(5-ethylsulfanyl-1,3,4-th…

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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) 4.11 9.69 -14.96 2 6 0 84 428.583 8 ↓

Analogs

14240697
14240697

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Popular Name: (2R)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanamide (2R)-N-(5-ethylsulfanyl-1,3,4-th…

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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) 4.11 9.64 -14.89 2 6 0 84 428.583 8 ↓

Analogs

25444373
25444373
25444377
25444377
7807854
7807854

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanamide (2R)-N-(5-ethyl-1,3,4-thiadiazol…

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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) 3.30 9.13 -16.35 2 6 0 84 396.516 7 ↓

Analogs

14247014
14247014

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2R)-N-(5-ethylsulfanyl-1,3,4-th…

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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) 3.33 8.28 -16.77 2 6 0 84 400.529 7 ↓

Analogs

14247013
14247013

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]propanamide (2S)-N-(5-ethylsulfanyl-1,3,4-th…

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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) 3.33 8.28 -16.84 2 6 0 84 400.529 7 ↓

Parameters Provided:

ring.id = 139024
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 = 139024 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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