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

Analogs

13010896
13010896

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Popular Name: N-[(1R)-1-(4-methoxyphenyl)propyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1R)-1-(4-methoxyphenyl)propy…

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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) 1.59 5.77 -16.04 1 5 0 59 322.43 7 ↓

Analogs

13010894
13010894

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Popular Name: N-[(1S)-1-(4-methoxyphenyl)propyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1S)-1-(4-methoxyphenyl)propy…

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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) 1.59 5.77 -16 1 5 0 59 322.43 7 ↓

Analogs

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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) 0.12 5.59 -24.67 1 8 0 94 396.465 10 ↓

Analogs

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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) 0.12 5.6 -22 1 8 0 94 396.465 10 ↓

Analogs

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Popular Name: N-[[4-(difluoromethoxy)phenyl]methyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[[4-(difluoromethoxy)phenyl]me…

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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) 1.98 4.59 -17.59 1 5 0 59 330.356 7 ↓

Analogs

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Popular Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1S)-2-hydroxy-1-phenyl-ethyl…

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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) 0.92 2.67 -15.59 2 5 0 70 294.376 6 ↓

Analogs

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Popular Name: N-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1R)-2-hydroxy-1-phenyl-ethyl…

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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) 0.92 2.67 -15.29 2 5 0 70 294.376 6 ↓

Analogs

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Popular Name: N-[(1S)-1-(5-fluoro-2-methoxy-phenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1S)-1-(5-fluoro-2-methoxy-ph…

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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) 2.08 5.31 -16.62 1 5 0 59 326.393 6 ↓

Analogs

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Popular Name: N-[(1R)-1-(5-fluoro-2-methoxy-phenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(1R)-1-(5-fluoro-2-methoxy-ph…

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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) 2.08 5.28 -17.06 1 5 0 59 326.393 6 ↓

Analogs

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Popular Name: N-[(3-hydroxyphenyl)methyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(3-hydroxyphenyl)methyl]-3-(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) 0.87 2.15 -17.11 2 5 0 70 280.349 5 ↓

Analogs

21669131
21669131
21669134
21669134
21669136
21669136

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Popular Name: N-(1-methyl-1-phenyl-ethyl)-3-(2-oxothiazolidin-3-yl)propanamide N-(1-methyl-1-phenyl-ethyl)-3-(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) 2.38 6.27 -14.19 1 4 0 49 292.404 5 ↓

Analogs

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Popular Name: N-[(4-bromo-2-chloro-phenyl)methyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(4-bromo-2-chloro-phenyl)meth…

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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) 2.79 6.06 -15.53 1 4 0 49 377.691 5 ↓

Analogs

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Popular Name: 3-[[3-(2-oxothiazolidin-3-yl)propanoylamino]methyl]benzoic 3-[[3-(2-oxothiazolidin-3-yl)pro…

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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) 1.26 5.56 -62.47 1 6 -1 90 307.351 6 ↓

Analogs

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Popular Name: N-benzyl-N-(2-hydroxyethyl)-3-(2-oxothiazolidin-3-yl)propanamide N-benzyl-N-(2-hydroxyethyl)-3-(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) 0.98 5.05 -17.2 1 5 0 61 308.403 7 ↓

Analogs

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Popular Name: N-[(2-hydroxyphenyl)methyl]-N-methyl-3-(2-oxothiazolidin-3-yl)propanamide N-[(2-hydroxyphenyl)methyl]-N-me…

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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) 1.56 5.73 -15.51 1 5 0 61 294.376 5 ↓
Hi High (pH 8-9.5) 1.56 6.73 -57.28 0 5 -1 64 293.368 5 ↓

Parameters Provided:

ring.id = 39473
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 = 39473 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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