UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-phenyl-imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.56 9.37 -19.36 0 5 0 44 301.39 3 ↓

Analogs

34625879
34625879

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(p-tolyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 3.01 10.05 -19.42 0 5 0 44 315.417 3 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(4-fluorophenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.72 9.44 -18.71 0 5 0 44 319.38 3 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(2-fluorophenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.68 9.72 -19.98 0 5 0 44 319.38 3 ↓

Analogs

4924945
4924945
4794025
4794025

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(3-chlorophenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 3.22 9.89 -17.04 0 5 0 44 335.835 3 ↓

Analogs

4918283
4918283
5096303
5096303
4423402
4423402

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(4-chlorophenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 3.24 9.89 -18.22 0 5 0 44 335.835 3 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(3,4-difluorophenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.82 9.5 -17.16 0 5 0 44 337.37 3 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(4-methoxyphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.62 8.67 -19.62 0 6 0 53 331.416 4 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(2-methoxyphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.57 9.02 -20.86 0 6 0 53 331.416 4 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(4-ethoxyphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.99 9.59 -19.45 0 6 0 53 345.443 5 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(3,4-dimethoxyphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.21 8.57 -21.4 0 7 0 62 361.442 5 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(2,5-dimethoxyphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 2.60 8.31 -23.01 0 7 0 62 361.442 5 ↓

Analogs

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Popular Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(4-isopropylphenyl)imidazolidin-2-one 1-[2-(azepan-1-yl)-2-oxo-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) 4.07 11.29 -18.95 0 5 0 44 343.471 4 ↓

Parameters Provided:

ring.id = 558289
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 = 558289 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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