UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-[2-(2,5-dioxoimidazolidin-1-yl)ethylsulfanyl]benzoic 2-[2-(2,5-dioxoimidazolidin-1-yl…

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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) 0.76 4.75 -58.92 1 6 -1 90 279.297 5 ↓

Analogs

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Popular Name: 3-[2-(4-aminophenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(4-aminophenyl)sulfanylethy…

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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) 1.12 3.58 -9.62 3 5 0 75 279.365 4 ↓

Analogs

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Popular Name: 3-[2-(4-aminophenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(4-aminophenyl)sulfanylethy…

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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) 0.31 2.19 -11.57 3 5 0 75 251.311 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-methyl-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(2-amino-4-methyl-phenyl)su…

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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) 1.90 4.33 -9.45 3 5 0 75 293.392 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-methyl-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(2-amino-4-methyl-phenyl)su…

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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) 1.09 2.94 -11.41 3 5 0 75 265.338 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-methyl-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(4-amino-2-methyl-phenyl)su…

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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) 1.50 4.15 -9.79 3 5 0 75 293.392 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-methyl-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(4-amino-2-methyl-phenyl)su…

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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) 0.69 2.77 -11.72 3 5 0 75 265.338 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-fluoro-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(4-amino-2-fluoro-phenyl)su…

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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) 1.21 3.63 -11.12 3 5 0 75 297.355 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-fluoro-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(4-amino-2-fluoro-phenyl)su…

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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) 0.40 2.24 -13.13 3 5 0 75 269.301 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-fluoro-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(2-amino-4-fluoro-phenyl)su…

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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) 1.62 3.73 -9.03 3 5 0 75 297.355 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-fluoro-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(2-amino-4-fluoro-phenyl)su…

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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) 0.81 2.34 -11.04 3 5 0 75 269.301 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-6-chloro-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(2-amino-6-chloro-phenyl)su…

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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) 2.11 4.23 -10.37 3 5 0 75 313.81 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-6-chloro-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(2-amino-6-chloro-phenyl)su…

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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) 1.30 2.84 -12.23 3 5 0 75 285.756 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-chloro-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(4-amino-2-chloro-phenyl)su…

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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) 1.73 4.04 -10.23 3 5 0 75 313.81 4 ↓

Analogs

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Popular Name: 3-[2-(4-amino-2-chloro-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(4-amino-2-chloro-phenyl)su…

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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 2.65 -12.26 3 5 0 75 285.756 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-bromo-phenyl)sulfanylethyl]-5,5-dimethyl-imidazolidine-2,4-dione 3-[2-(2-amino-4-bromo-phenyl)sul…

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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) 2.26 4.28 -8.58 3 5 0 75 358.261 4 ↓

Analogs

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Popular Name: 3-[2-(2-amino-4-bromo-phenyl)sulfanylethyl]imidazolidine-2,4-dione 3-[2-(2-amino-4-bromo-phenyl)sul…

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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) 1.45 2.9 -10.59 3 5 0 75 330.207 4 ↓

Parameters Provided:

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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 = 125570 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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