UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14253975
14253975
14253978
14253978
14253981
14253981
61716951
61716951
66238376
66238376

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Popular Name: (5R)-5-ethyl-3-[(2R)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-methyl-imidazolidine-2,4-dione (5R)-5-ethyl-3-[(2R)-2-hydroxy-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) 2.19 4.86 -11.5 2 6 0 79 346.427 6 ↓

Analogs

14253978
14253978
14253981
14253981
61716951
61716951
66238376
66238376
66238377
66238377

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Popular Name: (5S)-5-ethyl-3-[(2R)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-methyl-imidazolidine-2,4-dione (5S)-5-ethyl-3-[(2R)-2-hydroxy-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) 2.19 4.89 -11.35 2 6 0 79 346.427 6 ↓

Analogs

14253981
14253981
61716951
61716951
66238376
66238376
66238377
66238377
66238378
66238378

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-5-ethyl-3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-methyl-imidazolidine-2,4-dione (5R)-5-ethyl-3-[(2S)-2-hydroxy-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) 2.19 4.85 -11.02 2 6 0 79 346.427 6 ↓

Analogs

61716951
61716951
66238376
66238376
66238377
66238377
66238378
66238378
14253972
14253972

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Popular Name: (5S)-5-ethyl-3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-methyl-imidazolidine-2,4-dione (5S)-5-ethyl-3-[(2S)-2-hydroxy-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) 2.19 4.92 -11.1 2 6 0 79 346.427 6 ↓

Analogs

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Popular Name: (5R)-3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-isobutyl-imidazolidine-2,4-dione (5R)-3-[(2S)-2-hydroxy-3-[(1R)-t…

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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 5.64 -10.83 2 6 0 79 360.454 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-isobutyl-imidazolidine-2,4-dione (5S)-3-[(2S)-2-hydroxy-3-[(1R)-t…

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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 5.61 -11.05 2 6 0 79 360.454 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-3-[(2R)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5-isobutyl-imidazolidine-2,4-dione (5S)-3-[(2R)-2-hydroxy-3-[(1R)-t…

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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 5.54 -11.01 2 6 0 79 360.454 7 ↓

Analogs

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Popular Name: 3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(2S)-2-hydroxy-3-[(1R)-tetral…

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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) 3.81 7.49 -11.28 2 6 0 79 388.508 9 ↓

Analogs

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Popular Name: 3-[(2S)-2-hydroxy-3-[(1S)-tetralin-1-yl]oxy-propyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(2S)-2-hydroxy-3-[(1S)-tetral…

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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) 3.81 7.5 -11.47 2 6 0 79 388.508 9 ↓

Analogs

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Popular Name: 3-[(2R)-2-hydroxy-3-[(1S)-tetralin-1-yl]oxy-propyl]-5,5-dipropyl-imidazolidine-2,4-dione 3-[(2R)-2-hydroxy-3-[(1S)-tetral…

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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) 3.81 7.44 -11.45 2 6 0 79 388.508 9 ↓

Analogs

14253972
14253972
14253975
14253975
14253978
14253978

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Popular Name: 5,5-diethyl-3-[(2S)-2-hydroxy-3-[(1R)-tetralin-1-yl]oxy-propyl]imidazolidine-2,4-dione 5,5-diethyl-3-[(2S)-2-hydroxy-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) 2.69 5.96 -11.39 2 6 0 79 360.454 7 ↓

Analogs

14253972
14253972
14253975
14253975
14253978
14253978

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-diethyl-3-[(2S)-2-hydroxy-3-[(1S)-tetralin-1-yl]oxy-propyl]imidazolidine-2,4-dione 5,5-diethyl-3-[(2S)-2-hydroxy-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) 2.69 5.96 -11.61 2 6 0 79 360.454 7 ↓

Analogs

14253972
14253972
14253975
14253975
14253978
14253978

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-diethyl-3-[(2R)-2-hydroxy-3-[(1S)-tetralin-1-yl]oxy-propyl]imidazolidine-2,4-dione 5,5-diethyl-3-[(2R)-2-hydroxy-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) 2.69 5.9 -11.55 2 6 0 79 360.454 7 ↓

Parameters Provided:

ring.id = 242031
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 = 242031 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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