UCSF
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Analogs

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Popular Name: 1-[(2-chloro-5-nitro-phenyl)methyl]-3-methyl-imidazolidine-2,4,5-trione 1-[(2-chloro-5-nitro-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) 0.73 5.92 -9.03 0 8 0 107 297.654 3 ↓

Analogs

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Popular Name: 1-benzyl-3-[[methyl(propyl)amino]methyl]imidazolidine-2,4,5-trione 1-benzyl-3-[[methyl(propyl)amino…

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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) 1.06 5.71 -6.08 0 6 0 64 289.335 6 ↓
Lo Low (pH 4.5-6) 1.06 8.02 -39.29 1 6 1 66 290.343 6 ↓

Analogs

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Popular Name: 1-allyl-3-[(2-isopropoxy-5-nitro-phenyl)methyl]imidazolidine-2,4,5-trione 1-allyl-3-[(2-isopropoxy-5-nitro…

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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) 1.49 9.22 -9.77 0 9 0 116 347.327 7 ↓

Analogs

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Popular Name: 1-ethyl-3-[(2-isopropoxyphenyl)methyl]imidazolidine-2,4,5-trione 1-ethyl-3-[(2-isopropoxyphenyl)m…

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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) 1.29 7.88 -6.55 0 6 0 70 290.319 5 ↓

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) 0.74 7.41 -7.15 0 7 0 87 320.276 6 ↓

Analogs

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Popular Name: 1-allyl-3-[(5-bromo-2-fluoro-phenyl)methyl]imidazolidine-2,4,5-trione 1-allyl-3-[(5-bromo-2-fluoro-phe…

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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) 1.71 7.06 -6.41 0 5 0 61 341.136 4 ↓

Analogs

6435838
6435838
37844068
37844068

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Popular Name: 1-[(5-bromo-2-fluoro-phenyl)methyl]-3-isopropyl-imidazolidine-2,4,5-trione 1-[(5-bromo-2-fluoro-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) 1.81 7.09 -6.28 0 5 0 61 343.152 3 ↓

Analogs

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Popular Name: 1-[(2-bromophenyl)methyl]-3-butyl-imidazolidine-2,4,5-trione 1-[(2-bromophenyl)methyl]-3-buty…

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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) 2.37 7.86 -6.04 0 5 0 61 339.189 5 ↓

Parameters Provided:

ring.id = 65894
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 = 65894 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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