UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3-[3-(2-methoxy-N-methyl-anilino)propyl]imidazolidine-2,4-dione 3-[3-(2-methoxy-N-methyl-anilino…

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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) 1.18 4.44 -12.26 1 6 0 62 277.324 6 ↓
Lo Low (pH 4.5-6) 1.18 4.48 -34.05 2 6 1 63 278.332 6 ↓

Analogs

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Popular Name: 3-[3-(N-ethyl-4-fluoro-anilino)propyl]imidazolidine-2,4-dione 3-[3-(N-ethyl-4-fluoro-anilino)p…

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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 5.57 -11.57 1 5 0 53 279.315 6 ↓
Lo Low (pH 4.5-6) 1.71 5.64 -30.68 2 5 0 54 280.323 6 ↓

Analogs

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Popular Name: 3-[3-(3-fluoro-N-isopropyl-4-methoxy-anilino)propyl]imidazolidine-2,4-dione 3-[3-(3-fluoro-N-isopropyl-4-met…

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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) 2.00 5.11 -14.68 1 6 0 62 323.368 7 ↓
Lo Low (pH 4.5-6) 2.00 5.39 -28.66 2 6 0 63 324.376 7 ↓

Analogs

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Popular Name: 5,5-dimethyl-3-[3-(N-methylanilino)propyl]imidazolidine-2,4-dione 5,5-dimethyl-3-[3-(N-methylanili…

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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 5.94 -9.26 1 5 0 53 275.352 5 ↓

Parameters Provided:

ring.id = 288700
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 = 288700 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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