UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (5Z)-5-[[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methylene]imidazolidine-2,4-dione (5Z)-5-[[2,5-dimethyl-1-(p-tolyl…

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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) 2.27 4.04 -49.79 1 5 -1 74 294.334 2 ↓
Lo Low (pH 4.5-6) 1.82 6.87 -8.84 2 5 0 71 295.342 2 ↓

Analogs

1170612
1170612

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Popular Name: (5Z)-5-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]imidazolidine-2,4-dione (5Z)-5-[[1-(4-iodophenyl)-2,5-di…

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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) 2.45 7.3 -8.5 2 5 0 71 407.211 2 ↓

Analogs

664672
664672

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Popular Name: 3-allyl-5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-imidazolidinedione 3-allyl-5-{[1-(3,4-dichloropheny…

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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) 3.57 11.03 -9.19 1 5 0 60 390.27 4 ↓

Analogs

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Popular Name: 4-[3-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzonitrile 4-[3-[(Z)-(2,5-dioxoimidazolidin…

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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 6.58 -12.26 2 6 0 94 306.325 2 ↓

Analogs

3641380
3641380

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Popular Name: (5E)-5-[[1-(4-diethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-3-ethyl-imidazolidine-2,4-dion (5E)-5-[[1-(4-diethylaminophenyl…

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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) 2.66 11.54 -10.76 1 6 0 63 380.492 6 ↓

Parameters Provided:

ring.id = 228738
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 = 228738 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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