UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

2788726
2788726
2788727
2788727
2788728
2788728

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Popular Name: (7aS)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-thioxo-5,6,7,7a-tetrahydropyrrolo[2,1-e]imidazol-1-one (7aS)-2-[[(2R)-tetrahydrofuran-2…

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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 5.55 -12.75 0 4 0 33 240.328 2 ↓

Analogs

2788727
2788727
2788728
2788728
2788725
2788725

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Popular Name: (7aR)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-thioxo-5,6,7,7a-tetrahydropyrrolo[2,1-e]imidazol-1-one (7aR)-2-[[(2R)-tetrahydrofuran-2…

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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 5.47 -13.29 0 4 0 33 240.328 2 ↓

Analogs

2788728
2788728
2788725
2788725
2788726
2788726

Draw Identity 99% 90% 80% 70%

Popular Name: (7aS)-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-3-thioxo-5,6,7,7a-tetrahydropyrrolo[2,1-e]imidazol-1-one (7aS)-2-[[(2S)-tetrahydrofuran-2…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 5.39 -12.29 0 4 0 33 240.328 2 ↓

Analogs

2788725
2788725
2788726
2788726

Draw Identity 99% 90% 80% 70%

Popular Name: (7aR)-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-3-thioxo-5,6,7,7a-tetrahydropyrrolo[2,1-e]imidazol-1-one (7aR)-2-[[(2S)-tetrahydrofuran-2…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 5.47 -12.58 0 4 0 33 240.328 2 ↓

Parameters Provided:

ring.id = 236305
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 = 236305 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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