UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

2805403
2805403
2805404
2805404
2805405
2805405
2805406
2805406
15947424
15947424

Draw Identity 99% 90% 80% 70%

Popular Name: (6R,7R)-7-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-2-furoyl]amino]-8-keto-3-[[(5-methyl-1,3,4-thiadia (6R,7R)-7-[[5-[(4-chloro-3-methy…

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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) 3.36 9.08 -73.86 1 10 -1 138 592.1 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6R,7S)-7-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-2-furoyl]amino]-8-keto-3-[[(5-methyl-1,3,4-thiadia (6R,7S)-7-[[5-[(4-chloro-3-methy…

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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) 3.36 8.9 -72.04 1 10 -1 138 592.1 9 ↓

Analogs

2805403
2805403
2805404
2805404
2805405
2805405
2805406
2805406
15947424
15947424

Draw Identity 99% 90% 80% 70%

Popular Name: (6S,7R)-7-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-2-furoyl]amino]-8-keto-3-[[(5-methyl-1,3,4-thiadia (6S,7R)-7-[[5-[(4-chloro-3-methy…

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) 3.36 8.89 -72.72 1 10 -1 138 592.1 9 ↓

Analogs

2805403
2805403
2805404
2805404
2805405
2805405
2805406
2805406
15947424
15947424

Draw Identity 99% 90% 80% 70%

Popular Name: (6S,7S)-7-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-2-furoyl]amino]-8-keto-3-[[(5-methyl-1,3,4-thiadia (6S,7S)-7-[[5-[(4-chloro-3-methy…

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) 3.36 9.6 -66.76 1 10 -1 138 592.1 9 ↓

Parameters Provided:

ring.id = 240715
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 = 240715 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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