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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14228779
14228779
14228782
14228782
14228785
14228785

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] [(1R)-1-[(5-methylisoxazol-3-yl)…

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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 5.77 -22.04 2 10 0 140 420.447 8 ↓

Analogs

14228782
14228782
14228785
14228785
14228776
14228776

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] [(1S)-1-[(5-methylisoxazol-3-yl)…

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 5.79 -22.81 2 10 0 140 420.447 8 ↓

Analogs

14228785
14228785
14228779
14228779
14228776
14228776

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] [(1R)-1-[(5-methylisoxazol-3-yl)…

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 5.77 -22.75 2 10 0 140 420.447 8 ↓

Analogs

14228779
14228779
14228782
14228782

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] [(1S)-1-[(5-methylisoxazol-3-yl)…

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 5.76 -24.97 2 10 0 140 420.447 8 ↓
Hi High (pH 8-9.5) 0.73 4.85 -49.49 1 10 -1 142 419.439 8 ↓

Parameters Provided:

ring.id = 233380
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 = 233380 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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