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

Analogs

35497200
35497200
35497202
35497202
35497205
35497205

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-2-[(1R)-3-oxo-1H-isobenzofuran-1-yl]-N-[(1,3,5-trimethylpyrazol- N-[[(1R)-cyclohex-3-en-1-yl]meth…

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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) 3.18 12.56 -21.95 0 6 0 64 407.514 6 ↓

Analogs

35497202
35497202
35497205
35497205
35497198
35497198

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(1S)-cyclohex-3-en-1-yl]methyl]-2-[(1R)-3-oxo-1H-isobenzofuran-1-yl]-N-[(1,3,5-trimethylpyrazol- N-[[(1S)-cyclohex-3-en-1-yl]meth…

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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) 3.18 12.86 -22.73 0 6 0 64 407.514 6 ↓

Analogs

35497205
35497205
35497198
35497198
35497200
35497200

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-2-[(1S)-3-oxo-1H-isobenzofuran-1-yl]-N-[(1,3,5-trimethylpyrazol- N-[[(1R)-cyclohex-3-en-1-yl]meth…

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) 3.18 12.85 -22.18 0 6 0 64 407.514 6 ↓

Analogs

35497198
35497198
35497200
35497200
35497202
35497202

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(1S)-cyclohex-3-en-1-yl]methyl]-2-[(1S)-3-oxo-1H-isobenzofuran-1-yl]-N-[(1,3,5-trimethylpyrazol- N-[[(1S)-cyclohex-3-en-1-yl]meth…

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) 3.18 12.86 -21.68 0 6 0 64 407.514 6 ↓

Parameters Provided:

ring.id = 17197
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 = 17197 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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