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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: cyclopropyl-(2,5-dimethyl-3-furyl)methanone cyclopropyl-(2,5-dimethyl-3-fury…

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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) 1.72 6.22 -6.17 0 2 0 30 164.204 2 ↓

Analogs

43609439
43609439
43609442
43609442
43609444
43609444

Draw Identity 99% 90% 80% 70%

Popular Name: (2,5-dimethyl-3-furyl)-[(1R,2S)-2-methylcyclopropyl]methanone (2,5-dimethyl-3-furyl)-[(1R,2S)-…

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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) 2.33 6.92 -5.6 0 2 0 30 178.231 2 ↓

Analogs

43609442
43609442
43609444
43609444
43609436
43609436

Draw Identity 99% 90% 80% 70%

Popular Name: (2,5-dimethyl-3-furyl)-[(1S,2S)-2-methylcyclopropyl]methanone (2,5-dimethyl-3-furyl)-[(1S,2S)-…

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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) 2.33 6.89 -6.04 0 2 0 30 178.231 2 ↓

Analogs

43609444
43609444
43609436
43609436
43609439
43609439

Draw Identity 99% 90% 80% 70%

Popular Name: (2,5-dimethyl-3-furyl)-[(1R,2R)-2-methylcyclopropyl]methanone (2,5-dimethyl-3-furyl)-[(1R,2R)-…

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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) 2.33 6.89 -6.03 0 2 0 30 178.231 2 ↓

Analogs

43609436
43609436
43609439
43609439
43609442
43609442

Draw Identity 99% 90% 80% 70%

Popular Name: (2,5-dimethyl-3-furyl)-[(1S,2R)-2-methylcyclopropyl]methanone (2,5-dimethyl-3-furyl)-[(1S,2R)-…

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) 2.33 6.93 -5.64 0 2 0 30 178.231 2 ↓

Parameters Provided:

ring.id = 2649
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 = 2649 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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