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

Analogs

20900339
20900339

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Popular Name: (1S)-1-ethyl-6-methyl-N-tetralin-5-yl-3,4-dihydro-1H-pyrrolo[2,1-c]pyrazine-2-carboxamide (1S)-1-ethyl-6-methyl-N-tetralin…

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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) 4.62 11.75 -12.97 1 4 0 37 337.467 2 ↓

Analogs

20900337
20900337

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Popular Name: (1R)-1-ethyl-6-methyl-N-tetralin-5-yl-3,4-dihydro-1H-pyrrolo[2,1-c]pyrazine-2-carboxamide (1R)-1-ethyl-6-methyl-N-tetralin…

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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) 4.62 11.81 -13.07 1 4 0 37 337.467 2 ↓

Analogs

20900383
20900383

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Popular Name: (1S)-6-methyl-1-propyl-N-tetralin-5-yl-3,4-dihydro-1H-pyrrolo[2,1-c]pyrazine-2-carboxamide (1S)-6-methyl-1-propyl-N-tetrali…

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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) 5.17 12.55 -13.11 1 4 0 37 351.494 3 ↓

Analogs

20900381
20900381

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-6-methyl-1-propyl-N-tetralin-5-yl-3,4-dihydro-1H-pyrrolo[2,1-c]pyrazine-2-carboxamide (1R)-6-methyl-1-propyl-N-tetrali…

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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) 5.17 12.55 -13.05 1 4 0 37 351.494 3 ↓

Parameters Provided:

ring.id = 82333
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 = 82333 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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