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

Analogs

11814954
11814954

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-(2-methoxyethyl)-4-[[[5-(o-tolyl)-1,2,4-triazin-3-yl]amino]methyl]pyrrolidin-2-one (4S)-1-(2-methoxyethyl)-4-[[[5-(…

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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) 1.37 -1.39 -15.95 1 7 0 80 341.415 7 ↓

Analogs

11814952
11814952

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-(2-methoxyethyl)-4-[[[5-(o-tolyl)-1,2,4-triazin-3-yl]amino]methyl]pyrrolidin-2-one (4R)-1-(2-methoxyethyl)-4-[[[5-(…

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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) 1.37 -1.14 -14.28 1 7 0 80 341.415 7 ↓

Analogs

11838367
11838367

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Popular Name: (4R)-4-[[[5-(2,6-dimethoxyphenyl)-1,2,4-triazin-3-yl]-methyl-amino]methyl]-1-ethyl-pyrrolidin-2-one (4R)-4-[[[5-(2,6-dimethoxyphenyl…

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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) 1.63 1.24 -20.14 0 8 0 81 371.441 7 ↓

Analogs

11838366
11838366

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-[[[5-(2,6-dimethoxyphenyl)-1,2,4-triazin-3-yl]-methyl-amino]methyl]-1-ethyl-pyrrolidin-2-one (4S)-4-[[[5-(2,6-dimethoxyphenyl…

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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) 1.63 1.11 -21.97 0 8 0 81 371.441 7 ↓

Parameters Provided:

ring.id = 47770
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 = 47770 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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