UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

35425551
35425551
35425602
35425602
35425605
35425605
35425626
35425626
35425629
35425629

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Popular Name: N-(2,4-dimethoxyphenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(2,4-dimethoxyphenyl)-2-(8-mor…

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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) 0.49 5.4 -17.85 1 11 0 112 414.422 6 ↓

Analogs

35425593
35425593
35425596
35425596
35425599
35425599
35425635
35425635
35425638
35425638

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Popular Name: methyl methyl

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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) 0.62 7.34 -20.46 1 11 0 120 412.406 6 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 1.00 8.27 -20.32 1 11 0 120 426.433 7 ↓

Analogs

35425593
35425593
35425596
35425596
35425611
35425611
35425620
35425620
35425623
35425623

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Popular Name: N-(3-chlorophenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(3-chlorophenyl)-2-(8-morpholi…

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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) 1.11 7.2 -16.75 1 9 0 94 388.815 4 ↓

Analogs

35425593
35425593
35425596
35425596
35425599
35425599
35425605
35425605
35425608
35425608

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Popular Name: N-(4-chlorophenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(4-chlorophenyl)-2-(8-morpholi…

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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) 1.13 7.21 -17.69 1 9 0 94 388.815 4 ↓

Analogs

35425593
35425593
35425596
35425596
35425599
35425599
35425617
35425617
35425620
35425620

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Popular Name: N-(2-bromophenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(2-bromophenyl)-2-(8-morpholin…

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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) 1.21 7.43 -15.5 1 9 0 94 433.266 4 ↓

Analogs

35425593
35425593
35425608
35425608
35425678
35425678
35425681
35425681
35425684
35425684

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Popular Name: N-(4-chloro-2-fluoro-phenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(4-chloro-2-fluoro-phenyl)-2-(…

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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) 1.22 7.33 -14.99 1 9 0 94 406.805 4 ↓

Analogs

35425632
35425632
35425641
35425641
35425644
35425644
35425653
35425653

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Popular Name: 2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide 2-(8-morpholino-3-oxo-[1,2,4]tri…

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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) 1.32 7.7 -20.51 1 9 0 94 422.367 5 ↓

Analogs

35425599
35425599
35425608
35425608
35425635
35425635
35425638
35425638
35425641
35425641

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Popular Name: N-(3-fluoro-4-methyl-phenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(3-fluoro-4-methyl-phenyl)-2-(…

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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) 0.99 7.39 -17.19 1 9 0 94 386.387 4 ↓

Analogs

35425596
35425596
35425599
35425599
35425635
35425635
35425638
35425638
35425641
35425641

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Popular Name: N-(3-chloro-4-methyl-phenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(3-chloro-4-methyl-phenyl)-2-(…

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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) 1.51 7.78 -16.85 1 9 0 94 402.842 4 ↓

Analogs

35425559
35425559
35425602
35425602
35425605
35425605
35425626
35425626

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Popular Name: N-(3-chloro-4-methoxy-phenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(3-chloro-4-methoxy-phenyl)-2-…

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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) 1.12 6.53 -18.33 1 10 0 103 418.841 5 ↓

Analogs

35425559
35425559
35425602
35425602
35425626
35425626
35425650
35425650

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Popular Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acetamide N-(5-chloro-2,4-dimethoxy-phenyl…

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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) 1.10 5.96 -19.93 1 11 0 112 448.867 6 ↓

Analogs

35425641
35425641
35425644
35425644
35425690
35425690

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Popular Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(8-morpholino-3-oxo-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)acet N-[2-chloro-5-(trifluoromethyl)p…

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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) 1.95 8.34 -16.92 1 9 0 94 456.812 5 ↓

Parameters Provided:

ring.id = 376433
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 = 376433 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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