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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-1-ethyl-7-methyl-2,2-dioxo-pyrazino[3,2-d][1,2,6]thiadiazin-4-amine 6-bromo-1-ethyl-7-methyl-2,2-dio…

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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) 0.07 -0.15 -14.15 2 7 0 102 320.172 1 ↓

Analogs

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Popular Name: 2,2-dioxo-6,7-bis(trifluoromethyl)-1H-pyrazino[2,3-d][1,2,6]thiadiazin-4-amine 2,2-dioxo-6,7-bis(trifluoromethy…

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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) 0.56 -1.8 -37.88 2 7 -1 112 334.181 2 ↓

Analogs

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Popular Name: 1-ethyl-2,2-dioxo-6,7-bis(trifluoromethyl)pyrazino[2,3-d][1,2,6]thiadiazin-4-amine 1-ethyl-2,2-dioxo-6,7-bis(triflu…

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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) 1.18 0.61 -11.79 2 7 0 102 363.243 3 ↓

Analogs

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Popular Name: 1-ethyl-6,7-diisopropyl-2,2-dioxo-pyrazino[2,3-d][1,2,6]thiadiazin-4-amine 1-ethyl-6,7-diisopropyl-2,2-diox…

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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) 1.47 2.72 -15.73 2 7 0 102 311.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6,7-diisopropyl-2,2-dioxo-1H-pyrazino[5,6-d][1,2,6]thiadiazin-4-amine 6,7-diisopropyl-2,2-dioxo-1H-pyr…

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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) 0.85 0.33 -52.69 2 7 -1 112 282.349 2 ↓
Lo Low (pH 4.5-6) 1.03 0.68 -30.71 3 7 0 114 283.357 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-ethyl-6-methyl-2,2-dioxo-1H-pyrazino[5,6-d][1,2,6]thiadiazin-4-amine 7-ethyl-6-methyl-2,2-dioxo-1H-py…

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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) -0.69 -1.82 -53.26 2 7 -1 112 240.268 1 ↓
Lo Low (pH 4.5-6) -0.51 -1.42 -34.28 3 7 0 114 241.276 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6,7-diethyl-2,2-dioxo-1H-pyrazino[5,6-d][1,2,6]thiadiazin-4-amine 6,7-diethyl-2,2-dioxo-1H-pyrazin…

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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) -0.12 -1.17 -52.53 2 7 -1 112 254.295 2 ↓
Lo Low (pH 4.5-6) 0.06 -0.78 -32.95 3 7 0 114 255.303 2 ↓

Parameters Provided:

ring.id = 11375
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 = 11375 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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