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Analogs

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Popular Name: 6-ethyl-3-(pyridin-2-yl)[1,2]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione 6-ethyl-3-(pyridin-2-yl)[1,2]thi…

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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) 1.28 2.02 -42.51 0 6 -1 84 273.297 2 ↓
Lo Low (pH 4.5-6) 0.83 4.01 -7.7 1 6 0 81 274.305 2 ↓

Analogs

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Popular Name: 6-(propan-2-yl)-3-(pyridin-2-yl)[1,2]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione 6-(propan-2-yl)-3-(pyridin-2-yl)…

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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) 1.65 2.7 -41.7 0 6 -1 84 287.324 2 ↓
Lo Low (pH 4.5-6) 1.19 4.5 -7.37 1 6 0 81 288.332 2 ↓

Analogs

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Popular Name: 6-methyl-3-(pyridin-2-yl)[1,2]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione 6-methyl-3-(pyridin-2-yl)[1,2]th…

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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) 0.91 1.04 -41.97 0 6 -1 84 259.27 1 ↓
Lo Low (pH 4.5-6) 0.45 3.01 -7.87 1 6 0 81 260.278 1 ↓

Analogs

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Popular Name: 6-propyl-3-(pyridin-2-yl)[1,2]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione 6-propyl-3-(pyridin-2-yl)[1,2]th…

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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) 1.79 2.78 -42.91 0 6 -1 84 287.324 3 ↓
Lo Low (pH 4.5-6) 1.33 4.76 -7.52 1 6 0 81 288.332 3 ↓

Analogs

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Popular Name: 6-(2-methoxyethyl)-3-(2-pyridyl)-4H-isothiazolo[4,5-d]pyrimidine-5,7-dione 6-(2-methoxyethyl)-3-(2-pyridyl)…

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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) 0.89 1.51 -44.7 0 7 -1 93 303.323 4 ↓
Lo Low (pH 4.5-6) 0.43 3.56 -9.28 1 7 0 90 304.331 4 ↓

Parameters Provided:

ring.id = 503063
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 = 503063 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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