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

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Popular Name: 2-[(5-butylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine-5-car 2-[(5-butylamino-1,3,4-thiadiazo…

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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) 2.26 5.92 -62.71 2 9 -1 137 394.458 8 ↓
Mid Mid (pH 6-8) 2.72 3.44 -127.66 1 9 -2 140 393.45 8 ↓

Analogs

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Popular Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrim 2-[[5-(2-methoxyethylamino)-1,3,…

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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) 0.80 3.51 -63.73 2 10 -1 146 396.43 8 ↓
Mid Mid (pH 6-8) 1.26 1.05 -128.59 1 10 -2 149 395.422 8 ↓

Analogs

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Popular Name: 6-methyl-4-oxo-2-[(5-propylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3H-furo[5,4-d]pyrimidine-5-ca 6-methyl-4-oxo-2-[(5-propylamino…

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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) 1.70 5.14 -62.79 2 9 -1 137 380.431 7 ↓
Mid Mid (pH 6-8) 2.15 2.67 -127.77 1 9 -2 140 379.423 7 ↓

Analogs

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Popular Name: 6-methyl-4-oxo-2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3H-furo[5,4-d]pyrimidine-5 6-methyl-4-oxo-2-[(5-propylsulfa…

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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) 2.44 6.16 -61.26 1 8 -1 125 397.483 7 ↓
Mid Mid (pH 6-8) 2.90 3.69 -125.21 0 8 -2 128 396.475 7 ↓

Analogs

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Popular Name: 2-[(5-ethylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine-5-car 2-[(5-ethylamino-1,3,4-thiadiazo…

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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) 1.20 4.37 -63.06 2 9 -1 137 366.404 6 ↓
Mid Mid (pH 6-8) 1.65 1.91 -128.1 1 9 -2 140 365.396 6 ↓

Analogs

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Popular Name: 2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine- 2-[[5-(isobutylamino)-1,3,4-thia…

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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) 1.94 5.92 -62.55 2 9 -1 137 394.458 7 ↓
Mid Mid (pH 6-8) 2.40 3.46 -127.42 1 9 -2 140 393.45 7 ↓

Analogs

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Popular Name: 6-methyl-4-oxo-2-[[5-(sec-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-3H-furo[5,4-d]pyrimidine 6-methyl-4-oxo-2-[[5-(sec-butyla…

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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) 2.03 6.02 -62.95 2 9 -1 137 394.458 7 ↓
Mid Mid (pH 6-8) 2.49 3.56 -128.41 1 9 -2 140 393.45 7 ↓

Analogs

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Popular Name: 6-methyl-4-oxo-2-[[5-(sec-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-3H-furo[5,4-d]pyrimidine 6-methyl-4-oxo-2-[[5-(sec-butyla…

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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) 2.03 6.03 -62.92 2 9 -1 137 394.458 7 ↓
Mid Mid (pH 6-8) 2.49 3.56 -128.48 1 9 -2 140 393.45 7 ↓

Analogs

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Popular Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidin 2-[[5-(tert-butylamino)-1,3,4-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) 2.00 5.74 -62.91 2 9 -1 137 394.458 6 ↓
Mid Mid (pH 6-8) 2.93 1.42 -30.93 3 9 0 137 395.466 5 ↓
Mid Mid (pH 6-8) 2.46 3.27 -128.59 1 9 -2 140 393.45 6 ↓

Analogs

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Popular Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine-5-c 2-[[5-(allylamino)-1,3,4-thiadia…

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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) 1.46 4.98 -62.7 2 9 -1 137 378.415 7 ↓
Mid Mid (pH 6-8) 1.92 2.52 -127.59 1 9 -2 140 377.407 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-6-methyl-4-oxo-3H-furo[5,4-d]pyrimidine-5-carboxyl 2-[(5-amino-1,3,4-thiadiazol-2-y…

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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) 0.45 2.65 -63.69 3 9 -1 151 338.35 4 ↓
Mid Mid (pH 6-8) 0.90 0.18 -128.31 2 9 -2 154 337.342 4 ↓

Parameters Provided:

ring.id = 117941
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 = 117941 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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