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

Analogs

31822173
31822173
31822185
31822185
31822187
31822187
31822243
31822243
31822260
31822260

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Popular Name: N-(4-acetylphenyl)-2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide N-(4-acetylphenyl)-2-(4-amino-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) 3.68 7.25 -18.37 3 6 0 98 386.502 5 ↓

Analogs

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Popular Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,5-dimethoxyphenyl)acetamide 2-(4-amino-5,6-dimethyl-thieno[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) 3.82 5.6 -17.74 3 7 0 99 404.517 6 ↓
Lo Low (pH 4.5-6) 3.82 5.93 -30.32 4 7 1 101 405.525 6 ↓
Lo Low (pH 4.5-6) 3.82 2.6 -36.81 4 7 1 101 405.525 6 ↓

Analogs

31822185
31822185

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Popular Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3,4-difluorophenyl)acetamide 2-(4-amino-5,6-dimethyl-thieno[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) 4.04 7.02 -19.17 3 5 0 81 380.445 4 ↓
Lo Low (pH 4.5-6) 4.04 7.35 -35.14 4 5 1 82 381.453 4 ↓
Lo Low (pH 4.5-6) 4.04 4.09 -42.21 4 5 1 82 381.453 4 ↓

Analogs

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Popular Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-methoxyphenyl)acetamide 2-(4-amino-5,6-dimethyl-thieno[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) 3.81 6.23 -15.84 3 6 0 90 374.491 5 ↓
Lo Low (pH 4.5-6) 3.81 6.57 -30.14 4 6 1 91 375.499 5 ↓
Lo Low (pH 4.5-6) 3.81 3.25 -36.59 4 6 1 91 375.499 5 ↓

Analogs

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Popular Name: 2-(4-amino-5,6-dimethyl-thieno[3,2-e]pyrimidin-2-yl)sulfanyl-N-(2-methoxy-5-methyl-phenyl)acetamide 2-(4-amino-5,6-dimethyl-thieno[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) 4.21 6.98 -15.13 3 6 0 90 388.518 5 ↓
Lo Low (pH 4.5-6) 4.21 3.31 -30.56 4 6 1 91 389.526 5 ↓

Analogs

16755264
16755264
31822173
31822173
31822185
31822185
31822187
31822187
31822236
31822236

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenyl-acetamide 2-(4-amino-5,6-dimethyl-thieno[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) 3.78 6.9 -20.03 3 5 0 81 344.465 4 ↓

Analogs

31822845
31822845

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Popular Name: 4-[[2-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]-N,N-dimethyl-benzamide 4-[[2-(4-amino-5,6-dimethyl-thie…

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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) 2.75 6.75 -23.21 3 7 0 101 415.544 5 ↓
Lo Low (pH 4.5-6) 2.75 7.09 -38.3 4 7 1 102 416.552 5 ↓
Lo Low (pH 4.5-6) 2.75 3.71 -45.55 4 7 1 102 416.552 5 ↓

Analogs

12539267
12539267
31822942
31822942

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Popular Name: (2R)-2-(4-amino-5,6-dimethyl-thieno[3,2-e]pyrimidin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)propanamide (2R)-2-(4-amino-5,6-dimethyl-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) 4.97 9.35 -15.44 3 5 0 81 386.546 4 ↓
Lo Low (pH 4.5-6) 4.97 9.67 -29 4 5 1 82 387.554 4 ↓
Lo Low (pH 4.5-6) 4.97 6.08 -31.35 4 5 1 82 387.554 4 ↓

Analogs

31822938
31822938
31822940
31822940
12539263
12539263

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Popular Name: (2S)-2-(4-amino-5,6-dimethyl-thieno[3,2-e]pyrimidin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)propanamide (2S)-2-(4-amino-5,6-dimethyl-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) 4.97 9.35 -15.49 3 5 0 81 386.546 4 ↓
Lo Low (pH 4.5-6) 4.97 9.66 -28.92 4 5 1 82 387.554 4 ↓
Lo Low (pH 4.5-6) 4.97 6.08 -31.37 4 5 1 82 387.554 4 ↓

Parameters Provided:

ring.id = 36770
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 = 36770 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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