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

Analogs

11839296
11839296
14972395
14972395
14972399
14972399
19219869
19219869
19219875
19219875

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Popular Name: N-(2-diethylaminoethyl)-N-ethyl-5-methyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyri N-(2-diethylaminoethyl)-N-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) 2.86 -1.4 -40.94 2 7 1 72 420.603 10 ↓

Analogs

14972395
14972395
14972399
14972399
19219869
19219869
19219875
19219875
64002291
64002291

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-diethylaminoethyl)-N-ethyl-5-methyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyri N-(2-diethylaminoethyl)-N-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) 2.86 -1.65 -42.47 2 7 1 72 420.603 10 ↓

Analogs

11996327
11996327
12030997
12030997
12031001
12031001

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Popular Name: N-isopropyl-5-methyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxamide N-isopropyl-5-methyl-4-[[(2S)-te…

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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) 2.13 -4.33 -8.78 2 6 0 76 334.445 5 ↓

Analogs

12030997
12030997
12031001
12031001
11996326
11996326

Draw Identity 99% 90% 80% 70%

Popular Name: N-isopropyl-5-methyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxamide N-isopropyl-5-methyl-4-[[(2R)-te…

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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) 2.13 -4.28 -8.81 2 6 0 76 334.445 5 ↓

Analogs

12029396
12029396
12078264
12078264
12078265
12078265
12121584
12121584
12121589
12121589

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Popular Name: N-ethyl-5-methyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxamide N-ethyl-5-methyl-4-[[(2S)-tetrah…

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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) 1.84 -4.83 -8.88 2 6 0 76 320.418 5 ↓

Analogs

12078264
12078264
12078265
12078265
12121584
12121584
12121589
12121589
12029393
12029393

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-5-methyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxamide N-ethyl-5-methyl-4-[[(2R)-tetrah…

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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) 1.84 -4.78 -8.85 2 6 0 76 320.418 5 ↓

Analogs

12031001
12031001
11996326
11996326
11996327
11996327
11869025
11869025

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Popular Name: N-isopropyl-N,5-dimethyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxa N-isopropyl-N,5-dimethyl-4-[[(2S…

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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) 2.38 -2.53 -9.92 1 6 0 67 348.472 5 ↓

Analogs

11996326
11996326
11996327
11996327
12030997
12030997

Draw Identity 99% 90% 80% 70%

Popular Name: N-isopropyl-N,5-dimethyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carboxa N-isopropyl-N,5-dimethyl-4-[[(2R…

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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) 2.38 -2.4 -9.8 1 6 0 67 348.472 5 ↓

Analogs

12213410
12213410

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Popular Name: 5-methyl-N-(3-methylsulfanylpropyl)-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidin 5-methyl-N-(3-methylsulfanylprop…

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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 -5.13 -9.46 2 6 0 76 380.539 8 ↓

Analogs

12213408
12213408

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Popular Name: 5-methyl-N-(3-methylsulfanylpropyl)-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidin 5-methyl-N-(3-methylsulfanylprop…

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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 -5.1 -9.49 2 6 0 76 380.539 8 ↓

Analogs

12217477
12217477
12245488
12245488
12245489
12245489
14889506
14889506
14889508
14889508

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Popular Name: N-(3-ethoxypropyl)-5-methyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carb N-(3-ethoxypropyl)-5-methyl-4-[[…

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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) 2.09 -5.45 -9.44 2 7 0 85 378.498 9 ↓

Analogs

12245488
12245488
12245489
12245489
12217476
12217476

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-ethoxypropyl)-5-methyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carb N-(3-ethoxypropyl)-5-methyl-4-[[…

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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) 2.09 -5.41 -9.39 2 7 0 85 378.498 9 ↓

Analogs

12217501
12217501
12278401
12278401
12278402
12278402

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methoxyethyl)-5-methyl-4-[[(2S)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carb N-(2-methoxyethyl)-5-methyl-4-[[…

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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) 1.45 -5.5 -9.71 2 7 0 85 350.444 7 ↓

Analogs

12278401
12278401
12278402
12278402
12217500
12217500

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methoxyethyl)-5-methyl-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]thieno[4,5-e]pyrimidine-6-carb N-(2-methoxyethyl)-5-methyl-4-[[…

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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) 1.45 -5.46 -9.67 2 7 0 85 350.444 7 ↓

Parameters Provided:

ring.id = 31650
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 = 31650 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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