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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-amino-5-[[(1R,2S,4S)-2,4-dimethylcyclohexyl]amino]-1-ethyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2S,4S)-2,4-dimet…

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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) 1.98 4.6 -10.46 4 6 0 93 280.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2S,4S)-2,4-dimethylcyclohexyl]amino]-1-ethyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2S,4S)-2,4-dimet…

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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) 1.98 4.3 -10.58 4 6 0 93 280.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1R,2S,4R)-2,4-dimethylcyclohexyl]amino]-1-ethyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2S,4R)-2,4-dimet…

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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) 1.98 3.98 -10.61 4 6 0 93 280.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2S,4R)-2,4-dimethylcyclohexyl]amino]-1-ethyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2S,4R)-2,4-dimet…

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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) 1.98 4.07 -10.73 4 6 0 93 280.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1R,2S,4S)-2,4-dimethylcyclohexyl]amino]-1-propyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2S,4S)-2,4-dimet…

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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) 2.48 5.34 -10.17 4 6 0 93 294.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2S,4S)-2,4-dimethylcyclohexyl]amino]-1-propyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2S,4S)-2,4-dimet…

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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) 2.48 5.05 -10.31 4 6 0 93 294.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1R,2S,4R)-2,4-dimethylcyclohexyl]amino]-1-propyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2S,4R)-2,4-dimet…

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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) 2.48 4.73 -10.29 4 6 0 93 294.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2S,4R)-2,4-dimethylcyclohexyl]amino]-1-propyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2S,4R)-2,4-dimet…

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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) 2.48 4.82 -10.45 4 6 0 93 294.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2R,4R)-2,4-dimethylcyclohexyl]amino]-1-methyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2R,4R)-2,4-dimet…

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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) 1.60 3.66 -10.55 4 6 0 93 266.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1S,2R,4S)-2,4-dimethylcyclohexyl]amino]-1-methyl-pyrimidine-2,4-dione 6-amino-5-[[(1S,2R,4S)-2,4-dimet…

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Activity (Go SEA)

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) 1.60 3.06 -10.78 4 6 0 93 266.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1R,2R,4R)-2,4-dimethylcyclohexyl]amino]-1-methyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2R,4R)-2,4-dimet…

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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) 1.60 3.37 -10.77 4 6 0 93 266.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-5-[[(1R,2R,4S)-2,4-dimethylcyclohexyl]amino]-1-methyl-pyrimidine-2,4-dione 6-amino-5-[[(1R,2R,4S)-2,4-dimet…

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Activity (Go SEA)

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) 1.60 3.14 -10.84 4 6 0 93 266.345 2 ↓

Parameters Provided:

ring.id = 524687
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 = 524687 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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