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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: 4-chloro-2-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidine 4-chloro-2-[[(1S,3R)-3-methylcyc…

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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) 4.61 9.31 -6.89 0 2 0 26 312.891 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-2-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidine 4-chloro-2-[[(1S,3S)-3-methylcyc…

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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) 4.61 9.09 -6.93 0 2 0 26 312.891 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-2-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidine 4-chloro-2-[[(1R,3R)-3-methylcyc…

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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) 4.61 9.09 -6.9 0 2 0 26 312.891 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-2-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidine 4-chloro-2-[[(1R,3S)-3-methylcyc…

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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) 4.61 9.31 -6.92 0 2 0 26 312.891 3 ↓

Analogs

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Popular Name: 2-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine 2-[[(1S,3R)-3-methylcyclohexyl]s…

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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) 3.42 7.72 -9.1 2 3 0 52 293.461 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine 2-[[(1S,3S)-3-methylcyclohexyl]s…

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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) 3.42 7.49 -9.1 2 3 0 52 293.461 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine 2-[[(1R,3R)-3-methylcyclohexyl]s…

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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) 3.42 7.49 -9.09 2 3 0 52 293.461 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine 2-[[(1R,3S)-3-methylcyclohexyl]s…

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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) 3.42 7.72 -9.13 2 3 0 52 293.461 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine [2-[[(1S,3R)-3-methylcyclohexyl]…

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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) 3.17 7.6 -9.99 3 4 0 64 308.476 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine [2-[[(1S,3S)-3-methylcyclohexyl]…

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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) 3.17 7.37 -10.01 3 4 0 64 308.476 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine [2-[[(1R,3R)-3-methylcyclohexyl]…

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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) 3.17 7.37 -10.07 3 4 0 64 308.476 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [2-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine [2-[[(1R,3S)-3-methylcyclohexyl]…

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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) 3.17 7.6 -10.05 3 4 0 64 308.476 4 ↓

Parameters Provided:

ring.id = 141096
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 = 141096 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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