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• Synonyms (0)
• Vendors (1)
• Annotations (0)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (9)

ZINC16896342

• 16896342

Physical Representations

Activity (Go SEA)

• 23561595
  

  Analogs

  23561599

  

  16893428

  

  16893430

  

  16893436

  

  16893438

  

  Popular Name: (2R)-N-(o-tolyl)-2-(5-phenylthieno[3,2-e]pyrimidin-4-yl)sulfanyl-propanamide (2R)-N-(o-tolyl)-2-(5-phenylthie…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 24368436

  • AKOS (make-on-demand)

    • AKOS000892095

  Draw Identity 99% 90% 80% 70%

  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)	5.31	12.23	-12.34	1	4	0	55	405.548	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC23561595
• 23561599
  

  Analogs

  16892728

  

  16892730

  

  16893428

  

  16893430

  

  16893436

  

  Popular Name: (2S)-N-(o-tolyl)-2-(5-phenylthieno[3,2-e]pyrimidin-4-yl)sulfanyl-propanamide (2S)-N-(o-tolyl)-2-(5-phenylthie…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 24368436

  • AKOS (make-on-demand)

    • AKOS000892095

  Draw Identity 99% 90% 80% 70%

  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)	5.31	12.25	-12.15	1	4	0	55	405.548	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC23561599
• 62038633
  

  Analogs

  16893452

  

  16893454

  

  16896342

  

  16896343

  

  16896522

  

  Popular Name: (2S)-N-(5-chloro-2-hydroxy-phenyl)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-propana (2S)-N-(5-chloro-2-hydroxy-pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 2090268

  Draw Identity 99% 90% 80% 70%

  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)	5.52	9.9	-11.35	2	5	0	75	455.992	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC62038633
• 62038634
  

  Analogs

  16893452

  

  16893454

  

  16896342

  

  16896343

  

  16896522

  

  Popular Name: (2R)-N-(5-chloro-2-hydroxy-phenyl)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-propana (2R)-N-(5-chloro-2-hydroxy-pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 2090268

  Draw Identity 99% 90% 80% 70%

  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)	5.52	9.91	-11.35	2	5	0	75	455.992	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC62038634
• 62038653
  

  Analogs

  16893452

  

  16893454

  

  16896342

  

  16896343

  

  16896522

  

  Popular Name: (2S)-N-(5-chloro-2-hydroxy-phenyl)-2-[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-propa (2S)-N-(5-chloro-2-hydroxy-pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 2090278

  Draw Identity 99% 90% 80% 70%

  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)	5.96	10.55	-11.4	2	5	0	75	470.019	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC62038653
• 62038654
  

  Analogs

  16893452

  

  16893454

  

  16896342

  

  16896343

  

  16896522

  

  Popular Name: (2R)-N-(5-chloro-2-hydroxy-phenyl)-2-[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-propa (2R)-N-(5-chloro-2-hydroxy-pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 2090278

  Draw Identity 99% 90% 80% 70%

  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)	5.96	10.56	-11.15	2	5	0	75	470.019	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC62038654
• 62038675
  

  Analogs

  16893452

  

  16893454

  

  16896342

  

  16896343

  

  16896522

  

  Popular Name: (2S)-N-(5-chloro-2-hydroxy-phenyl)-2-[5-(3,4-dimethylphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]su (2S)-N-(5-chloro-2-hydroxy-pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 2090287

  Draw Identity 99% 90% 80% 70%

  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)	6.34	11.05	-11.4	2	5	0	75	484.046	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC62038675
• 9004845
  

  Analogs

  16895450

  

  16895451

  

  16895620

  

  16895621

  

  16895800

  

  Popular Name: 2-[(8-methyl-9-phenyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)sulfanyl]-N-(4-tert-bu 2-[(8-methyl-9-phenyl-7-thia-3,5…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00504711

  • Otava (Virtual)

    • 1249527

  • PubChem

    • 40903499

  • AKOS (make-on-demand)

    • AKOS003080516

  Draw Identity 99% 90% 80% 70%

  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)	6.47	-0.19	-10.61	1	4	0	54	447.629	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC09004845
• 947663
  

  Analogs

  1942417

  

  1942441

  

  16895450

  

  16895451

  

  16895620

  

  Popular Name: BRD-K71179477-001-01-3 BRD-K71179477-001-01-3

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 1999255

  • ChemBridge

    • 7575287

  • Enamine

    • Z56882641

  • Innovapharm

    • STT-00029946

  • Mcule

    • MCULE-5311008380

  And 9 More

  Draw Identity 99% 90% 80% 70%

  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)	4.77	11.18	-11.17	1	4	0	55	391.521	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00947663