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

ZINC05743606

• 5743606

Physical Representations

Activity (Go SEA)

• 688833
  

  Analogs

  5743606

  

  Popular Name:

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AK-968/37171090

  • Vitas-M

    • STK446804

  • eMolecules

    • 25952592

  • Molport

    • MolPort-001-500-461
    • MolPort-019-742-115

  And 11 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)	3.83	-2.77	-15.59	3	6	0	90	414.527	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00688833
• 941058
  

  Analogs

  5743606

  

  Popular Name: benzo[b]thiophene-3-carboxamide, 2-[[3-(3,4-dimethoxyphenyl)-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro- benzo[b]thiophene-3-carboxamide,…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STL355909

  • eMolecules

    • 642134

  • Aldrich CPR

    • R510386|ALDRICH

  • American Custom Chemicals Corp.

    • NEW0078357

  • ChemDiv

    • 1889-2891

  And 19 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)	2.82	-2.92	-15.55	3	6	0	90	386.473	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00941058
• 944950
  

  Analogs

  1945456

  

  1945458

  

  1946626

  

  1946630

  

  5743606

  

  Popular Name: (6S)-2-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carb (6S)-2-[[(E)-3-(3,4-dimethoxyphe…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 26501534

  • Molport

    • MolPort-002-047-878

  • ChemDiv

    • 5596-0346

  • Innovapharm

    • STT-00216556

  • Mcule

    • MCULE-1944780148

  And 11 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)	3.30	5.88	-15.05	3	6	0	91	400.5	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00944950
• 944952
  

  Analogs

  1945456

  

  1945458

  

  1946626

  

  1946630

  

  5743606

  

  Popular Name: (6R)-2-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carb (6R)-2-[[(E)-3-(3,4-dimethoxyphe…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 26501534

  • Molport

    • MolPort-002-047-878

  • ChemDiv

    • 5596-0346

  • Innovapharm

    • STT-00216556

  • Mcule

    • MCULE-1944780148

  And 11 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)	3.29	-2.56	-15.25	3	6	0	90	400.5	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00944952
• 995607
  

  Analogs

  1945456

  

  1945458

  

  1946626

  

  1946630

  

  5743606

  

  Popular Name:

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AK-968/11988062

  • Vitas-M

    • STK421794

  • eMolecules

    • 25875255

  • Molport

    • MolPort-019-760-923
    • MolPort-001-490-188

  And 12 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)	4.96	-1.48	-14.89	0	3	0	90	456.608	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00995607
• 995609
  

  Analogs

  1945456

  

  1945458

  

  1946626

  

  1946630

  

  5743606

  

  Popular Name:

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AK-968/11988062

  • Vitas-M

    • STK421794

  • eMolecules

    • 25875255

  • Molport

    • MolPort-019-760-923
    • MolPort-001-490-188

  And 12 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)	4.96	-1.48	-14.9	0	3	0	90	456.608	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00995609
• 994661
  

  Analogs

  5708170

  

  5743606

  

  Popular Name:

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AK-968/11841322

  • Vitas-M

    • STK375340

  • eMolecules

    • 2095343

  • Molport

    • MolPort-019-778-126
    • MolPort-001-488-601

  And 11 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)	4.24	-3.1	-13.12	3	5	0	81	384.501	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00994661
• 799685
  

  Analogs

  1959940

  

  4860696

  

  5708170

  

  5743606

  

  Popular Name: benzo[b]thiophene-3-carboxamide, 4,5,6,7-tetrahydro-2-[[3-(4-methoxyphenyl)-1-oxo-2-propenyl]amino]- benzo[b]thiophene-3-carboxamide,…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AG-690/11665230

  • Vitas-M

    • STL355612

  • eMolecules

    • 649412

  • Molport

    • MolPort-000-999-186

  • Aldrich CPR

    • R564583|ALDRICH

  And 19 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)	3.23	5.35	-12.78	3	5	0	81	356.447	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00799685
• 4860696
  

  Analogs

  5708170

  

  5743606

  

  1959940

  

  Popular Name: 2-[3-(4-methoxyphenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide 2-[3-(4-methoxyphenyl)prop-2-eno…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 26280365

  • IBScreen

    • STOCK2S-62064

  • Mcule

    • MCULE-9736444280

  • Pharmeks

    • PHAR129523

  • ChemDB

    • 4147017

  And 3 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)	3.23	-3.34	-13.66	3	5	0	81	356.447	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04860696