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

ZINC04245494

• 4245494

Physical Representations

Activity (Go SEA)

• 4478369
  

  Analogs

  31893447

  

  31893451

  

  31893457

  

  31893461

  

  31893464

  

  Popular Name: 1-Propyl-1,2,3,4-tetrahydro-6-quinolinecarbaldehyde 1-Propyl-1,2,3,4-tetrahydro-6-qu…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Molport

    • MolPort-000-874-584

  • AK Scientific

    • 1325AF

  • Asinex

    • BAS08768132

  • Asinex Building Blocks

    • BAS08768132

  • ChemBridge BuildingBlocks

    • 4300154

  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)	3.19	-0.17	-6.94	0	2	0	20	203.285	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04478369
• 4532632
  

  Analogs

  31893447

  

  31893457

  

  31893461

  

  31893464

  

  31893467

  

  Popular Name: 2,3,6,7-Tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 2,3,6,7-Tetrahydro-1H,5H-pyrido[…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Molport

    • MolPort-009-015-651

  • AK Scientific

    • 0859AE

  • APIChem

    • AC-24426

  • Ark Pharm Building Blocks

    • AK130296

  • Chembo Pharma

    • KB-216250

  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)	2.80	-0.81	-7.59	0	2	0	20	201.269	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04532632
• 12647627
  

  Analogs

  34550334

  

  4245494

  

  4245495

  

  Popular Name: 1,1,7,7-Tetramethyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 1,1,7,7-Tetramethyl-2,3,6,7-tetr…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Molport

    • MolPort-002-499-965

  • ACT Chemical BB

    • ACT04871

  • AK Scientific

    • W4500

  • Aldrich CPR

    • CDS009392|ALDRICH

  • Anward

    • ANW-47912

  And 20 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)	4.25	7.78	-6.88	0	2	0	20	257.377	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12647627
• 13779225
  

  Analogs

  31893453

  

  4245494

  

  4245495

  

  Popular Name: 1-(8-tert-butyl-1,4,4-trimethyl-2,3-dihydroquinolin-6-yl)pentan-1-one 1-(8-tert-butyl-1,4,4-trimethyl-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • BindingDB.org

    • 50063796

  • ChEMBL12

    • CHEMBL15039

  • ChEMBL12 10uM

    • CHEMBL15039

  • ChEMBL19

    • CHEMBL15039

  • PubChem

    • 10710474

  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)	6.35	11.04	-6.94	0	2	0	20	315.501	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC13779225
• 14988361
  

  Analogs

  31893447

  

  31893457

  

  31893461

  

  31893464

  

  31893467

  

  Popular Name: 1-(2-Hydroxyethyl)-1,2,3,4-tetrahydro-6-quinolinecarbaldehyde 1-(2-Hydroxyethyl)-1,2,3,4-tetra…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK695275

  • eMolecules

    • 25618124

  • Molport

    • MolPort-005-306-794

  • BioBlocks

    • A4488/0191940

  • BioBlocks BB

    • ZERO/009866

  And 10 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)	1.68	2.12	-9.4	1	3	0	41	205.257	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14988361
• 47843890
  

  Analogs

  31997190

  

  31893447

  

  31893451

  

  31893457

  

  32114063

  

  Popular Name: 1-methyl-1,2,3,4-tetrahydroquinoline-6,8-dicarbaldehyde 1-methyl-1,2,3,4-tetrahydroquino…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Molport

    • MolPort-016-635-058

  • Enamine Building Blocks

    • EN300-61196

  • Molport BB

    • MolPort-016-635-058

  • Princeton BioMolecular Research

    • OSSL_845302

  • Ryan Scientific BB

    • 000-41798

  And 1 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)	2.03	5.34	-14.25	0	3	0	37	203.241	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC47843890
• 493835
  

  Analogs

  4245484

  

  4245492

  

  4245494

  

  4245495

  

  4245501

  

  Popular Name: 1-Ethyl-1,2,3,4-tetrahydro-quinoline-6-carbaldehyde 1-Ethyl-1,2,3,4-tetrahydro-quino…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK397321

  • Vitas-M BB

    • BBL029406

  • eMolecules

    • 1381857

  • AK Scientific

    • 9256AE

  • Aldrich CPR

    • CDS007401|ALDRICH

  And 21 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)	2.69	-0.29	-7.2	0	2	0	20	189.258	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00493835
• 3882898
  

  Analogs

  4245484

  

  4245494

  

  4245495

  

  4245501

  

  4245506

  

  Popular Name: 1-methyl-1,2,3,4-tetrahydroquinoline-6-carbaldehyde 1-methyl-1,2,3,4-tetrahydroquino…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK346813

  • Vitas-M BB

    • BBL010349

  • eMolecules

    • 981009

  • AK Scientific

    • 4248AE

  • Aldrich CPR

    • CBR00342|ALDRICH

  And 48 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)	2.32	5.86	-7.67	0	2	0	20	175.231	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC03882898
• 1390496
  

  Analogs

  4245484

  

  4245494

  

  4245495

  

  4245501

  

  4245506

  

  Popular Name: 1-isobutyl-1,2,3,4-tetrahydro-6-quinolinecarbaldehyde 1-isobutyl-1,2,3,4-tetrahydro-6-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Molport

    • MolPort-000-874-587

  • KeyOrganics

    • 4W-0257

  • Innovapharm BB Make on Demand

    • BBV-00007226

  • ChemDB

    • 4709202

  • PubChem

    • 1477989

  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)	3.44	0	-6.83	0	2	0	20	217.312	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC01390496