User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (7)

ZINC41710892

• 41710892

Physical Representations

Activity (Go SEA)

• 48908604
  

  Analogs

  41703267

  

  41703960

  

  Popular Name: 1-(2-chlorophenyl)-3-(3-isopropylphenyl)urea 1-(2-chlorophenyl)-3-(3-isopropy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 47103589

  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)	5.26	8.26	-6.97	2	3	0	41	288.778	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC48908604
• 48908674
  

  Analogs

  41654464

  

  41710892

  

  Popular Name: 1-(2-chlorophenyl)-3-(3,5-dimethylphenyl)urea 1-(2-chlorophenyl)-3-(3,5-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 9005363

  • UORSY Make-on-demand

    • PB44681127

  • ChEMBL12

    • CHEMBL1688077

  • ChEMBL19

    • CHEMBL1688077

  • PubChem

    • 47103673

  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)	4.60	7.69	-7.59	2	3	0	41	274.751	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC48908674
• 6726790
  

  Analogs

  36750245

  

  39972893

  

  41703267

  

  41703613

  

  41703960

  

  Popular Name:

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK477126

  • eMolecules

    • 2325522

  • Molport

    • MolPort-002-129-176

  • Alinda

    • IVK/0017113

  • ChemBridge

    • 9048679

  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)	4.66	-0.69	-7.01	2	3	0	41	274.751	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06726790
• 396437
  

  Analogs

  36744149

  

  38003746

  

  41654464

  

  41710892

  

  Popular Name: 1-(2-chlorophenyl)-3-(m-tolyl)urea 1-(2-chlorophenyl)-3-(m-tolyl)urea

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Aldrich CPR

    • S631752|ALDRICH

  • TimTec

    • ST50549852

  • Otava (Virtual)

    • 9005242

  • UORSY Make-on-demand

    • PB44663991

  • ChemDB

    • 6665582

  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)	4.20	-0.85	-7.42	2	3	0	41	260.724	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00396437
• 22212388
  

  Analogs

  37010170

  

  37010218

  

  41708380

  

  41708383

  

  41708865

  

  Popular Name: 1-[3-[(1S)-1-aminoethyl]phenyl]-3-phenyl-urea 1-[3-[(1S)-1-aminoethyl]phenyl]-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 44175615
    • 16788345

  • Enamine BB Make on Demand

    • BBV-32712623

  • UORSY BB Make-on-demand

    • BBV-32712623

  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)	0.98	4.39	-51	5	4	1	69	256.329	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC22212388
• 399295
  

  Analogs

  38003746

  

  41710892

  

  Popular Name: 1-(2-chloro-5-methyl-phenyl)-3-(2-chlorophenyl)urea 1-(2-chloro-5-methyl-phenyl)-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Aldrich CPR

    • S773735|ALDRICH

  • NCI Plated 2007

    • 204206

  • TimTec

    • ST50553860

  • ChemDB

    • 6671126

  • PubChem

    • 306523

  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)	4.83	-0.81	-6.11	2	3	0	41	295.169	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00399295
• 1740943
  

  Analogs

  38003746

  

  41710892

  

  Popular Name: 1-(2-chloro-5-methyl-phenyl)-3-methyl-urea 1-(2-chloro-5-methyl-phenyl)-3-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • NCI Plated 2007

    • 205385

  • ChemDB

    • 5189932

  • PubChem

    • 57951421
    • 307281

  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)	2.50	-1.89	-7.63	2	3	0	41	198.653	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC01740943