User Information

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

ZINC32123384

• 32123384

Physical Representations

Activity (Go SEA)

• 32201570
  

  Analogs

  32201575

  

  32201598

  

  32201602

  

  32203011

  

  32203015

  

  Popular Name: (1R)-2-(4-phenoxyanilino)-1-phenyl-ethanol (1R)-2-(4-phenoxyanilino)-1-phen…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39435890

  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)	4.36	7.7	-9.57	2	3	0	41	305.377	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32201570
• 32202980
  

  Analogs

  32202985

  

  32203003

  

  32203007

  

  32203011

  

  32203015

  

  Popular Name: (1R)-2-(3-chloro-4-methoxy-anilino)-1-(4-ethylphenyl)ethanol (1R)-2-(3-chloro-4-methoxy-anili…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39437492

  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)	4.18	6.16	-8.58	2	3	0	41	305.805	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32202980
• 32208609
  

  Analogs

  32208613

  

  32123384

  

  32123386

  

  Popular Name: (1S)-1-(3-chlorophenyl)-2-(3,4-dimethoxyanilino)ethanol (1S)-1-(3-chlorophenyl)-2-(3,4-d…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39443187

  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)	2.91	4.32	-10.64	2	4	0	51	307.777	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32208609
• 32208631
  

  Analogs

  32208635

  

  37859436

  

  37859437

  

  32111616

  

  32123372

  

  Popular Name: (1S)-1-(4-chlorophenyl)-2-(3,4-dimethoxyanilino)ethanol (1S)-1-(4-chlorophenyl)-2-(3,4-d…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60724966
    • 39443203

  • Enamine BB Make on Demand

    • BBV-32185780

  • UORSY BB Make-on-demand

    • BBV-32185780

  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)	2.93	4.33	-10.22	2	4	0	51	307.777	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32208631
• 37876815
  

  Analogs

  32123380

  

  32123382

  

  Popular Name: (1R)-1-(2-chlorophenyl)-2-(3,5-dimethoxyanilino)ethanol (1R)-1-(2-chlorophenyl)-2-(3,5-d…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60897513

  • Enamine BB Make on Demand

    • BBV-32194377

  • UORSY BB Make-on-demand

    • BBV-32194377

  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)	3.28	3.83	-7.59	2	4	0	51	307.777	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37876815
• 32112305
  

  Analogs

  32112306

  

  32112307

  

  32112308

  

  32114269

  

  32114270

  

  Popular Name: (1S)-1-(2-chlorophenyl)-2-(N-methylanilino)ethanol (1S)-1-(2-chlorophenyl)-2-(N-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39362003

  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)	3.48	6.98	-5.27	1	2	0	23	261.752	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32112305
• 32112306
  

  Analogs

  32112307

  

  32112308

  

  32114269

  

  32114270

  

  32114271

  

  Popular Name: (1R)-1-(2-chlorophenyl)-2-(N-methylanilino)ethanol (1R)-1-(2-chlorophenyl)-2-(N-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39362004

  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)	3.48	7	-5.19	1	2	0	23	261.752	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32112306