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

ZINC32107148

• 32107148

Physical Representations

Activity (Go SEA)

• 32115568
  

  Analogs

  32115570

  

  32117248

  

  32117249

  

  32120421

  

  32123227

  

  Popular Name: (1R)-2-(tert-butylamino)-1-[3-(2-methoxyethoxy)phenyl]ethanol (1R)-2-(tert-butylamino)-1-[3-(2…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39366544

  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)	2.02	3.31	-37.34	3	4	1	55	268.377	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32115568
• 32127807
  

  Analogs

  32127809

  

  32127827

  

  32127829

  

  32127831

  

  32127833

  

  Popular Name: (1S)-1-(4-isobutoxy-3-methoxy-phenyl)-2-(propylamino)ethanol (1S)-1-(4-isobutoxy-3-methoxy-ph…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39381384

  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)	2.21	5.19	-44.19	3	4	1	55	282.404	9	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	2.21	3.69	-7.71	2	4	0	51	281.396	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32127807
• 15745743
  

  Analogs

  32009249

  

  32009250

  

  32104700

  

  32104702

  

  32104711

  

  Popular Name: (1S)-2-methylamino-1-(3-pentoxyphenyl)ethanol (1S)-2-methylamino-1-(3-pentoxyp…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Collaborative Drug Discovery

    • 717526

  • PubChem

    • 15174856
    • 44828191
    • 26779131

  • SureChEMBL

    • SCHEMBL11824232

  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)	2.89	4.66	-40.65	3	3	1	46	238.351	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC15745743
• 15745742
  

  Analogs

  15745743

  

  32009249

  

  32009250

  

  32104700

  

  32104702

  

  Popular Name: (1R)-2-methylamino-1-(3-pentoxyphenyl)ethanol (1R)-2-methylamino-1-(3-pentoxyp…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Collaborative Drug Discovery

    • 717526

  • PubChem

    • 15174856
    • 44828191
    • 26779129

  • SureChEMBL

    • SCHEMBL11824232

  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)	2.89	4.73	-40.47	3	3	1	46	238.351	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC15745742
• 226411
  

  Analogs

  32009222

  

  32009224

  

  32009235

  

  32009237

  

  32009249

  

  Popular Name: 1-(3-Ethoxy-phenyl)-2-methylamino-ethanol 1-(3-Ethoxy-phenyl)-2-methylamin…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK379566

  • eMolecules

    • 1343138

  • Asinex

    • BAS01550335

  • Asinex Building Blocks

    • BAS01550335

  • BOC Sciences BB

    • 143337-62-6

  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)	1.32	2.3	-40.82	3	3	1	46	196.27	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00226411
• 226413
  

  Analogs

  32009222

  

  32009224

  

  32009235

  

  32009237

  

  32009249

  

  Popular Name: 1-(3-Ethoxy-phenyl)-2-methylamino-ethanol 1-(3-Ethoxy-phenyl)-2-methylamin…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK379566

  • eMolecules

    • 1343138

  • Asinex

    • BAS01550335

  • Asinex Building Blocks

    • BAS01550335

  • BOC Sciences BB

    • 143337-62-6

  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)	1.32	2.37	-40.66	3	3	1	46	196.27	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00226413
• 19784877
  

  Analogs

  32104756

  

  32104758

  

  32104759

  

  32104760

  

  32106329

  

  Popular Name: 1-(3-methoxyphenyl)-2-(1-pyrrolidinyl)-1-ethanol 1-(3-methoxyphenyl)-2-(1-pyrroli…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 56686961
    • 28349944

  • ChemDiv BB Make-on-demand

    • BB10-7318

  • Enamine BB Make on Demand

    • BBV-33439186

  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)	1.59	5.14	-39.46	2	3	1	34	222.308	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC19784877
• 12359669
  

  Analogs

  32009222

  

  32009224

  

  32090317

  

  32090321

  

  32104711

  

  Popular Name: 2-Isopropylamino-1-(3-methoxyphenyl)ethanol 2-Isopropylamino-1-(3-methoxyphe…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Alfa-Aesar

    • H50737

  • Labotest

    • LT03382293

  • Mcule

    • MCULE-6130631320

  • PubChem

    • 24208811
    • 42553202

  And 2 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)	1.62	2.86	-38.7	3	3	1	46	210.297	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12359669
• 12359670
  

  Analogs

  32009222

  

  32009224

  

  32090317

  

  32090321

  

  32104711

  

  Popular Name: 2-Isopropylamino-1-(3-methoxyphenyl)ethanol 2-Isopropylamino-1-(3-methoxyphe…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Alfa-Aesar

    • H50737

  • Labotest

    • LT03382293

  • Mcule

    • MCULE-6130631320

  • PubChem

    • 24208811
    • 42553204

  And 2 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)	1.62	2.79	-38.79	3	3	1	46	210.297	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12359670