User Information

• Synonyms (6)
• Vendors (23)
• Annotations (2)
• Representations (1)
• Notes (4)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (16)

ZINC08731364

• 8731364

Physical Representations

Vendor Notes

Activity (Go SEA)

• 32108583
  

  Analogs

  13938443

  

  Popular Name: N-cyclopropyl-4-(3-hydroxypropyl)benzenesulfonamide N-cyclopropyl-4-(3-hydroxypropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 1399889

  • PubChem

    • 39357438

  • Enamine BB Make on Demand

    • BBV-40707482

  • UORSY BB Make-on-demand

    • BBV-40707482

  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)	1.44	1.23	-13.36	2	4	0	66	255.339	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32108583
• 32118225
  

  Analogs

  32120095

  

  13938443

  

  Popular Name: 4-(3-aminooxypropyl)-N-cyclopropyl-benzenesulfonamide 4-(3-aminooxypropyl)-N-cycloprop…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39369600

  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)	1.44	1.99	-12.66	3	5	0	81	270.354	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32118225
• 32128856
  

  Analogs

  32230134

  

  8731364

  

  Popular Name: (2S)-3-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-propanoic (2S)-3-[3-(cyclopropylsulfamoyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39382880

  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)	1.52	4.09	-52.22	1	5	-1	86	282.341	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32128856
• 32128857
  

  Analogs

  32230134

  

  8731364

  

  Popular Name: (2R)-3-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-propanoic (2R)-3-[3-(cyclopropylsulfamoyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39382882

  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)	1.52	4.07	-52.78	1	5	-1	86	282.341	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32128857
• 32128864
  

  Analogs

  8731364

  

  Popular Name: (3S)-3-[3-(cyclopropylsulfamoyl)phenyl]butanoic (3S)-3-[3-(cyclopropylsulfamoyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39382896

  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)	0.04	3.99	-53.24	1	5	-1	86	282.341	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32128864
• 32130992
  

  Analogs

  32230134

  

  8731364

  

  Popular Name: 3-[3-[[(1R)-1-methylpropyl]sulfamoyl]phenyl]propanoic 3-[3-[[(1R)-1-methylpropyl]sulfa…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39385620

  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)	2.13	4.2	-52.43	1	5	-1	86	284.357	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32130992
• 32130994
  

  Analogs

  32230134

  

  8731364

  

  Popular Name: 3-[3-[[(1S)-1-methylpropyl]sulfamoyl]phenyl]propanoic 3-[3-[[(1S)-1-methylpropyl]sulfa…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39385622

  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)	2.13	4.28	-52.94	1	5	-1	86	284.357	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32130994
• 32133754
  

  Analogs

  32120095

  

  13938443

  

  Popular Name: 4-(3-aminooxypropyl)-N-[(1R)-1-methylpropyl]benzenesulfonamide 4-(3-aminooxypropyl)-N-[(1R)-1-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39387789

  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)	2.28	2.58	-12.16	3	5	0	81	286.397	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32133754
• 32133757
  

  Analogs

  32120095

  

  13938443

  

  Popular Name: 4-(3-aminooxypropyl)-N-[(1S)-1-methylpropyl]benzenesulfonamide 4-(3-aminooxypropyl)-N-[(1S)-1-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39387790

  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)	2.28	2.66	-12.04	3	5	0	81	286.397	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32133757
• 36747192
  

  Analogs

  49155069

  

  49240388

  

  6880367

  

  Popular Name: 3-[4-[(3-amino-3-oxo-propyl)sulfamoyl]phenyl]propanoic 3-[4-[(3-amino-3-oxo-propyl)sulf…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43553448

  • Enamine BB Make on Demand

    • BBV-25180151

  • UORSY BB Make-on-demand

    • BBV-25180151

  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)	-0.05	0.46	-55.46	3	7	-1	129	299.328	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC36747192
• 37023011
  

  Analogs

  8731364

  

  Popular Name: 3-[4-[cyclopropyl(ethyl)sulfamoyl]phenyl]propanoic 3-[4-[cyclopropyl(ethyl)sulfamoy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43243322

  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)	1.94	6.9	-46.92	0	5	-1	78	296.368	7	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	1.94	4.92	-12.48	1	5	0	75	297.376	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37023011
• 37024005
  

  Analogs

  8731364

  

  Popular Name: 3-[4-[cyclopropyl(methyl)sulfamoyl]phenyl]propanoic 3-[4-[cyclopropyl(methyl)sulfamo…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43247610

  • Enamine BB Make on Demand

    • BBV-14850107

  • UORSY BB Make-on-demand

    • BBV-14850107

  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)	1.56	6.13	-46.99	0	5	-1	78	282.341	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37024005
• 37097088
  

  Analogs

  8731364

  

  Popular Name: 3-[4-[cyclopropyl(propyl)sulfamoyl]phenyl]propanoic 3-[4-[cyclopropyl(propyl)sulfamo…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43270287

  • Enamine BB Make on Demand

    • BBV-14874102

  • UORSY BB Make-on-demand

    • BBV-14874102

  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)	2.44	7.65	-46.75	0	5	-1	78	310.395	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37097088
• 37109604
  

  Analogs

  8731364

  

  Popular Name: 3-[4-[methyl-[(1R)-1-methylpropyl]sulfamoyl]phenyl]propanoic 3-[4-[methyl-[(1R)-1-methylpropy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43272674

  • Enamine BB Make on Demand

    • BBV-32189480

  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)	2.40	6.96	-46.92	0	5	-1	78	298.384	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37109604
• 37109605
  

  Analogs

  8731364

  

  Popular Name: 3-[4-[methyl-[(1S)-1-methylpropyl]sulfamoyl]phenyl]propanoic 3-[4-[methyl-[(1S)-1-methylpropy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43272674

  • Enamine BB Make on Demand

    • BBV-32189480

  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)	2.40	6.68	-46.91	0	5	-1	78	298.384	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37109605
• 37112831
  

  Analogs

  13087606

  

  Popular Name: 3-[4-[ethyl-[(1R)-1-methylpropyl]sulfamoyl]phenyl]propanoic 3-[4-[ethyl-[(1R)-1-methylpropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43274415

  • Enamine BB Make on Demand

    • BBV-14878354

  • UORSY BB Make-on-demand

    • BBV-14878354

  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)	2.78	7.53	-46.89	0	5	-1	78	312.411	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37112831