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• Vendors (0)
• Annotations (1)
• Representations (1)
• Notes (0)
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• Analogs (4)

ZINC34591970

• 34591970

Physical Representations

Activity (Go SEA)

• 42802850
  

  Analogs

  34384250

  

  34384251

  

  Popular Name: (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(2-hydroxy-1,1-dimethyl-2-oxo-ethoxy)imino-acet (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChEMBL12

    • CHEMBL503020

  • ChEMBL19

    • CHEMBL503020

  • PubChem

    • 44562023

  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)	-5.29	7.47	-110.04	7	17	-1	271	603.623	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42802850
• 42835067
  

  Analogs

  34384250

  

  34384251

  

  Popular Name: (6R,7R)-3-[[4-(2-aminoethyl)pyridin-1-ium-1-yl]methyl]-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2- (6R,7R)-3-[[4-(2-aminoethyl)pyri…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChEMBL12

    • CHEMBL504740

  • ChEMBL19

    • CHEMBL504740

  • PubChem

    • 44562025

  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)	-5.48	7.82	-163.78	6	15	0	235	590.644	11	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	-5.48	7.43	-115.94	5	15	-1	233	589.636	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42835067
• 42888869
  

  Analogs

  34384250

  

  34384251

  

  Popular Name: (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(2-hydroxy-1,1-dimethyl-2-oxo-ethoxy)imino-acet (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChEMBL12

    • CHEMBL520754

  • ChEMBL19

    • CHEMBL520754

  • PubChem

    • 44562019

  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)	-5.21	9.02	-116.08	3	14	-1	207	546.567	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42888869
• 49867611
  

  Analogs

  34384250

  

  34384251

  

  Popular Name: (6R,7R)-3-[(3-aminopyridin-1-ium-1-yl)methyl]-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(2-hydrox (6R,7R)-3-[(3-aminopyridin-1-ium…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChEMBL12

    • CHEMBL481078

  • ChEMBL19

    • CHEMBL481078

  • PubChem

    • 44562021

  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)	-5.08	6.9	-113.6	5	15	-1	233	561.582	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC49867611