9 Record(s) returned from your Search Criteria

Organism

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Chemical Name: (+/-)-9H-Purine-9-ethanol, 6-amino-.beta.-hexyl-.alpha.-methyl- Synonyms

  • (+/-)-EHNA
  • 6-Amino-beta-hexyl-alpha-methyl-9H-purine-9-ethanol

  • NSC263164
AIDS# 000491
Click For Structure Based Search Links to ChemID Plus by CAS#

59262-86-1 [STEREOCHEMISTRY UNDEFINED]

58337-38-5 [HYDROCHLORIDE]

51350-19-7

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000491


HYDROCHLORIDE SALT; R,R AND S,S ISOMERS 
C14 H23 N5 O  MW: 277.37 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 5 PHIA (Flexible Bonds): 5.17 Calc. LogP
(MDL QSAR): 2.16
Company:  MARUHO CORPORATION Calc. LogP
(KowWin): 2.14

Lines of Data: 1
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#


Number of References: 1
Number of References: 0

Number of References: 3
Lipinski:    4                     (Score, out of 4)
Classes: ADENOSINE DEAMINASE INHIBITORS; PURINE ACYCLIC NUCLEOSIDES; PHOSPHODIESTERASE INHIBITORS; PHOSPHOLIPASE INHIBITORS

 

Chemical Name: Imidazo[4,5-d][1,3]diazepin-8-ol, 3,4,7,8-tetrahydro-3-.beta.-D-ribofuranosyl-, (8R) Synonyms

  • Coformycin

  • NSC277817
AIDS# 031186
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11033-22-0

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031186


R-ISOMER; .BETA.-D-RIBO- 
C11 H16 N4 O5  MW: 284.27 Links to PubMed by CAS#

H-bond donors: 5 H-bond acceptors: 8 PHIA (Flexible Bonds): 3.65 Calc. LogP
(MDL QSAR): -2.43
Company:  Calc. LogP
(KowWin): -3.2
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 2
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZODIAZEPINE RIBONUCLEOSIDES; ADENOSINE DEAMINASE INHIBITORS; MYCINS

 

Chemical Name: 1H-Benzimidazole-2-propanamide, N-[1-[(3R)-3-[4-(aminocarbonyl)-1H-imidazol-1-yl]-4-hydroxybutyl]-1H-indol-6-yl]-1-methyl- Synonyms
AIDS# 210536
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210536


 
C27 H29 N7 O3  MW: 499.57 Links to PubMed by CAS#

H-bond donors: 3 H-bond acceptors: 7 PHIA (Flexible Bonds): 7.29 Calc. LogP
(MDL QSAR): 4.38
Company:  Calc. LogP
(KowWin): 2.79
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; BENZIMIDAZOLES; INDOLES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: 1H-Imidazole-4-carboxamide, 1-[1-(hydroxymethyl)-3-(1-naphthalenyl)propyl]- Synonyms
AIDS# 210537
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210537


RACEMIC MIXTURE OF R/S ISOMERS; R FORM SHOWN 
C18 H19 N3 O2  MW: 309.37 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 4 PHIA (Flexible Bonds): 4.62 Calc. LogP
(MDL QSAR): 1.85
Company:  Calc. LogP
(KowWin): 2.81
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; NAPHTHALENES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: 1H-Imidazole-4-carboxamide, 1-[(1R,2S)-2-hydroxy-1-[2-(1-naphthalenyl)ethyl]propyl]- Synonyms
AIDS# 210538
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210538


 
C19 H21 N3 O2  MW: 323.39 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 4 PHIA (Flexible Bonds): 4.85 Calc. LogP
(MDL QSAR): 2.31
Company:  Calc. LogP
(KowWin): 3.23
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; NAPHTHALENES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: 1H-Imidazole-4-carboxamide, 1-[(1R,2S)-1-[2-(2,3-dichlorophenyl)ethyl]-2-hydroxypropyl]- Synonyms
AIDS# 210539
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210539


 
C15 H17 Cl2 N3 O2  MW: 342.22 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 6 PHIA (Flexible Bonds): 5.72 Calc. LogP
(MDL QSAR): 1.78
Company:  Calc. LogP
(KowWin): 3.34
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: D-Erythro-pentitol, 3-[4-(aminocarbonyl)-1H-imidazol-1-yl]-1,3,4-trideoxy-5-O-(2-naphthalenyl)- Synonyms
AIDS# 210540
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210540


 
C19 H21 N3 O3  MW: 339.39 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 5 PHIA (Flexible Bonds): 5.35 Calc. LogP
(MDL QSAR): 2.35
Company:  Calc. LogP
(KowWin): 2.76
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; NAPHTHALENES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: 1H-Imidazole-4-carboxamide, 1-[1-(hydroxymethyl)-3-phenylpropyl]- Synonyms
AIDS# 210541
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210541


PRESUMABLY A MIXTURE OF R/S ISOMERS 
C14 H17 N3 O2  MW: 259.31 Links to PubMed by CAS#

H-bond donors: 2 H-bond acceptors: 4 PHIA (Flexible Bonds): 4.57 Calc. LogP
(MDL QSAR): 0.51
Company:  Calc. LogP
(KowWin): 1.64
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: IMIDAZOLES; ADENOSINE DEAMINASE INHIBITORS

 

Chemical Name: Guanidine, N''-[4-[5-[(1H-benzimidazol-2-ylamino)methyl]-2-thienyl]-2-thiazolyl]- Synonyms
AIDS# 210542
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210542


 
C16 H15 N7 S2  MW: 369.48 Links to PubMed by CAS#

H-bond donors: 4 H-bond acceptors: 8 PHIA (Flexible Bonds): 4.66 Calc. LogP
(MDL QSAR): 2.82
Company:  Calc. LogP
(KowWin): 3.74
Anti-HIV Cellular data: 0

Lines of Data: 1
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 1
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: GUANIDINES; BENZIMIDAZOLES; THIOPHENES; THIAZOLES; ADENOSINE DEAMINASE INHIBITORS

 



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