35 Record(s) returned from your Search Criteria

Organism

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Chemical Name: 3-(5-Butyldihydro-2(3H)-furanylidene)-5-hydroxy-6-pentyldihydro-2H-pyran-2,4(3H)-dione Synonyms

  • Lachnellulone

  • NSC627481
AIDS# 132777
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132777


 
C18 H28 O5  MW: 324.41 Links to PubMed by CAS#

H-bond donors: 1 H-bond acceptors: 5 PHIA (Flexible Bonds): 6.93 Calc. LogP
(MDL QSAR): 2.83
Company:  Calc. LogP
(KowWin): 4.38

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

   
TB Min IC50

   
Links to NIST by AIDS#


Number of References: 1
Number of References: 0
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyldihydro-6-(2-thiazolylethynyl)- Synonyms
AIDS# 411623
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411623


 
C15 H15 N O3 S  MW: 289.35 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 3.77 Calc. LogP
(MDL QSAR): 1.91
Company:  Calc. LogP
(KowWin): 3.08
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 2
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: PYRANDIONES; THIAZOLES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyldihydro-6-[(4-methoxyphenyl)ethynyl]- Synonyms
AIDS# 411652
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411652


 
C19 H20 O4  MW: 312.36 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 4 PHIA (Flexible Bonds): 4.61 Calc. LogP
(MDL QSAR): 3.57
Company:  PFIZER INC Calc. LogP
(KowWin): 4.16
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyldihydro-6-[[3-(1-methylethyl)phenyl]ethynyl]- Synonyms
AIDS# 411653
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411653


 
C21 H24 O3  MW: 324.42 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 3 PHIA (Flexible Bonds): 4.87 Calc. LogP
(MDL QSAR): 4.72
Company:  PFIZER INC Calc. LogP
(KowWin): 5.53
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: Benzeneacetic acid, 3-[(2-cyclopentyltetrahydro-4,6-dioxo-2H-pyran-2-yl)ethynyl]-, methyl ester Synonyms
AIDS# 411654
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411654


 
C21 H22 O5  MW: 354.4 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 5.65 Calc. LogP
(MDL QSAR): 3.26
Company:  PFIZER INC Calc. LogP
(KowWin): 4.16
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-(3-butynyl)-6-cyclopentyldihydro- Synonyms
AIDS# 411655
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411655


 
C14 H18 O3  MW: 234.29 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 3 PHIA (Flexible Bonds): 3.63 Calc. LogP
(MDL QSAR): 1.61
Company:  PFIZER INC Calc. LogP
(KowWin): 3.29
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyldihydro-6-(4-phenyl-3-butynyl)- Synonyms
AIDS# 411656
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411656


 
C20 H22 O3  MW: 310.39 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 3 PHIA (Flexible Bonds): 4.93 Calc. LogP
(MDL QSAR): 3.84
Company:  PFIZER INC Calc. LogP
(KowWin): 5.06
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyldihydro-6-[4-(3-methoxyphenyl)-3-butynyl]- Synonyms
AIDS# 411657
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Links to PubChem by AIDS#

411657


 
C21 H24 O4  MW: 340.42 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 4 PHIA (Flexible Bonds): 5.67 Calc. LogP
(MDL QSAR): 3.73
Company:  PFIZER INC Calc. LogP
(KowWin): 5.14
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-[4-(6-benzothiazolyl)-3-butynyl]-6-cyclopentyldihydro- Synonyms
AIDS# 411658
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Links to PubChem by AIDS#

411658


 
C21 H21 N O3 S  MW: 367.47 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 4.97 Calc. LogP
(MDL QSAR): 4.06
Company:  PFIZER INC Calc. LogP
(KowWin): 5.23
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

Chemical Name: 2H-Pyran-2,4(3H)-dione, 6-cyclopentyl-6-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-butynyl]dihydro- Synonyms
AIDS# 411659
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Links to PubChem by AIDS#

411659


 
C22 H24 O5  MW: 368.43 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 5.4 Calc. LogP
(MDL QSAR): 3.49
Company:  PFIZER INC Calc. LogP
(KowWin): 5.11
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 1
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    4                     (Score, out of 4)
Classes: PYRANDIONES

 

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