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Chemical Name: N-{3-[4-(4-Fluorobenzoyl)piperidin-1-yl]propyl}-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190991
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190991


STEREOCHEMISTRY UNSPECIFIED 
C27 H32 F N3 O3  MW: 465.57 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 7 PHIA (Flexible Bonds): 7.98 Calc. LogP
(MDL QSAR): 2.5
Company:  Calc. LogP
(KowWin): 2.43
Anti-HIV Cellular data: 0

Lines of Data: 5
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 5
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-{4-[4-(4-Fluorobenzoyl)piperidin-1-yl]butyl}-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190992
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190992


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C28 H34 F N3 O3  MW: 479.59 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 7 PHIA (Flexible Bonds): 8.55 Calc. LogP
(MDL QSAR): 3.13
Company:  Calc. LogP
(KowWin): 2.92
Anti-HIV Cellular data: 0

Lines of Data: 3
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 3
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-{5-[4-(4-Fluorobenzoyl)piperidin-1-yl]pentyl}-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190993
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190993


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C29 H36 F N3 O3  MW: 493.62 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 7 PHIA (Flexible Bonds): 9.13 Calc. LogP
(MDL QSAR): 3.83
Company:  Calc. LogP
(KowWin): 3.41
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-{2-[4-(4-Fluorobenzoyl)piperidin-1-yl]ethyl}-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190994
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190994


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C26 H30 F N3 O3  MW: 451.54 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 7 PHIA (Flexible Bonds): 7.42 Calc. LogP
(MDL QSAR): 1.96
Company:  Calc. LogP
(KowWin): 1.94
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: 1-Methyl-5-oxo-N-phenyl-N-(3-piperidin-1-ylpropyl)pyrrolidine-3-carboxamide Synonyms
AIDS# 190995
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190995


STEREOCHEMISTRY UNSPECIFIED; HYDROCHLORIDE 
C20 H29 N3 O2  MW: 343.47 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 6.34 Calc. LogP
(MDL QSAR): 2.14
Company:  Calc. LogP
(KowWin): 1.46
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: 1-Methyl-5-oxo-N-phenyl-N-[3-(4-phenylpiperidin-1-yl)propyl]pyrrolidine-3-carboxamide Synonyms
AIDS# 190996
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Links to PubChem by AIDS#

190996


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C26 H33 N3 O2  MW: 419.57 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 7.28 Calc. LogP
(MDL QSAR): 3.16
Company:  Calc. LogP
(KowWin): 3.1
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-[3-(4-Hydroxy-4-phenylpiperidin-1-yl)propyl]-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190997
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190997


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C26 H32 Cl N3 O3  MW: 470.01 Links to PubMed by CAS#

H-bond donors: 1 H-bond acceptors: 7 PHIA (Flexible Bonds): 7.62 Calc. LogP
(MDL QSAR): 2.44
Company:  Calc. LogP
(KowWin): 2.24
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: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: 1-Methyl-5-oxo-N-phenyl-N-[3-(1'H-spiro[indene-1,4'-piperidin]-1'-yl)propyl]pyrrolidine-3-carboxamide Synonyms
AIDS# 190998
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Links to PubChem by AIDS#

190998


STEREOCHEMISTRY UNSPECIFIED; FUMARATE 
C28 H33 N3 O2  MW: 443.59 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 6.28 Calc. LogP
(MDL QSAR): 4.1
Company:  Calc. LogP
(KowWin): 3.77
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-[3-(4-Benzylpiperidin-1-yl)propyl]-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 190999
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Links to PubChem by AIDS#

190999


STEREOCHEMISTRY UNSPECIFIED; HYDROCHLORIDE 
C27 H35 N3 O2  MW: 433.59 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 5 PHIA (Flexible Bonds): 7.85 Calc. LogP
(MDL QSAR): 3.73
Company:  Calc. LogP
(KowWin): 3.59
Anti-HIV Cellular data: 0

Lines of Data: 5
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 5
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

Chemical Name: N-[3-(4-Benzylpiperazin-1-yl)propyl]-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide Synonyms
AIDS# 191000
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Links to PubChem by AIDS#

191000


STEREOCHEMISTRY UNSPECIFIED; DIHYDROCHLORIDE 
C26 H34 N4 O2  MW: 434.58 Links to PubMed by CAS#

H-bond donors: 0 H-bond acceptors: 6 PHIA (Flexible Bonds): 7.81 Calc. LogP
(MDL QSAR): 2.8
Company:  Calc. LogP
(KowWin): 1.4
Anti-HIV Cellular data: 0

Lines of Data: 2
Anti-OI data: 0
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0

Number of References: 2
Number of References: 0
Lipinski:    4                     (Score, out of 4)
Classes: CCR5 CO-RECEPTOR INHIBITORS; 5-OXOPYRROLIDINE-3-CARBOXAMIDES

 

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