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Organism

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Chemical Name: 3'-Azido-2'-deoxy-5-(2-propynyloxy)uridine			Synonyms 3'-N3-5-OCH2CCH-ddU		AIDS# 000072
					Links to ChemID Plus by CAS# 111495-93-3
					Links to PubChem by AIDS# 000072
.BETA.-D
C12 H13 N5 O5		MW: 307.27			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 10	PHIA (Flexible Bonds): 5.24	Calc. LogP (MDL QSAR): -0.32
Company: YALE UNIV			Calc. LogP (KowWin): -8.1
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: PYRIMIDINE DIDEOXYNUCLEOSIDES; NUCLEOSIDES, AZIDO; ALKYNES

Chemical Name: Thymidine, 4'-C-ethynyl-			Synonyms 4'-.alpha.-Ethynylthymidine		AIDS# 000334
					Links to ChemID Plus by CAS# 221272-62-4
					Links to PubChem by AIDS# 000334
.BETA.-D
C12 H14 N2 O5		MW: 266.25			Links to PubMed by CAS#
H-bond donors: 3	H-bond acceptors: 7	PHIA (Flexible Bonds): 3.54	Calc. LogP (MDL QSAR): -0.6
Company: YAMASA CORP (JAPAN)			Calc. LogP (KowWin): -0.47
Lines of Data: 18	Anti-HIV Enzyme data: 0	Anti-OI data: 0	TB Min MIC	TB Min IC50	Links to NIST by AIDS# 000334
Number of References: 5	Number of References: 0	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: PYRIMIDINE DEOXYRIBONUCLEOSIDES; ALKYNES; NUCLEOSIDES, 4'-SUBSTITUTED; NUCLEOSIDE RT INHIBITORS

Chemical Name: 1-(3-Ethynyl-3-deoxy-.beta.-D-arabinofuranosyl)thymine			Synonyms 3'-Ethynyl-araT		AIDS# 000985
					Links to ChemID Plus by CAS# 115913-85-4
					Links to PubChem by AIDS# 000985
.BETA.-D; ARABINOFURANOSYL
C12 H14 N2 O5		MW: 266.25			Links to PubMed by CAS#
H-bond donors: 3	H-bond acceptors: 7	PHIA (Flexible Bonds): 3.8	Calc. LogP (MDL QSAR): -0.51
Company:			Calc. LogP (KowWin): -0.7
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: PYRIMIDINE DEOXYARABINONUCLEOSIDES; ALKYNES

Chemical Name: 9-(4-Hydroxy-2-butyn)-adenine			Synonyms HOCH2C#C-CH2-adenine		AIDS# 001053
					Links to ChemID Plus by CAS# 114978-79-9
					Links to PubChem by AIDS# 001053

C9 H9 N5 O		MW: 203.2			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 5	PHIA (Flexible Bonds): 2.69	Calc. LogP (MDL QSAR): 0.35
Company:			Calc. LogP (KowWin): -0.89
Lines of Data: 2	Anti-HIV Enzyme data: 0	Anti-OI data: 0	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 2	Number of References: 0	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: ALKYNES; PURINE ACYCLIC NUCLEOSIDES

Chemical Name: 9-(4-Chloro-2-butyn)-adenine			Synonyms ClCH2C#C-CH2-adenine		AIDS# 001054
					Links to ChemID Plus by CAS# 114987-15-4
					Links to PubChem by AIDS# 001054

C9 H8 Cl N5		MW: 221.65			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 5	PHIA (Flexible Bonds): 2.92	Calc. LogP (MDL QSAR): 1.28
Company:			Calc. LogP (KowWin): 0.83
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: ALKYNES; PURINE ACYCLIC NUCLEOSIDES

Chemical Name: (4-Hydroxy-2-butyn)cytosine			Synonyms HOCH2C#C-CH2-cytosine		AIDS# 001059
					Links to ChemID Plus by CAS# 114987-17-6
					Links to PubChem by AIDS# 001059

C8 H9 N3 O2		MW: 179.18			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 5	PHIA (Flexible Bonds): 3.34	Calc. LogP (MDL QSAR): 1.6
Company:			Calc. LogP (KowWin): -1.96
Lines of Data: 1	Anti-HIV Enzyme data: 0	Lines of Data: 2	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 1	Lipinski: 4 (Score, out of 4)
Classes: ALKYNES; PYRIMIDINE ACYCLIC NUCLEOSIDES

Chemical Name: 9-(4-Hydroxy-2-butyn)guanine			Synonyms HOCH2C#C-CH2-guanine		AIDS# 001063
					Links to ChemID Plus by CAS# 99776-30-4
					Links to PubChem by AIDS# 001063

C9 H9 N5 O2		MW: 219.2			Links to PubMed by CAS#
H-bond donors: 3	H-bond acceptors: 6	PHIA (Flexible Bonds): 2.89	Calc. LogP (MDL QSAR): -0.43
Company:			Calc. LogP (KowWin): -1.21
Lines of Data: 1	Anti-HIV Enzyme data: 0	Lines of Data: 2	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 1	Lipinski: 4 (Score, out of 4)
Classes: ALKYNES; PURINE ACYCLIC NUCLEOSIDES

Chemical Name: 3'-Propargyl-3'-deoxythymidine			Synonyms 3'-Propargyl-ddT		AIDS# 001087
					Links to ChemID Plus by CAS# 128119-36-8
					Links to PubChem by AIDS# 001087
.BETA.-D
C13 H16 N2 O4		MW: 264.28			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 6	PHIA (Flexible Bonds): 4.12	Calc. LogP (MDL QSAR): 0.22
Company: ROCHE			Calc. LogP (KowWin): 0.05
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: PYRIMIDINE DIDEOXYNUCLEOSIDES; ALKYNES

Chemical Name: 3'-Propargyl-2',3'-dideoxycytidine			Synonyms 3'-Propargyl-ddC		AIDS# 001093
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 001093

C12 H15 N3 O3		MW: 249.27			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 6	PHIA (Flexible Bonds): 3.89	Calc. LogP (MDL QSAR): 0.29
Company: ROCHE			Calc. LogP (KowWin): -1.09
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: PYRIMIDINE DIDEOXYNUCLEOSIDES; ALKYNES

Chemical Name: Class II Bolaphiles (acetylenic)			Synonyms Acetylenic Bolaphile surfactant		AIDS# 001714
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 001714
X = R = (CH2) 5; 6; 7; 8; 10. X = (CH2) 5; R = (CH2) 10
C16 H26 O5 R X		MW: 298.38			Links to PubMed by CAS#
H-bond donors:	H-bond acceptors:	PHIA (Flexible Bonds):	Calc. LogP (MDL QSAR):
Company:			Calc. LogP (KowWin):
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: (Score, out of 4)
Classes: SURFACTANTS, NON-IONIC; ALKYNES

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