Organism

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Organism

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Chemical Name: 9,10-Anthracenedione			Synonyms Anthraquinone		AIDS# 001365
					Links to ChemID Plus by CAS# 84-65-1
					Links to PubChem by AIDS# 001365

C14 H8 O2		MW: 208.22			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 2	PHIA (Flexible Bonds): 1.77	Calc. LogP (MDL QSAR): 2.79
Company:			Calc. LogP (KowWin): 3.34
Anti-HIV Cellular data: 0	Lines of Data: 1	Lines of Data: 6	TB Min MIC 6400 ug/mL	TB Min IC50	Links to NIST by AIDS#
Number of References: 0	Number of References: 1	Number of References: 3	Lipinski: 4 (Score, out of 4)
Classes: ANTHRAQUINONES

Chemical Name: 1-Chloroanthraquinone			Synonyms 1-Chloroanthraquinone		AIDS# 001366
					Links to ChemID Plus by CAS# 82-44-0
					Links to PubChem by AIDS# 001366

C14 H7 Cl O2		MW: 242.66			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 3	PHIA (Flexible Bonds): 2.13	Calc. LogP (MDL QSAR): 2.82
Company:			Calc. LogP (KowWin): 3.99
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 2	TB Min MIC > 100 ug/mL	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: ANTHRAQUINONES

Chemical Name: 1-Aminoanthraquinone			Synonyms 1-Aminoanthraquinone .alpha.-Aminoanthraquinone C.I. 37275 Diazo Fast Red AL NSC458		AIDS# 001367
					Links to ChemID Plus by CAS# 82-45-1
					Links to PubChem by AIDS# 001367

C14 H9 N O2		MW: 223.23			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 3	PHIA (Flexible Bonds): 1.97	Calc. LogP (MDL QSAR): 2.19
Company:			Calc. LogP (KowWin): 3.53
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 1	TB Min MIC > 100 ug/mL	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: ANTHRAQUINONES

Chemical Name: 1-(Methylamino)anthraquinone			Synonyms 1-(Methylamino)anthraquinone .alpha.-Methylaminoanthraquinone C.I. Solvent Red 111 C.I. 60505 Methane quinone NSC3721		AIDS# 001368
					Links to ChemID Plus by CAS# 82-38-2
					Links to PubChem by AIDS# 001368

C15 H11 N O2		MW: 237.26			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 3	PHIA (Flexible Bonds): 2.35	Calc. LogP (MDL QSAR): 2.43
Company:			Calc. LogP (KowWin): 4.07
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 2	TB Min MIC 100 ug/mL	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: ANTHRAQUINONES

Chemical Name: 2-Methylanthraquinone			Synonyms 2-Methylanthraquinone		AIDS# 001369
					Links to ChemID Plus by CAS# 84-54-8
					Links to PubChem by AIDS# 001369

C15 H10 O2		MW: 222.24			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 2	PHIA (Flexible Bonds): 1.99	Calc. LogP (MDL QSAR): 2.96
Company:			Calc. LogP (KowWin): 3.4
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: 1	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: ANTHRAQUINONES

Chemical Name: 9,10-Dioxoanthracene-2-carboxylic acid			Synonyms		AIDS# 001371
					Links to ChemID Plus by CAS# 117-78-2
					Links to PubChem by AIDS# 001371

C15 H8 O4		MW: 252.22			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 4	PHIA (Flexible Bonds): 2.4	Calc. LogP (MDL QSAR): 2.9
Company:			Calc. LogP (KowWin): 2.16
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 2	TB Min MIC 0.315 ug/mL	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: ANTITUBERCULOUS AGENTS; ANTHRAQUINONES

Chemical Name: 1,2-Dihydroxy-9,10-anthracenedione			Synonyms Alizarin 1, 2-Dihydroxyanthraquinone NSC7212		AIDS# 001373
					Links to ChemID Plus by CAS# 72-48-0
					Links to PubChem by AIDS# 001373
ISOLATED FROM RUBIA CORDIFOLIA
C14 H8 O4		MW: 240.21			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 4	PHIA (Flexible Bonds): 2.16	Calc. LogP (MDL QSAR): 2.4
Company:			Calc. LogP (KowWin): 1.49
Lines of Data: 4	Lines of Data: 9	Lines of Data: 8	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 3	Number of References: 3	Number of References: 1	Lipinski: 4 (Score, out of 4)
Classes: NATURAL PRODUCTS; ANTHRAQUINONES

Chemical Name: 1,4-Dihydroxy-9,10-anthracene-dione			Synonyms Quinizarin NSC646569		AIDS# 001374
					Links to ChemID Plus by CAS# 81-64-1
					Links to PubChem by AIDS# 001374

C14 H8 O4		MW: 240.21			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 4	PHIA (Flexible Bonds): 2.16	Calc. LogP (MDL QSAR): 2.75
Company:			Calc. LogP (KowWin): 3.94
Lines of Data: 1	Lines of Data: 7	Lines of Data: 4	TB Min MIC 12.5 ug/mL	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 2	Number of References: 2	Lipinski: 4 (Score, out of 4)
Classes: ANTHRAQUINONES

Chemical Name: 1,8-Dihydroxyanthracene-9,10-dione			Synonyms Danthron Dihydroxyanthraquinone 1, 8-Dihydroanthraquinone DHAQ Chrysazin NSC646568		AIDS# 001375
					Links to ChemID Plus by CAS# 117-10-2
					Links to PubChem by AIDS# 001375

C14 H8 O4		MW: 240.21			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 4	PHIA (Flexible Bonds): 2.16	Calc. LogP (MDL QSAR): 2.8
Company:			Calc. LogP (KowWin): 3.94
Lines of Data: 1	Lines of Data: 8	Lines of Data: 5	TB Min MIC 50 ug/mL	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 3	Number of References: 4	Lipinski: 4 (Score, out of 4)
Classes: ANTIVIRALS; ANTHRAQUINONES

Chemical Name: 1,5-Dihydroxy-9,10-anthracenedione			Synonyms 1, 5-Dihydroxyanthraquinone Anthrarufin NSC7211; NSC646570		AIDS# 001376
					Links to ChemID Plus by CAS# 117-12-4
					Links to PubChem by AIDS# 001376

C14 H8 O4		MW: 240.21			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 4	PHIA (Flexible Bonds): 2.16	Calc. LogP (MDL QSAR): 2.91
Company:			Calc. LogP (KowWin): 3.94
Lines of Data: 2	Lines of Data: 1	Lines of Data: 1	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 1	Number of References: 1	Lipinski: 4 (Score, out of 4)
Classes: ANTHRAQUINONES

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