Anti-infectives are drugs that can either kill an infectious agent or inhibit it from spreading. Anti-infectives include antibiotics and antibacterials, antifungals, antivirals and antiprotozoals.

Antibiotics specifically treat infections caused by bacteria, most commonly used types of antibiotics are: Aminoglycosides, Penicillins, Fluoroquinolones, Cephalosporins, Macrolides, and Tetracyclines. New other approaches such as photodynamic therapy (PDT) and antibacterial peptides have been considered as alternatives to kill bacteria.

The high rates of morbidity and mortality caused by fungal infections are associated with the current limited antifungal arsenal and the high toxicity of the compounds. The most common antifungal targets include fungal RNA synthesis and cell wall and membrane components, though new antifungal targets are being investigated.

Viral infections occur when viruses enter cells in the body and begin reproducing, often causing illness. Viruses are classified as DNA viruses or RNA viruses, RNA viruses include retroviruses, such as HIV, are prone to mutate. The currently available antiviral drugs target 4 main groups of viruses: herpes, hepatitis, HIV and influenza viruses. Drug resistance in the clinical utility of antiviral drugs has raised an urgent need for developing new antiviral drugs.

Antiprotozoal drugs are medicines that treat infections caused by protozoa. Of which, malaria remains a major world health problem following the emergence and spread of Plasmodium falciparum that is resistant to the majority of antimalarial drugs. At present, antimalarial discovery approaches have been studied, such as the discovery of antimalarials from natural sources, chemical modifications of existing antimalarials, the development of hybrid compounds, testing of commercially available drugs that have been approved for human use for other diseases and molecular modelling using virtual screening technology and docking.

References:
[1] Scorzoni L, et al. Front Microbiol. 2017 Jan 23;8:36.
[2] Dehghan Esmatabadi MJ, et al. Cell Mol Biol (Noisy-le-grand). 2017 Feb 28;63(2):40-48.
[3] Raymund R, et al. Mayo Clin Proc. 2011 Oct; 86(10):1009-1026.
[4] Aguiar AC, et al. Mem Inst Oswaldo Cruz. 2012 Nov;107(7):831-45.


Anti-infection >
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15-PGDH 5 alpha Reductase 5-Lipoxygenase Acetyl-CoA Carboxylase Acyltransferase Adenosine Deaminase Adenosine Kinase Aldehyde Dehydrogenase (ALDH) Aldose Reductase Aminopeptidase Angiotensin-converting Enzyme (ACE) ATGL ATP Citrate Lyase Carbonic Anhydrase Carboxypeptidase Cathepsin CETP COMT Cytochrome P450 Dipeptidyl Peptidase Dopamine β-hydroxylase E1/E2/E3 Enzyme Elastase Enolase FAAH FABP Factor Xa Farnesyl Transferase Fatty Acid Synthase (FAS) FXR Glucokinase GSNOR Gutathione S-transferase HCV Protease Hexokinase HIF/HIF Prolyl-Hydroxylase HIV Integrase HIV Protease HMG-CoA Reductase (HMGCR) HSP Indoleamine 2,3-Dioxygenase (IDO) Isocitrate Dehydrogenase (IDH) Lactate Dehydrogenase LXR MAGL Mineralocorticoid Receptor Mitochondrial Metabolism MMP Nampt NEDD8-activating Enzyme Neprilysin PAI-1 PDHK PGC-1α Phosphatase Phosphodiesterase (PDE) Phospholipase Procollagen C Proteinase Proteasome Pyruvate Kinase RAR/RXR Renin ROR Ser/Thr Protease SGK Stearoyl-CoA Desaturase (SCD) Thrombin Tryptophan Hydroxylase Tyrosinase Xanthine Oxidase
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4-Phenoxybenzylamine

4-Phenoxybenzylamine inhibits the function of the NS3 protein by stabilizing an inactive conformation with an IC50 of about 500 μM against FL NS3/4a.

  • CAS Number: 107622-80-0
  • MF: C13H13NO
  • MW: 199.248
  • Catalog: HCV
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 319.6±25.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 149.5±16.4 °C

Pazufloxacin-d4

Pazufloxacin-d4 is deuterium labeled Pazufloxacin.

  • CAS Number: 1346602-96-7
  • MF: C16H11D4FN2O4
  • MW: 322.32
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Acetylalkannin

Acetylalkannin (Alkannin acetate) is an isohexenylnaphthazarin pigment isolated from Arnebia euchroma with antimicrobial and cytotoxic activities[1].

  • CAS Number: 34232-27-4
  • MF: C18H18O6
  • MW: 330.33
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-[[P(S),2'R]-2'-Deoxy-2'-fluoro-2'-Methyl-6-O-Methyl-P-phenyl-5'-guanylyl]- L-alanine 1-Methylethyl ester

PSI-353661 (GS-558093) is a purine nucleotide NS5B polymerase inhibitor against HCV infection (EC90: 8 nM). PSI-353661 can produce high concentrations of the active triphosphate in primary human hepatocytes[1][3].

  • CAS Number: 1231747-08-2
  • MF: C24H32FN6O8P
  • MW: 582.51800
  • Catalog: HCV
  • Density: 1.53
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

AMY-101

AMY-101 (Cp40), a peptidic inhibitor of the central complement component C3 (KD = 0.5 nM), inhibits naturally occurring periodontitis in non-human primates (NHPs). AMY-101 (Cp40) exhibits a favorable anti-inflammatory activity in models with COVID-19 severe pneumonia with systemic hyper inflammation[1][2].

  • CAS Number: 1427001-89-5
  • MF: C83H117N23O18S2
  • MW: 1789.11
  • Catalog: SARS-CoV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

[[[(2R,5S)-5-(4-amino-5-fluoro-2,6-dioxo-3H-pyrimidin-1-yl)-1,3-oxathi olan-2-yl]methyl-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxyphosphon ic acid

Emtricitabine triphosphate ((-)-Emtricitabine triphosphate) is the phosphorylated anabolite of Emtricitabine (HY-17427). Emtricitabine is a nucleoside reverse transcriptase inhibitor. Emtricitabine is antiretroviral agent for HIV and HBV infection[1][2].

  • CAS Number: 145819-92-7
  • MF: C8H13FN3O12P3S
  • MW: 487.18600
  • Catalog: HIV
  • Density: 2.08g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Colutehydroquinone

Colutehydroquinone is an isoflavonoid that can be found in the root bark of Colutea arborescens. Colutehydroquinone exhibits antifungal activity[1].

  • CAS Number: 181311-16-0
  • MF: C18H20O6
  • MW: 332.35
  • Catalog: Fungal
  • Density: N/A
  • Boiling Point: 461.2±45.0 °C(Predicted)
  • Melting Point: N/A
  • Flash Point: N/A

HCV-IN-44

HCV-IN-44 (compound 28) is an HCV NS5B protein inhibitor that can effectively inhibit the replication of HCV virus. HCV-IN-44 can be used for the study of HCV infection[1].

  • CAS Number: 1850311-55-5
  • MF: C24H26FN3O5S
  • MW: 487.54
  • Catalog: HCV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

HBV-IN-10

HBV-IN-10 is an enantiomer of compound 6 (WO2021204258A1). Compound 6 is a hepatitis B surface antigen (HBsAg) inhibitor (0.001 μM< EC50 ≤0.05 μM). From patent WO2021204258A1, compound 6[1].

  • CAS Number: 2716907-16-1
  • MF: C23H24FN7O
  • MW: 433.48
  • Catalog: HBV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2-Hydroxycinnamic acid

2-Hydroxycinnamic acid is isolated from the methanol extract of Cinnamomum cassia. 2-Hydroxycinnamic acid shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 0.3 mM[2]

  • CAS Number: 614-60-8
  • MF: C9H8O3
  • MW: 164.158
  • Catalog: HIV
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 348.0±17.0 °C at 760 mmHg
  • Melting Point: 217ºC
  • Flash Point: 178.5±17.4 °C

BUFORIN II

Buforin II, derived from buforin I, a protein isolated from the stomach of the Asian toad Bufo bufo gargarizans, is a potent antimicrobial peptide. Buforin II has antimicrobial activity against a broad spectrum of Gram-positive and Gram-negative bacteria[1].

  • CAS Number: 172998-24-2
  • MF: C106H184N40O26
  • MW: 2434.87
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Valganciclovir Hydrochloride

Valganciclovir (hydrochloride), the L-valyl ester of ganciclovir, is actually a prodrug for ganciclovir. Valganciclovir is an antiviral medication used to treat cytomegalovirus infections.IC50 Value: Target: CMVin vitro: In cell culture model systems using Caco-2 cells for PEPT1 and SKPT cells for PEPT2, valganciclovir inhibited glycylsarcosine transport mediated by PEPT1 and PEPT2 with K(i) values (inhibition constant) of 1.68+/-0.30 and 0.043+/- 0.005 mM, respectively. The inhibition by valganciclovir was competitive in both cases [1].in vivo: 37 patients were enrolled; 19 patients received treatment with VGV and 18 patients received treatment with GCV. The VGV was not inferior in efficacy to GCV as pre-emptive therapy, with rates of viral clearance at 28 days of 89.5% and 83%, respectively (P-value for non-inferiority = 0.030). Toxicities were similar between the 2 arms. No patients developed CMV disease [2]. Patients being treated with an alemtuzumab-containing regimen received prophylaxis with either valaciclovir 500 mg orally daily orvalganciclovir 450 mg orally twice daily. None of the 20 patients randomized to valganciclovir experienced CMV reactivation (P = .004) [3].

  • CAS Number: 175865-59-5
  • MF: C14H23ClN6O5
  • MW: 390.823
  • Catalog: CMV
  • Density: N/A
  • Boiling Point: 629.1ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: N/A

1,3,7-Trihydroxy-2-prenylxanthone

1,3,7-Trihydroxy-2-prenylxanthone, a xanthone, shows weaker antibacterial activity. 1,3,7-Trihydroxy-2-prenylxanthone exhibits the MIC value of 6.25 mg/ml against VREs strains (E. faecalis, E. faecium, and E. gallinarum)[1].

  • CAS Number: 20245-39-0
  • MF: C18H16O5
  • MW: 312.317
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 576.2±39.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 214.5±20.6 °C

Zinlirvimab

Zinlirvimab is a humanized IgG1-λ2, HIV neutralising antibody targeting to HIV-1 gp120 envelope glycoprotein (IIIB gp120 V3 loop)[1][2].

  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Antibacterial agent 114

Antibacterial agent 114 (compound 1) is a potent antibacterial agent. Antibacterial agent 114 shows antibacterial activity against P.aeruginosa, B.subtilis, E.coli, E.faecalis, S.typhimuriumand, S.mutans, and S.aureus microorganisms, with MIC values of 625, 625, 625, 625, 625, 1250 and 1250 μM, respectively[1].

  • CAS Number: 2733391-71-2
  • MF: C19H14N4O
  • MW: 314.34
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

HSV-1/HSV-2-IN-2

HSV-1/HSV-2-IN-2 is a HSV-1, HSV-2 and VV inhibitor with EC50 values of 6.8, 8.9 and 8.9 µM, respectively. HSV-1/HSV-2-IN-2 shows antiviral activity[1].

  • CAS Number: 2490468-39-6
  • MF: C17H14ClFN4OS
  • MW: 376.84
  • Catalog: HSV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Rifaquizinone

Rifaquizinone (CBR-2092) is a Rifamycin-Quinolone Hybrid Antibiotic. Rifaquizinone inhibits wild-type S. aureus RNA polymerase with an IC50 of 34 nM. Rifaquizinone is effective against S. aureus infections, with MICs ranged from 0.008 to 0.5 μg/mL for 300 clinical isolates of staphylococci and streptococci[1][2].

  • CAS Number: 922717-97-3
  • MF: C65H81FN6O15
  • MW: 1205.37
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ethyl 4-hydroxy(2H4)benzoate

Ethylparaben-d4 is the deuterium labeled Ethylparaben[1].

  • CAS Number: 1219795-53-5
  • MF: C9H6D4O3
  • MW: 170.199
  • Catalog: Bacterial
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 297.5±0.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 120.3±12.6 °C

Etravirine (TMC125)

Etravirine is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used for the treatment of HIV.

  • CAS Number: 269055-15-4
  • MF: C20H15BrN6O
  • MW: 435.277
  • Catalog: HIV
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 637.4±65.0 °C at 760 mmHg
  • Melting Point: 265ºC (dec.)
  • Flash Point: 339.3±34.3 °C

Aurein 2.3

Aurein 2.3 is an antibiotic antimicrobial peptide. Aurein 2.3 partially inhibits E.coli ATPase activity and inhibits cell growth[1][2].

  • CAS Number: 302343-06-2
  • MF: C76H131N19O19
  • MW: 1614.97
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

sulfamerazine sodium

Sulfamerazine Sodium is a sulfonamide antibacterial.Target: AntibacterialSulfamerazine, the monomethyl derivative of sulfadiazine, is 2-sulfanilamido-4-methylpyrimidine. Sulfamerazine is a sulfonamide drug that inhibits bacterial synthesis of dihydrofolic acid by competing with para-aminobenzoic acid (PABA) for binding to dihydropteroate synthetase (dihydrofolate synthetase). Sulfamerazine is bacteriostatic in nature. Inhibition of dihydrofolic acid synthesis decreases the synthesis of bacterial nucleotides and DNA [1].

  • CAS Number: 127-58-2
  • MF: C11H11N4NaO2S
  • MW: 286.285
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: 519.1ºC at 760mmHg
  • Melting Point: 216-219 °C
  • Flash Point: 267.8ºC

Haplopine

Haplopine possesses photo-activated antimicrobial and DNA binding activities[1].

  • CAS Number: 5876-17-5
  • MF: C13H11NO4
  • MW: 245.231
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 431.2±40.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 214.6±27.3 °C

PKF050-638

PKF050-638 is a potent and selective inhibitor of HIV-1 Rev (IC50=0.04 μM). PKF050-638 inhibits the CRM1-mediated Rev nuclear export by disrupting CRM1-NES interaction[1].

  • CAS Number: 528893-52-9
  • MF: C13H13ClN4O2
  • MW: 292.72
  • Catalog: HIV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PTC725

PTC725 is a potent, selective, and orally bioavailable inhibitor of HCV NS4B, inhibits HCV 1b (Con1) replicons with EC50 of 1.7 nM; displays a selectivity index of >5,000 with respect to cellular GAPDH, and >1,000-fold selectivity window with respect to cytotoxicity; retains fully activity against HCV replicon mutants that are resistant to inhibitors of NS3 protease and NS5B polymerase, demonstrates synergistic affect in combination with alpha interferon in vivo.

  • CAS Number: 1248581-07-8
  • MF: C23H18F4N6O2S
  • MW: 518.487
  • Catalog: HCV
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 701.2±70.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 377.9±35.7 °C

SALANNIN(P)

Salannin, a limonoid bitter principle of the seed oil of Azadirachta indica, shows antiulcer and spermicidal activities. Salannin displays antibacterial activity towards both Gram-positive and Gram-negative bacteria[1][2].

  • CAS Number: 992-20-1
  • MF: C34H44O9
  • MW: 596.70800
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ganoderic acid TR

Ganoderic acid TR is a broad-spectrum inhibitor against influenza neuraminidases (NAs), particularly H5N1 and H1N1 neuraminidases. The IC50 values of 10.9 and 4.6 μM, respectively[1].

  • CAS Number: 862893-75-2
  • MF: C30H44O4
  • MW: 468.668
  • Catalog: Influenza Virus
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 618.6±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 341.9±28.0 °C

Micronomicin sulfate

Micronomicin sulfate (Gentamicin C2b sulfate) is an aminoglycoside antibiotic isolated from Micromonospora. Micronomicin sulfate is a broad-spectrum antibiotic close to the gentamicin-type antibiotics, exhibits a high activity against Pseudomonas, Proteus, Klebsiella pneumoniae, Serratia, etc (MIC=0.001-8.3 μg/ml)[1][2].

  • CAS Number: 66803-19-8
  • MF: C20H41N5O7.xH2O4S
  • MW: 561.647
  • Catalog: Bacterial
  • Density: 1.32g/cm3
  • Boiling Point: 667.2ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 357.3ºC

Glyasperin D

Glyasperin D is a flavonoid isolated from Glycyrrhiza uralensis, and possesses weaker anti-Helicobacter pylori activity[1].

  • CAS Number: 142561-10-2
  • MF: C22H26O5
  • MW: 370.43900
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Antibacterial agent 97

Antibacterial agent 97 (hit compound) is a potent antibacterial agent. Antibacterial agent 97 shows antibacterial activities with MIC of 16 and 16 µg/mL for Escherichia coli (E. coli) and Staphylococcus aureus (S. aureus), respectively[1].

  • CAS Number: 1714961-61-1
  • MF: C19H23N5S
  • MW: 353.48
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Decanoyl-RVKR-CMK

Decanoyl-RVKR-CMK (DecRVKRcmk) inhibits over-expressed gp160 processing and HIV-1 replication[1].

  • CAS Number: 150113-99-8
  • MF: C34H66ClN11O5
  • MW: 744.41
  • Catalog: HIV
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A