Responsive image

Common name


1,3-dioxolane

IUPAC name


1,3-dioxolane

SMILES


O1COCC1

Common name


1,3-dioxolane

IUPAC name


1,3-dioxolane

SMILES


O1COCC1

INCHI


InChI=1S/C3H6O2/c1-2-5-3-4-1/h1-3H2

FORMULA


C3H6O2

Responsive image

Common name


1,3-dioxolane

IUPAC name


1,3-dioxolane





Molecular weight


74.079

clogP


1.423

clogS


-0.057

Frequency


0.0034





HBond Acceptor


2

HBond Donor


0

Total Polar
Surface Area


18.46

Number of Rings


1

Rotatable Bond


0

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00139 Terconazole Responsive image Antifungal Agents; Genito Urinary System and Sex Hormones; Gynecological Antiinfectives and Antiseptics; Triazole Derivatives; For the treatment of candidiasis (a yeast-like fungal infection) of the vulva and vagina.
FDBD00880 Ketoconazole Responsive image Antifungal Agents; 14-alpha Demethylase Inhibitors; Genito Urinary System and Sex Hormones; Antiinfectives for Systemic Use; Dermatologicals; Gynecological Antiinfectives and Antiseptics; Imidazole and Triazole Derivatives; Antifungals for Topical Use; Antifungals for Dermatological Use; Antimycotics for Systemic Use; Imidazole Derivatives; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP3A Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C19 Inducers; Cytochrome P-450 CYP2C8 Inducers; Cytochrome P-450 CYP2B6 Inducers; Cytochrome P-450 CYP2B6 Inhibitors; CYP2A6 Inhibitors; CYP2A6 Inhibitors (strong); CYP2A6 Inhibitors (moderate); CYP2A6 Inducers; CYP2A6 Inducers (strong); CYP2B6 Inhibitors (strong); CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; BSEP/ABCB11 Inhibitors; Combined Inhibitors of CYP3A4 and P-glycoprotein; For the treatment of the following systemic fungal infections: candidiasis, chronic mucocutaneous candidiasis, oral thrush, candiduria, blastomycosis, coccidioidomycosis, histoplasmosis, chromomycosis, and paracoccidioidomycosis.
FDBD01013 Itraconazole Responsive image Antifungal Agents; Antiprotozoal Agents; 14-alpha Demethylase Inhibitors; Antiinfectives for Systemic Use; Triazole Derivatives; Antimycotics for Systemic Use; Cytochrome P-450 CYP3A Inhibitors; Cytochrome P-450 CYP2B6 Inducers; Cytochrome P-450 CYP2B6 Inhibitors; CYP2B6 Inhibitors (strong); CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP2E1 Inhibitors; CYP2E1 Inducers; CYP2E1 Inducers (strong); CYP3A4 Inhibitors; Combined Inhibitors of CYP3A4 and P-glycoprotein; For the treatment of the following fungal infections in immunocompromised and non-immunocompromised patients: pulmonary and extrapulmonary blastomycosis, histoplasmosis, aspergillosis, and onychomycosis.
FDBD01774 Doxofylline Responsive image Respiratory System; Drugs for Obstructive Airway Diseases; Xanthines; For the treatment of asthma.
FDBD01898 dioxacarb Responsive image Insecticide Insecticide
FDBD02003 diofenolan Responsive image Insecticide Insecticide
FDBD02468 lancotrione Responsive image Herbicide Herbicide
FDBD03048 azaconazole Responsive image Fungicide Fungicide
FDBD03056 etaconazole Responsive image Fungicide Fungicide
FDBD03071 propiconazole Responsive image Fungicide Fungicide
10 , 2
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
1ikt_ligand_4_680.mol2 1ikt 0.583333 -5.37 C(O)COC 5
129 , 13