EFINACONAZOLE

Search structure
Trade Names:
Synonyms:
Status: Approved (2014)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: D01AC19
UNII: J82SB7FXWB

Structure
InChI Key NFEZZTICAUWDHU-RDTXWAMCSA-N
Smile C=C1CCN([C@H](C)[C@](O)(Cn2cncn2)c2ccc(F)cc2F)CC1
InChI
InChI=1S/C18H22F2N4O/c1-13-5-7-23(8-6-13)14(2)18(25,10-24-12-21-11-22-24)16-4-3-15(19)9-17(16)20/h3-4,9,11-12,14,25H,1,5-8,10H2,2H3/t14-,18-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H22F2N4O
Molecular Weight 348.4
AlogP 2.48
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 54.18
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 25.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Lanosterol 14-alpha demethylase inhibitor FDA

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

MCS

Scaffolds

Side Effects from Label

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Skin and subcutaneous tissue disorders
30.84
General disorders and administration site conditions
28.13
Injury, poisoning and procedural complications
18.11
Nervous system disorders
3.62
Infections and infestations
3.06
Product issues
2.87
Musculoskeletal and connective tissue disorders
2.35

Cross References

Resources Reference
CAS NUMBER 164650-44-6
ChEBI 82718
ChEMBL CHEMBL2103877
DrugBank DB09040
DrugCentral 4874
EPA CompTox DTXSID40167787
FDA SRS J82SB7FXWB
PubChem 489181
SureChEMBL SCHEMBL300738
ZINC ZINC000000006251
CONTENTS