FOSRAVUCONAZOLE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: D01BA03
UNII: L4Q6O5430L

Structure
InChI Key SYTNEMZCCLUTNX-NPMXOYFQSA-N
Smile C[C@@H](c1nc(-c2ccc(C#N)cc2)cs1)[C@@](Cn1cncn1)(OCOP(=O)(O)O)c1ccc(F)cc1F
InChI
InChI=1S/C23H20F2N5O5PS/c1-15(22-29-21(10-37-22)17-4-2-16(9-26)3-5-17)23(11-30-13-27-12-28-30,34-14-35-36(31,32)33)19-7-6-18(24)8-20(19)25/h2-8,10,12-13,15H,11,14H2,1H3,(H2,31,32,33)/t15-,23+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H20F2N5O5PS
Molecular Weight 547.48
AlogP 4.33
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 10.0
Polar Surface Area 143.38
Molecular species ACID
Aromatic Rings 4.0
Heavy Atoms 37.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Cytochrome P450 51 inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Mycetoma 2 D008271 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 351227-64-0
ChEBI 34549
ChEMBL CHEMBL333325
DrugBank DB15204
EPA CompTox DTXSID70188627
FDA SRS L4Q6O5430L
KEGG C14817
PubChem 9807507
SureChEMBL SCHEMBL1434200
ZINC ZINC000001553335
CONTENTS