DEXPANTHENOL

Search structure
Synonyms:
Status: Approved (1985)
Entry Type: Small molecule
Molecule Category: UKNOWN
ATC: A11HA30
UNII: 1O6C93RI7Z

Structure
InChI Key SNPLKNRPJHDVJA-ZETCQYMHSA-N
Smile CC(C)(CO)[C@@H](O)C(=O)NCCCO
InChI
InChI=1S/C9H19NO4/c1-9(2,6-12)7(13)8(14)10-4-3-5-11/h7,11-13H,3-6H2,1-2H3,(H,10,14)/t7-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H19NO4
Molecular Weight 205.25
AlogP -1.14
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 6.0
Polar Surface Area 89.79
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 14.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Skin Diseases 3 D012871 ClinicalTrials
Stomatitis 2 D013280 ClinicalTrials
Erythema 2 D004890 ClinicalTrials
Cheilitis 2 D002613 ClinicalTrials

Cross References

Resources Reference
ChEBI 27373
ChEMBL CHEMBL1200979
DrugBank DB09357
DrugCentral 838
EPA CompTox DTXSID3022906
FDA SRS 1O6C93RI7Z
KEGG C05944
SureChEMBL SCHEMBL15861
ZINC ZINC000001530303
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