DEXISOMETHEPTENE MUCATE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: G5E8S36F0N

Structure
InChI Key WSXKZIDINJKWPM-PPPDGRNVSA-N
Smile CN[C@H](C)CCC=C(C)C.CN[C@H](C)CCC=C(C)C.O=C(O)[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(=O)O
InChI
InChI=1S/2C9H19N.C6H10O8/c2*1-8(2)6-5-7-9(3)10-4;7-1(3(9)5(11)12)2(8)4(10)6(13)14/h2*6,9-10H,5,7H2,1-4H3;1-4,7-10H,(H,11,12)(H,13,14)/t2*9-;1-,2-,3-,4+/m111/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H48N2O8
Molecular Weight 492.65
AlogP 2.34
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 12.03
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 10.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Tension-Type Headache 2 D018781 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3707373
FDA SRS G5E8S36F0N
PubChem 76853225
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