TROFINETIDE

Search structure
Synonyms:
Status: Approved (2023)
Entry Type: Protein
Molecule Category: UNKNOWN
UNII: Z2ME8F52QL

Structure
InChI Key BUSXWGRAOZQTEY-SDBXPKJASA-N
Smile C[C@@]1(C(=O)N[C@@H](CCC(=O)O)C(=O)O)CCCN1C(=O)CN
InChI
InChI=1S/C13H21N3O6/c1-13(5-2-6-16(13)9(17)7-14)12(22)15-8(11(20)21)3-4-10(18)19/h8H,2-7,14H2,1H3,(H,15,22)(H,18,19)(H,20,21)/t8-,13-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H21N3O6
Molecular Weight 315.33
AlogP -1.24
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 7.0
Polar Surface Area 150.03
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 22.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Ligand-gated ion channel Ionotropic glutamate receptor NMDA receptor
- - - 7960-7960 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Rett Syndrome 3 D015518 ClinicalTrials
Fragile X Syndrome 2 D005600 ClinicalTrials
Brain Injuries 2 D001930 ClinicalTrials
Brain Concussion 2 D001924 ClinicalTrials
Wounds and Injuries 1 D014947 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL197084
DrugBank DB06045
FDA SRS Z2ME8F52QL
PubChem 11318905
SureChEMBL SCHEMBL1170014
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