Crisugabalin
2-[(1S,2S,3R,6S,8S)-2-(aminomethyl)-2-tricyclo[4.2.1.03,8]nonanyl]acetic acid
Molecular Identity
Crisugabalin
2-[(1S,2S,3R,6S,8S)-2-(aminomethyl)-2-tricyclo[4.2.1.03,8]nonanyl]acetic acid
PubChem CID: 139300919
2D Structure
Properties
C12H19NO2
Molecular Formula
209.28
Molecular Weight
g/mol
209.1416
Exact Mass
Da
-0.9
XLogP
Drug-like (Lipinski: < 5)
63.3
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
304
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Crisugabalin2209104-84-5HSK-16149Q3MK7E8686RefChem:1082256HSK16149CrisugabalinaCrisugabalinecrisugabalin [INN]Crisugabalin [WHO-DD]orb1689753CHEMBL5314958SCHEMBL21144566GTPL13764EX-A10679
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Crisugabalin
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