Molecular Identity
creatine
2-[carbamimidoyl(methyl)amino]acetic acid
PubChem CID: 586
Creatine is a glycine derivative having methyl and amidino groups attached to the nitrogen. It has a role as a geroprotector, a nutraceutical, a neuroprotective agent, a mouse metabolite and a human metabolite. It is a glycine derivative and a member of guanidines. It is a conjugate acid of a creatinate. It is a tautomer of a creatine zwitterion.
2D Structure
Properties
C4H9N3O2
Molecular Formula
131.13
Molecular Weight
g/mol
131.0695
Exact Mass
Da
-1.2
XLogP
Drug-like (Lipinski: < 5)
90.4
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
3
H-Bond Acceptors
134
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
creatine57-00-1CreatinN-amidinosarcosineKreatinKrebiozonN-methyl-N-guanylglycinemethylglycocyamineGlycine, N-(aminoiminomethyl)-N-methyl-(alpha-Methylguanido)acetic acidPyrolysate2-(1-methylcarbamimidamido)acetic acidCosmocair C 100N-carbamimidoyl-N-methylglycineKreatinum
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to creatine
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