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: CN(CC(=O)O)C(=N)NIsomeric SMILES
SMILES: CN(CC(=O)O)C(=N)NSynonyms(20)
creatine57-00-1CreatinN-amidinosarcosineKreatinKrebiozonmethylglycocyamineN-methyl-N-guanylglycineGlycine, N-(aminoiminomethyl)-N-methyl-Pyrolysate(alpha-Methylguanido)acetic acidN-carbamimidoyl-N-methylglycineCosmocair C 100KreatinumNeotine
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Creatine
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