creatine

Ligand id: 4496

Name: creatine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 90.41
Molecular weight 131.07
XLogP -2.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
2-(1-methylcarbamimidamido)acetic acid
Database Links
CAS Registry No. 57-00-1 (source: Scifinder)
ChEBI CHEBI:16919
ChEMBL Ligand CHEMBL283800
DrugBank Ligand DB00148
GtoPdb PubChem SID 178101224
PubChem CID 586
RCSB PDB Ligand CRN
Search Google for chemical match using the InChIKey CVSVTCORWBXHQV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone CVSVTCORWBXHQV
Search UniChem for chemical match using the InChIKey CVSVTCORWBXHQV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone CVSVTCORWBXHQV
Wikipedia Creatine