AB-MECA

Ligand id: 416

Name: AB-MECA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 5
Rotatable bonds 6
Topological polar surface area 160.44
Molecular weight 399.17
XLogP 0.2
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S,3S,4R,5R)-5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
Database Links
CAS Registry No. 152918-26-8 (source: Scifinder)
PubChem CID 5310992
Search Google for chemical match using the InChIKey LDYMCRRFCMRFKB-MOROJQBDSA-N
Search Google for chemicals with the same backbone LDYMCRRFCMRFKB
Search UniChem for chemical match using the InChIKey LDYMCRRFCMRFKB-MOROJQBDSA-N
Search UniChem for chemicals with the same backbone LDYMCRRFCMRFKB