Ligand Id: 733
Ligand name WIN55212-2

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 43.7
Molecular weight 426.19
XLogP 5.94
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Summary Biological activity References Structure Similar ligands (Un)labelled forms
Classification
Compound class Synthetic organic
IUPAC Name
(11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-[(naphthalen-1-yl)carbonyl]-9-oxa-1-azatricyclo[6.3.1.0^{4,12}]dodeca-2,4,6,8(12)-tetraene
Synonyms
(R)-(+)-[2,3-dihydro-5-methyl-3-(4-morpholinylmethyl)pyrrolo-[1,2,3-de]-1,4-benzoxazin-6-yl]-1-naphthalenylmethanone mesylate
(R)-(+)-[2,3-dihydro-5-methyl-3-[(4-morpholino)methyl]pyrrolo-[1,2,3-de]-1,4-benzoxazin-6-yl](1-naphthyl)methanone
W102
Win 55,212
Win 55212-2
Win-55212-2
WIN55,212-2
Database Links
BindingDB Ligand 21281
CAS Registry No. 131543-22-1 (source: Scifinder)
ChEBI CHEBI:474473
ChEMBL Ligand 474473
PubChem CID 5311501
Search Google for chemical match using the InChIKey HQVHOQAKMCMIIM-HXUWFJFHSA-N
Search Google for chemicals with the same backbone HQVHOQAKMCMIIM
Wikipedia WIN_55,212-2
ZINC ZINC25783468

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