AMN082   Click here for help

GtoPdb Ligand ID: 1441

Synonyms: AMN 082 | AMN-082
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 24.06
Molecular weight 392.23
XLogP 6.01
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES C(NC(c1ccccc1)c1ccccc1)CNC(c1ccccc1)c1ccccc1
Isomeric SMILES C(NC(c1ccccc1)c1ccccc1)CNC(c1ccccc1)c1ccccc1
InChI InChI=1S/C28H28N2/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)29-21-22-30-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-30H,21-22H2
InChI Key DTZDSNQYNPNCPK-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
N,N'-bis[di(phenyl)methyl]ethane-1,2-diamine
Synonyms Click here for help
AMN 082 | AMN-082
Database Links Click here for help
BindingDB Ligand 58360
CAS Registry No. 97075-46-2 (source: Scifinder)
ChEMBL Ligand CHEMBL1387826
GtoPdb PubChem SID 135649940
PubChem CID 1894361
Search Google for chemical match using the InChIKey DTZDSNQYNPNCPK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DTZDSNQYNPNCPK
UniChem Compound Search for chemical match using the InChIKey DTZDSNQYNPNCPK-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey DTZDSNQYNPNCPK-UHFFFAOYSA-N
Wikipedia AMN082