BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1746
NameCID16680695
Pubchem ID16680695
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight322.23
Exact mass321.079953
Molecular formulaC16H17Cl2N3
XlogPN/A
Topological Polar Surface Area50.9
H-Bond Donor4
H-Bond Acceptor3
Rotational Bond Count3
IUPAC NameN'-benzylisoquinoline-1,7-diamine dihydrochloride
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC1=CC=C(C=C1)CNC2=CC3=C(C=C2)C=CN=C3N.Cl.Cl
Isomeric SMILEN/A
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