Record No. 1 of 1

ID1229
NameAsimilobine
Pubchem ID160875
KEGG IDN/A
SourceNelumbro nucifera
TypeNatural
Function5HT1A Inhibitor
Drug Like PropertiesYes
Molecular Weight267.32
Exact mass267.125929
Molecular formulaC17H17NO2
XlogP2.6
Topological Polar Surface Area41.5
H-Bond Donor2
H-Bond Acceptor3
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O
Isomeric SMILECOC1=C(C=C2CCN[C@H]3C2=C1C4=CC=CC=C4C3)O
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