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1GA
FEATURES
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NAMES
  • 1GA
SMILES
C/C1=C\Cc2ccc(cc2)NC/C(C)=C/CC1
InChI
InChI=1S/C16H21N/c1-13-4-3-5-14(2)12-17-16-10-8-15(7-6-13)9-11-16/h5-6,8-11,17H,3-4,7,12H2,1-2H3/b13-6?,14-5+
MOLECULAR FORMULA
C16H21N
CROSS REFERENCES
  • UniChem: 27264667
  • canSAR: 1017423
  • PDBe (Protein Data Bank Europe): 1GA
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1GA

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 227.17
AlogP 4.33
HBond donors 1
HBond acceptors 1
Atoms 38
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 1GA.