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Details

Stereochemistry ACHIRAL
Molecular Formula C21H23N3O2
Molecular Weight 349.4262
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BZO-HEXOXIZID

SMILES

CCCCCCN1C(=O)\C(=N/NC(=O)C2=CC=CC=C2)C3=C1C=CC=C3

InChI

InChIKey=ZGQHMZCITJHYOW-QOCHGBHMSA-N
InChI=1S/C21H23N3O2/c1-2-3-4-10-15-24-18-14-9-8-13-17(18)19(21(24)26)22-23-20(25)16-11-6-5-7-12-16/h5-9,11-14H,2-4,10,15H2,1H3,(H,23,25)/b22-19-

HIDE SMILES / InChI

Molecular Formula C21H23N3O2
Molecular Weight 349.4262
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
162.0 nM [Ki]
43.0 nM [Ki]
1.13 µM [Ki]
16.0 nM [Ki]

PubMed

Substance Class Chemical
Record UNII
X83OI5CX2U
Record Status Validated (UNII)
Record Version