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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N4O2
Molecular Weight 248.281
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-CYCLOPENTYLTHEOPHYLLINE

SMILES

CN1C2=C(NC(=N2)C3CCCC3)C(=O)N(C)C1=O

InChI

InChIKey=SCVHFRLUNIOSGI-UHFFFAOYSA-N
InChI=1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C12H16N4O2
Molecular Weight 248.281
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
11.0 nM [Ki]
Substance Class Chemical
Record UNII
U7PWT4CPL5
Record Status Validated (UNII)
Record Version