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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H15FN4O
Molecular Weight 298.3149
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PAMIPARIB

SMILES

C[C@]12CCCN1CC3=NNC(=O)C4=C5C(NC2=C35)=CC(F)=C4

InChI

InChIKey=DENYZIUJOTUUNY-MRXNPFEDSA-N
InChI=1S/C16H15FN4O/c1-16-3-2-4-21(16)7-11-13-12-9(15(22)20-19-11)5-8(17)6-10(12)18-14(13)16/h5-6,18H,2-4,7H2,1H3,(H,20,22)/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H15FN4O
Molecular Weight 298.3149
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
0.83 nM [IC50]
0.11 nM [IC50]

PubMed

Patents

Substance Class Chemical
Record UNII
8375F9S90C
Record Status Validated (UNII)
Record Version