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Chemical structure of Rucaparib

GC13249

Rucaparib

Also listed as Rucaparib (free base)

Rucaparib (free base) (AG014699) is an orally active, potent inhibitor of PARP proteins (PARP-1, PARP-2 and PARP-3) with a Ki of 1·4 nM for PARP1· Rucaparib (free base) is a modest hexose-6-phosphate dehydrogenase (H6PD) inhibitor· Rucaparib (free base) has the potential for castration-resistant prostate cancer (CRPC) research

ChemicalCAS283173-50-2MW323.36FormulaC19H18FN3O
CAS number
283173-50-2
Molecular weight
323.36
Formula
C19H18FN3O
Solubility
≥ 16·15mg/mL in DMSO
InChIKey
HMABYWSNWIZPAG-UHFFFAOYSA-N
Catalogue number
GC13249
Brand
GLPBIO
Computed properties PubChem CID 9931954 · XLogP 2.5 · TPSA 56.9 Ų · H-bond donors 3
XLogP
2.5
TPSA
56.9 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
24

SMILES CNCC1=CC=C(C=C1)C2=C3CCNC(=O)C4=C3C(=CC(=C4)F)N2

Computed descriptors from PubChem (CID 9931954), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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