PARPI

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UKNOWN
UNII: OWV057OPZ3

Structure
InChI Key LTZZZXXIKHHTMO-UHFFFAOYSA-N
Smile O=C(c1ccc(F)cc1)N1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)CC1
InChI
InChI=1S/C27H22F2N4O3/c28-19-8-6-18(7-9-19)26(35)32-11-13-33(14-12-32)27(36)22-15-17(5-10-23(22)29)16-24-20-3-1-2-4-21(20)25(34)31-30-24/h1-10,15H,11-14,16H2,(H,31,34)

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H22F2N4O3
Molecular Weight 488.49
AlogP 3.39
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 86.37
Molecular species NEUTRAL
Aromatic Rings 4.0
Heavy Atoms 36.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4650351
FDA SRS OWV057OPZ3
CONTENTS