U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H15FN4O
Molecular Weight 346.3577
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-06445974

SMILES

FC1=CC(=CC=C1C#N)C2=C3N(CCN(C4CC4)C3=O)C5=C2N=CC=C5

InChI

InChIKey=YWTCDMZVTLNYLN-UHFFFAOYSA-N
InChI=1S/C20H15FN4O/c21-15-10-12(3-4-13(15)11-22)17-18-16(2-1-7-23-18)25-9-8-24(14-5-6-14)20(26)19(17)25/h1-4,7,10,14H,5-6,8-9H2

HIDE SMILES / InChI

Molecular Formula C20H15FN4O
Molecular Weight 346.3577
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:05:01 UTC 2023
Edited
by admin
on Sat Dec 16 12:05:01 UTC 2023
Record UNII
LDJ6344143
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-06445974
Code English
BENZONITRILE, 4-(8-CYCLOPROPYL-6,7,8,9-TETRAHYDRO-9-OXOPYRIDO(2',3':4,5)PYRROLO(1,2-A)PYRAZIN-10-YL)-2-FLUORO-
Systematic Name English
Code System Code Type Description
CAS
2055776-17-3
Created by admin on Sat Dec 16 12:05:01 UTC 2023 , Edited by admin on Sat Dec 16 12:05:01 UTC 2023
PRIMARY
FDA UNII
LDJ6344143
Created by admin on Sat Dec 16 12:05:01 UTC 2023 , Edited by admin on Sat Dec 16 12:05:01 UTC 2023
PRIMARY
PUBCHEM
124141261
Created by admin on Sat Dec 16 12:05:01 UTC 2023 , Edited by admin on Sat Dec 16 12:05:01 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IC50
TARGET -> INHIBITOR
IC50
TARGET -> INHIBITOR
IC50
TARGET -> INHIBITOR
IC50