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Details

Stereochemistry ACHIRAL
Molecular Formula C40H38F5N3O3S
Molecular Weight 735.805
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RILAPLADIB

SMILES

COCCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C(SCC5=C(F)C(F)=CC=C5)=CC(=O)C6=C4C=CC=C6

InChI

InChIKey=NNBGCSGCRSCFEA-UHFFFAOYSA-N
InChI=1S/C40H38F5N3O3S/c1-51-22-21-46-19-17-32(18-20-46)47(24-27-9-11-28(12-10-27)29-13-15-31(16-14-29)40(43,44)45)37(50)25-48-35-8-3-2-6-33(35)36(49)23-38(48)52-26-30-5-4-7-34(41)39(30)42/h2-16,23,32H,17-22,24-26H2,1H3

HIDE SMILES / InChI

Molecular Formula C40H38F5N3O3S
Molecular Weight 735.805
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 Fri Dec 15 16:31:10 UTC 2023
Edited
by admin
on Fri Dec 15 16:31:10 UTC 2023
Record UNII
O14CWE893Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RILAPLADIB
INN   USAN  
INN   USAN  
Official Name English
SB-659032
Code English
RILAPLADIB [USAN]
Common Name English
rilapladib [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29703
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C76401
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
INN
8704
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
FDA UNII
O14CWE893Z
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
PUBCHEM
9918381
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
EVMPD
SUB64595
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
ChEMBL
CHEMBL2104981
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
DRUG BANK
DB05119
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
CAS
412950-08-4
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
SMS_ID
100000134795
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID50194281
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
USAN
RR-58
Created by admin on Fri Dec 15 16:31:10 UTC 2023 , Edited by admin on Fri Dec 15 16:31:10 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY