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Details

Stereochemistry ACHIRAL
Molecular Formula C25H18N4O3
Molecular Weight 422.4354
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-0873

SMILES

[O-][N+]1=CC=CC(=C1)C#CC2=CC(=CC=C2)N3C=C(C(=O)NC4CC4)C(=O)C5=C3N=CC=C5

InChI

InChIKey=JJWKQXNHYDJXKF-UHFFFAOYSA-N
InChI=1S/C25H18N4O3/c30-23-21-7-2-12-26-24(21)29(16-22(23)25(31)27-19-10-11-19)20-6-1-4-17(14-20)8-9-18-5-3-13-28(32)15-18/h1-7,12-16,19H,10-11H2,(H,27,31)

HIDE SMILES / InChI

Molecular Formula C25H18N4O3
Molecular Weight 422.4354
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 15:46:39 UTC 2023
Edited
by admin
on Fri Dec 15 15:46:39 UTC 2023
Record UNII
K4KAC9XCCO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MK-0873
Common Name English
N-CYCLOPROPYL-1-(3-((1-OXIDOPYRIDIN-3-YL)ETHYNYL)PHENYL)-1,4-DIHYDRO(1,8)NAPHTHYRIDIN-4-ONE-3-CARBOXAMIDE
Common Name English
1,8-NAPHTHYRIDINE-3-CARBOXAMIDE, N-CYCLOPROPYL-1,4-DIHYDRO-1-(3-((1-OXIDO-3-PYRIDINYL)ETHYNYL)PHENYL)-4-OXO-
Systematic Name English
MK0873
Code English
Code System Code Type Description
PUBCHEM
9919680
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
CAS
500355-52-2
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID80198191
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
SMS_ID
300000041497
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
DRUG BANK
DB13029
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
FDA UNII
K4KAC9XCCO
Created by admin on Fri Dec 15 15:46:39 UTC 2023 , Edited by admin on Fri Dec 15 15:46:39 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY