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

Details

Stereochemistry ACHIRAL
Molecular Formula C31H32N4O4
Molecular Weight 524.6102
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VMD-928

SMILES

NC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(NC4=CC=C(C=C4)C(O)=O)C=C1N5CCN(CC5)C6CCCCC6

InChI

InChIKey=YLGUWQFLCMWHDK-UHFFFAOYSA-N
InChI=1S/C31H32N4O4/c32-28-25(35-16-14-34(15-17-35)21-6-2-1-3-7-21)18-24(33-20-12-10-19(11-13-20)31(38)39)26-27(28)30(37)23-9-5-4-8-22(23)29(26)36/h4-5,8-13,18,21,33H,1-3,6-7,14-17,32H2,(H,38,39)

HIDE SMILES / InChI

Molecular Formula C31H32N4O4
Molecular Weight 524.6102
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 14:39:06 GMT 2023
Edited
by admin
on Sat Dec 16 14:39:06 GMT 2023
Record UNII
1JT6DVS51P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VMD-928
Code English
BENZOIC ACID, 4-((4-AMINO-3-(4-CYCLOHEXYL-1-PIPERAZINYL)-9,10-DIHYDRO-9,10-DIOXO-1-ANTHRACENYL)AMINO)-
Common Name English
4-((4-AMINO-3-(4-CYCLOHEXYLPIPERAZIN-1-YL)-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)AMINO)BENZOIC ACID
Common Name English
VMD928
Code English
Classification Tree Code System Code
FDA ORPHAN DRUG 633518
Created by admin on Sat Dec 16 14:39:06 GMT 2023 , Edited by admin on Sat Dec 16 14:39:06 GMT 2023
Code System Code Type Description
FDA UNII
1JT6DVS51P
Created by admin on Sat Dec 16 14:39:06 GMT 2023 , Edited by admin on Sat Dec 16 14:39:06 GMT 2023
PRIMARY
PUBCHEM
91826737
Created by admin on Sat Dec 16 14:39:06 GMT 2023 , Edited by admin on Sat Dec 16 14:39:06 GMT 2023
PRIMARY
CAS
1802770-18-8
Created by admin on Sat Dec 16 14:39:06 GMT 2023 , Edited by admin on Sat Dec 16 14:39:06 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY