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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H21N5
Molecular Weight 295.3821
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3MB-PP1

SMILES

CC1=CC=CC(CC2=NN(C3=NC=NC(N)=C23)C(C)(C)C)=C1

InChI

InChIKey=FYCOTGCSHZKHPR-UHFFFAOYSA-N
InChI=1S/C17H21N5/c1-11-6-5-7-12(8-11)9-13-14-15(18)19-10-20-16(14)22(21-13)17(2,3)4/h5-8,10H,9H2,1-4H3,(H2,18,19,20)

HIDE SMILES / InChI

Molecular Formula C17H21N5
Molecular Weight 295.3821
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:20:18 GMT 2023
Edited
by admin
on Sat Dec 16 15:20:18 GMT 2023
Record UNII
LP62329LQ7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3MB-PP1
Code English
1-TERT-BUTYL-3-((3-METHYLPHENYL)METHYL)PYRAZOLO(3,4-D)PYRIMIDIN-4-AMINE
Systematic Name English
1H-PYRAZOLO(3,4-D)PYRIMIDIN-4-AMINE, 1-(1,1-DIMETHYLETHYL)-3-((3-METHYLPHENYL)METHYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20647754
Created by admin on Sat Dec 16 15:20:19 GMT 2023 , Edited by admin on Sat Dec 16 15:20:19 GMT 2023
PRIMARY
CAS
956025-83-5
Created by admin on Sat Dec 16 15:20:19 GMT 2023 , Edited by admin on Sat Dec 16 15:20:19 GMT 2023
PRIMARY
PUBCHEM
24865390
Created by admin on Sat Dec 16 15:20:19 GMT 2023 , Edited by admin on Sat Dec 16 15:20:19 GMT 2023
PRIMARY
FDA UNII
LP62329LQ7
Created by admin on Sat Dec 16 15:20:19 GMT 2023 , Edited by admin on Sat Dec 16 15:20:19 GMT 2023
PRIMARY