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Compound Detail

CHEMBL1536835

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CC(C)CCn1nnnc1CN1CCN(c2ccccc2)CC1

Basic Information

ChEMBL ID CHEMBL1536835
Phase Preclinical
Structure Type MOL
InChI Key KRIPUEIIVKBRDC-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

314.4
MW (Da)
2.04
ALogP
6
HBA
0
HBD
50.1
PSA (Ų)
0.82
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H26N6
MW 314.44
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -2.34

Activity Summary

EC50 2 meas. best 4.53

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Insulin-degrading enzyme
CHEMBL1293287
EC50 4.53 4.51 29821.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine