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Compound Detail

CHEMBL5793038

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Cc1[nH]c(-c2cccc3ccccc23)c2c1C(=O)CCC2

Basic Information

ChEMBL ID CHEMBL5793038
Phase Preclinical
Structure Type MOL
InChI Key WDQNILVOGXOEAK-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

275.4
MW (Da)
4.66
ALogP
1
HBA
1
HBD
32.9
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17NO
MW 275.35
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.24

Activity Summary

Ki 1 meas. best 6.03

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Bromodomain-containing protein 4
CHEMBL1163125
Ki 6.03 6.03 943.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine