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Compound Detail

CHEMBL5937077

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CC(C)(C)c1ccc(CNC(=O)Nc2cccc3[nH]c(=O)[nH]c23)c(N2CCCC2)c1

Basic Information

ChEMBL ID CHEMBL5937077
Phase Preclinical
Structure Type MOL
InChI Key ZCDLCESRZHKZLM-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

407.5
MW (Da)
4.08
ALogP
3
HBA
4
HBD
93.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H29N5O2
MW 407.52
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.50

Activity Summary

IC50 1 meas. best 9.08

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Transient receptor potential cation channel subfamily V member 1
CHEMBL5102
IC50 9.08 9.08 0.8 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine