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Compound Detail

CHEMBL310923

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CCc1ccccc1Nc1ncnc2[nH]c(C)c(C)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL310923
Phase Preclinical
Structure Type MOL
InChI Key ADOGTKQXVMIGNU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

266.4
MW (Da)
3.88
ALogP
3
HBA
2
HBD
53.6
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18N4
MW 266.35
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.13

Literature References

PubMed DOI Target Context # Activities
8691423 10.1021/jm960118j Epidermal growth factor receptor 1

Data from ChEMBL 36 via Core Engine