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Compound Detail

CHEMBL4596881

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CC(C)(C)CNc1nccc(N2CC[C@@H](N)C2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596881
Phase Preclinical
Structure Type MOL
InChI Key XOGNVWVGXPSTMU-SNVBAGLBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

249.4
MW (Da)
1.47
ALogP
5
HBA
2
HBD
67.1
PSA (Ų)
0.85
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H23N5
MW 249.36
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.47

Data from ChEMBL 36 via Core Engine