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Compound Detail

CHEMBL6992

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CN1CCN(c2cnc3cc(Cl)ccc3n2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6992
Phase Preclinical
Structure Type MOL
InChI Key CSBHRDWXCQKDLZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

262.7
MW (Da)
2.04
ALogP
4
HBA
0
HBD
32.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H15ClN4
MW 262.74
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.95

Data from ChEMBL 36 via Core Engine