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Compound Detail

CHEMBL1196365

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CN1c2cccc(Cl)c2CC1C1=NCCN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196365
Phase Preclinical
Structure Type MOL
InChI Key AGODGIIHDUBDST-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

235.7
MW (Da)
1.70
ALogP
3
HBA
1
HBD
27.6
PSA (Ų)
0.80
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 C12H14ClN3
MW 235.72
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine