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Compound Detail

CHEMBL120626

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Cc1cnc2c(N3CCNCC3)nc(Cl)cn12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL120626
Phase Preclinical
Structure Type MOL
InChI Key CYBNMUORLCPDEI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

251.7
MW (Da)
1.10
ALogP
5
HBA
1
HBD
45.5
PSA (Ų)
0.82
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 C11H14ClN5
MW 251.72
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.25

Data from ChEMBL 36 via Core Engine