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Compound Detail

CHEMBL4284405

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O=C(O)c1ccnc(-c2cn(CCN3Cc4cccc(Cl)c4C3)cn2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4284405
Phase Preclinical
Structure Type MOL
InChI Key BXYJBQPBSKKOAB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.8
MW (Da)
3.31
ALogP
5
HBA
1
HBD
71.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17ClN4O2
MW 368.82
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.18

Data from ChEMBL 36 via Core Engine