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Compound Detail

CHEMBL4527014

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CC(C)(N)CCNc1nc(-c2ccncc2)nc2cnccc12

Basic Information

ChEMBL ID CHEMBL4527014
Phase Preclinical
Structure Type MOL
InChI Key BGPYYNGYDSECIG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

308.4
MW (Da)
2.63
ALogP
6
HBA
2
HBD
89.6
PSA (Ų)
0.75
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H20N6
MW 308.39
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.00

Data from ChEMBL 36 via Core Engine