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Compound Detail

CHEMBL4803984

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CCCNC(=N)Nc1ccc(Cc2ccc(NC3=NCCN3)nc2)cn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803984
Phase Preclinical
Structure Type MOL
InChI Key KRFMDKUGQLNZKI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

352.4
MW (Da)
1.78
ALogP
6
HBA
5
HBD
110.1
PSA (Ų)
0.40
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H24N8
MW 352.45
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine