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Compound Detail

CHEMBL1186254

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CCN(CC)CCNC(=O)c1ccc(I)c2cc3ccccc3nc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186254
Phase Preclinical
Structure Type MOL
InChI Key YINZEKFSQJPJBB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

447.3
MW (Da)
4.06
ALogP
3
HBA
1
HBD
45.2
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22IN3O
MW 447.32
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.36

Data from ChEMBL 36 via Core Engine