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Compound Detail

CHEMBL1182910

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C=C(C[n+]1ccc(-c2cccc(O)c2)cc1)c1ccc(I)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182910
Phase Preclinical
Structure Type MOL
InChI Key FWHAAMZIEXJYLI-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

414.3
MW (Da)
4.66
ALogP
1
HBA
1
HBD
24.1
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H17INO+
MW 414.27
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.22

Data from ChEMBL 36 via Core Engine