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Compound Detail

CHEMBL284187

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COc1ccccc1N1CCN(CCCCN2C(=O)C3C4C=CC(C5CC45)C3C2=O)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284187
Phase Preclinical
Structure Type MOL
InChI Key YNJVCNKZQNAPMV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

435.6
MW (Da)
2.65
ALogP
5
HBA
0
HBD
53.1
PSA (Ų)
0.37
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H33N3O3
MW 435.57
Aromatic Rings 1
Heavy Atoms 32
NP-Likeness -0.77

Data from ChEMBL 36 via Core Engine