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Compound Detail

CHEMBL2221220

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NCCCNCCCCNCCCNCc1ccc(OC2=CC(=O)c3ccccc3C2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2221220
Phase Preclinical
Structure Type MOL
InChI Key KCBBPLUDKJETRJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

464.6
MW (Da)
2.82
ALogP
7
HBA
4
HBD
105.5
PSA (Ų)
0.28
QED
0
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H36N4O3
MW 464.61
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness 0.25

Data from ChEMBL 36 via Core Engine