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Compound Detail

CHEMBL2220988

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NCCCNCCCNCCCNCc1ccc(OC2=CC(=O)c3cc4ccccc4cc3C2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2220988
Phase Preclinical
Structure Type MOL
InChI Key NEWYRJBENXEZLC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

500.6
MW (Da)
3.58
ALogP
7
HBA
4
HBD
105.5
PSA (Ų)
0.24
QED
1
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H36N4O3
MW 500.64
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness 0.27

Data from ChEMBL 36 via Core Engine