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Compound Detail

CHEMBL1189264

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c1cc(OCCN2CCOCC2)cc(-c2nc(N3CCOCC3)c3oc4ncccc4c3n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189264
Phase Preclinical
Structure Type MOL
InChI Key HXFUIPAMECNQOQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

461.5
MW (Da)
2.99
ALogP
9
HBA
0
HBD
86.0
PSA (Ų)
0.43
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 C25H27N5O4
MW 461.52
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -1.49

Data from ChEMBL 36 via Core Engine