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Compound Detail

CHEMBL1182629

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CN(CCCN(C)CCCC(O)(c1ccccc1)c1ccccc1)CCCC(O)(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182629
Phase Preclinical
Structure Type MOL
InChI Key ORKIMQYINJNMRH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

550.8
MW (Da)
6.67
ALogP
4
HBA
2
HBD
46.9
PSA (Ų)
0.16
QED
2
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C37H46N2O2
MW 550.79
Aromatic Rings 4
Heavy Atoms 41
NP-Likeness -0.24

Data from ChEMBL 36 via Core Engine