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Compound Detail

CHEMBL1190074

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O=C(O)[C@@H]1CCCN(CCCCCCCCN(c2ccccc2)c2ccccc2)C1

Basic Information

ChEMBL ID CHEMBL1190074
Phase Preclinical
Structure Type MOL
InChI Key JKMSCFQROYTOOZ-HSZRJFAPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

408.6
MW (Da)
5.96
ALogP
3
HBA
1
HBD
43.8
PSA (Ų)
0.44
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H36N2O2
MW 408.59
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.71

Data from ChEMBL 36 via Core Engine