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Compound Detail

CHEMBL3139571

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CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1

Basic Information

ChEMBL ID CHEMBL3139571
Phase Preclinical
Structure Type MOL
InChI Key DZVQJHYBCIMRMK-NRFANRHFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

408.6
MW (Da)
5.26
ALogP
6
HBA
0
HBD
52.4
PSA (Ų)
0.46
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H32N4O2
MW 408.55
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine