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Compound Detail

CHEMBL3765958

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O=C1/C(=C/c2ccc(O)c(CN3CCCC3)c2)CNC/C1=C\c1ccc(O)c(CN2CCCC2)c1

Basic Information

ChEMBL ID CHEMBL3765958
Phase Preclinical
Structure Type MOL
InChI Key LZFQBOCBJMRBRI-RNIAWFEPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

473.6
MW (Da)
3.93
ALogP
6
HBA
3
HBD
76.0
PSA (Ų)
0.55
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 C29H35N3O3
MW 473.62
Aromatic Rings 2
Heavy Atoms 35
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine