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Compound Detail

CHEMBL1197001

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COc1ccc2[nH]c(C(=N)NCc3c(OC)cccc3OC)cc2c1

Basic Information

ChEMBL ID CHEMBL1197001
Phase Preclinical
Structure Type MOL
InChI Key SGCBSFBLWDLENT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

339.4
MW (Da)
3.31
ALogP
4
HBA
3
HBD
79.4
PSA (Ų)
0.48
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 C19H21N3O3
MW 339.40
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.54

Data from ChEMBL 36 via Core Engine