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Compound Detail

CHEMBL1196604

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CN(C)Cc1cc(C(=O)/C=C/c2c(Cl)cccc2Cl)cc(CN(C)C)c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196604
Phase Preclinical
Structure Type MOL
InChI Key BECHAMFDVUEQRA-CMDGGOBGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

407.3
MW (Da)
4.72
ALogP
4
HBA
1
HBD
43.8
PSA (Ų)
0.53
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H24Cl2N2O2
MW 407.34
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.44

Data from ChEMBL 36 via Core Engine