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Compound Detail

CHEMBL39691

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CN[C@H]1CC[C@@H](c2ccc(Cl)cc2Cl)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL39691
Phase Preclinical
Structure Type MOL
InChI Key WIRYELRBPYAMBW-DYVFJYSZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

306.2
MW (Da)
5.18
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.81
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17Cl2N
MW 306.24
Aromatic Rings 2
Heavy Atoms 20

Data from ChEMBL 36 via Core Engine