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Compound Detail

CHEMBL2027944

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CC#CCN(C)Cc1cc2cc(OCc3ccccc3)ccc2n1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2027944
Phase Preclinical
Structure Type MOL
InChI Key VGRCPBXRHAYOKK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
4.21
ALogP
3
HBA
0
HBD
17.4
PSA (Ų)
0.63
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 C22H24N2O
MW 332.45
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.69

Data from ChEMBL 36 via Core Engine