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Compound Detail

CHEMBL1963614

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COc1ccc(-n2nnnc2C(F)(F)F)cc1CN[C@H]1CCN(C(=O)N(C)C)C[C@H]1c1ccccc1

Basic Information

ChEMBL ID CHEMBL1963614
Phase Preclinical
Structure Type MOL
InChI Key SXOAVORWRVYTGL-PMACEKPBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

503.5
MW (Da)
3.32
ALogP
7
HBA
1
HBD
88.4
PSA (Ų)
0.56
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28F3N7O2
MW 503.53
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -1.53

Data from ChEMBL 36 via Core Engine