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Compound Detail

CHEMBL3040775

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CCCCCCCCc1ccc(CO[C@@H]2CN[C@@H](CO)C2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040775
Phase Preclinical
Structure Type MOL
InChI Key PZGMTDCHGJZERG-UXHICEINSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.5
MW (Da)
3.83
ALogP
3
HBA
2
HBD
41.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H33NO2
MW 319.49
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness 0.79

Data from ChEMBL 36 via Core Engine