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Compound Detail

CHEMBL3545942

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CC[C@@H]1CO[C@H](CC(=O)O)CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3545942
Phase Preclinical
Structure Type MOL
InChI Key HVQPRKAGYIETEV-RNFRBKRXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

173.2
MW (Da)
0.23
ALogP
3
HBA
2
HBD
58.6
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H15NO3
MW 173.21
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness 1.16

Data from ChEMBL 36 via Core Engine