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Compound Detail

CHEMBL1195565

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CCC1(CO)COC(CC(=O)O)CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195565
Phase Preclinical
Structure Type MOL
InChI Key YADOKCLZAIDRMN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

203.2
MW (Da)
-0.41
ALogP
4
HBA
3
HBD
78.8
PSA (Ų)
0.58
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H17NO4
MW 203.24
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 1.05

Data from ChEMBL 36 via Core Engine