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Compound Detail

CHEMBL4300037

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CCCCCCCCc1ccc(CC(=O)[C@@H]2C[C@@H](O)CN2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300037
Phase Preclinical
Structure Type MOL
InChI Key UFFLGOHQTOSSMC-MOPGFXCFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

317.5
MW (Da)
3.42
ALogP
3
HBA
2
HBD
49.3
PSA (Ų)
0.65
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H31NO2
MW 317.47
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness 0.50

Data from ChEMBL 36 via Core Engine