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Compound Detail

CHEMBL4302815

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

Basic Information

ChEMBL ID CHEMBL4302815
Phase Preclinical
Structure Type MOL
InChI Key VUDYMPOUZYCRDW-MSOLQXFVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

303.4
MW (Da)
3.50
ALogP
3
HBA
2
HBD
49.3
PSA (Ų)
0.54
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H29NO2
MW 303.45
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness 0.46

Data from ChEMBL 36 via Core Engine