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Compound Detail

CHEMBL2219571

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CCCCCOc1nc2ccccc2cc1C(O)CCCCCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2219571
Phase Preclinical
Structure Type MOL
InChI Key SNADZOMJIROEOR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

359.5
MW (Da)
4.87
ALogP
4
HBA
2
HBD
79.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H29NO4
MW 359.47
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness 0.01

Data from ChEMBL 36 via Core Engine