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Compound Detail

CHEMBL1622470

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C[N+]1(CC(COCc2ccccc2)OC(=O)Cc2ccccc2)CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1622470
Phase Preclinical
Structure Type MOL
InChI Key RWEJQWANTQCRPK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

384.5
MW (Da)
2.83
ALogP
4
HBA
0
HBD
44.8
PSA (Ų)
0.49
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 C23H30NO4+
MW 384.50
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.09

Data from ChEMBL 36 via Core Engine