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Compound Detail

CHEMBL141509

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COc1ccc(CCNCC2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL141509
Phase Preclinical
Structure Type MOL
InChI Key FWMGIECEDIUFSN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

399.5
MW (Da)
4.25
ALogP
5
HBA
2
HBD
60.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H33NO4
MW 399.53
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 0.94

Data from ChEMBL 36 via Core Engine