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Compound Detail

CHEMBL432072

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O=C1c2ccc(O)cc2C23CCCCC2C1N(CC1CCCO1)CC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL432072
Phase Preclinical
Structure Type MOL
InChI Key BSCRKXLANCGZGY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

341.4
MW (Da)
3.27
ALogP
4
HBA
1
HBD
49.8
PSA (Ų)
0.90
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H27NO3
MW 341.45
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 0.76

Data from ChEMBL 36 via Core Engine