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Compound Detail

CHEMBL1179745

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CCN(CC)CC[C@H]1COC(c2ccccc2)(c2ccccc2)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179745
Phase Preclinical
Structure Type MOL
InChI Key OLNWUMKYDNNISB-GHTZIAJQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

339.5
MW (Da)
3.67
ALogP
3
HBA
1
HBD
32.7
PSA (Ų)
0.84
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 C22H29NO2
MW 339.48
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness 0.17

Data from ChEMBL 36 via Core Engine