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Compound Detail

CHEMBL3040069

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CCN1CCC[C@H]1COc1cncc([C@H]2C[C@@H]2CCOC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040069
Phase Preclinical
Structure Type MOL
InChI Key WNSYEOGSYNPFJH-ZVZYQTTQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

304.4
MW (Da)
3.08
ALogP
4
HBA
0
HBD
34.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H28N2O2
MW 304.43
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.15

Data from ChEMBL 36 via Core Engine