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Compound Detail

CHEMBL1190045

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Oc1noc(C2CCNCC2)c1CCCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190045
Phase Preclinical
Structure Type MOL
InChI Key MWOXWCPESBQMBA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

286.4
MW (Da)
3.02
ALogP
4
HBA
2
HBD
58.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H22N2O2
MW 286.37
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness 0.10

Data from ChEMBL 36 via Core Engine