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Compound Detail

CHEMBL1193973

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Cc1c(O)c(O)cc2c1CCNCC2c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193973
Phase Preclinical
Structure Type MOL
InChI Key GNVDGBRXYQPWSR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

269.3
MW (Da)
2.68
ALogP
3
HBA
3
HBD
52.5
PSA (Ų)
0.70
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H19NO2
MW 269.34
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 1.01

Data from ChEMBL 36 via Core Engine