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Compound Detail

CHEMBL4300640

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COc1cc2c(cc1OC)C1C(CO)COC(=N)N1CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300640
Phase Preclinical
Structure Type MOL
InChI Key PNWPTROUIPVWPY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

292.3
MW (Da)
1.18
ALogP
5
HBA
2
HBD
75.0
PSA (Ų)
0.87
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H20N2O4
MW 292.34
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.90

Data from ChEMBL 36 via Core Engine