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Compound Detail

CHEMBL5792812

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O=C(O)c1ccncc1NCC1CCc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5792812
Phase Preclinical
Structure Type MOL
InChI Key DOXATKGVGAODPB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

268.3
MW (Da)
2.92
ALogP
3
HBA
2
HBD
62.2
PSA (Ų)
0.89
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16N2O2
MW 268.32
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.41

Data from ChEMBL 36 via Core Engine