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Compound Detail

CHEMBL5221228

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CCC1NCCc2c1[nH]c1ccc(O)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221228
Phase Preclinical
Structure Type MOL
InChI Key JYRSBENZEDBDCG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

216.3
MW (Da)
2.47
ALogP
2
HBA
3
HBD
48.0
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H16N2O
MW 216.28
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness 1.11

Data from ChEMBL 36 via Core Engine