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Compound Detail

CHEMBL1194533

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O=C(OC1CCNCC1)n1c(=O)[nH]c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194533
Phase Preclinical
Structure Type MOL
InChI Key HFLYSOMIOVWLNB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

261.3
MW (Da)
1.07
ALogP
5
HBA
2
HBD
76.1
PSA (Ų)
0.80
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 C13H15N3O3
MW 261.28
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.18

Data from ChEMBL 36 via Core Engine