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Compound Detail

CHEMBL1186142

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O=C(/C=C/c1ccccn1)NCCCCCC(=O)NO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186142
Phase Preclinical
Structure Type MOL
InChI Key QVOOYKPJQVGLIJ-CMDGGOBGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

277.3
MW (Da)
1.28
ALogP
4
HBA
3
HBD
91.3
PSA (Ų)
0.29
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H19N3O3
MW 277.32
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.71

Data from ChEMBL 36 via Core Engine