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Compound Detail

CHEMBL3896789

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O=C1NCC(C2CCCCC2)N1c1ccc2nc[nH]c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3896789
Phase Preclinical
Structure Type MOL
InChI Key FCBIEHRSWNOZRH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

284.4
MW (Da)
3.04
ALogP
2
HBA
2
HBD
61.0
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H20N4O
MW 284.36
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine