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Compound Detail

CHEMBL1623084

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CCCCCCCCn1c2c(c(=N)c3ccccc31)CCC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1623084
Phase Preclinical
Structure Type MOL
InChI Key ARMSHPQLBWTDEC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

296.5
MW (Da)
4.97
ALogP
2
HBA
1
HBD
28.8
PSA (Ų)
0.70
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H28N2
MW 296.46
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.47

Data from ChEMBL 36 via Core Engine