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Compound Detail

CHEMBL1789442

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CCN(CC)c1ccc2nc3c4ccccc4/c(=N/c4ccc(C)cc4)cc-3oc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789442
Phase Preclinical
Structure Type MOL
InChI Key QEUAYXZPFJSYLQ-ZZIIXHQDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

407.5
MW (Da)
6.47
ALogP
4
HBA
0
HBD
41.6
PSA (Ų)
0.25
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H25N3O
MW 407.52
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.04

Data from ChEMBL 36 via Core Engine