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Compound Detail

CHEMBL284907

ELMUSTINE
🧪 Phase II
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🧪 Phase II
O=NN(CCCl)C(=O)NCCO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284907
Name ELMUSTINE
Phase Phase II
Structure Type MOL
InChI Key YJZJEQBSODVMTH-UHFFFAOYSA-N

Known Names

Elmustina Elmustine NSC-294895
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
3
Known Names

Molecular Properties

195.6
MW (Da)
-0.09
ALogP
4
HBA
2
HBD
82.0
PSA (Ų)
0.37
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Stem -mustine

Extended Properties

Molecular Formula C5H10ClN3O3
MW 195.61
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness -0.31

Literature References

PubMed DOI Target Context # Activities
6492072 10.1021/jm00377a008 Mus musculus 3
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] A 1
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] B 1

Data from ChEMBL 36 via Core Engine