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Compound Detail

CHEMBL460283

MANNOMUSTINE
🧪 Phase II
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🧪 Phase II
O[C@@H]([C@H](O)[C@H](O)CNCCCl)[C@H](O)CNCCCl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL460283
Name MANNOMUSTINE
Phase Phase II
Structure Type MOL
InChI Key MQXVYODZCMMZEM-ZYUZMQFOSA-N

Known Names

BCM Degranol chinoin Mannitol mustard dihydrochloride Mannomustine Mannomustine dihydrochloride Mannomustine hydrochloride Manomustina NSC-9698 NSC-9698 FREE BASE
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
9
Known Names

Molecular Properties

305.2
MW (Da)
-1.91
ALogP
6
HBA
6
HBD
105.0
PSA (Ų)
0.20
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer
USAN Stem -mustine

Extended Properties

Molecular Formula C10H22Cl2N2O4
MW 305.20
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 0.47

Literature References

PubMed DOI Target Context # Activities
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