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Compound Detail

CHEMBL3594503

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CNC(=O)[C@@H]1CNCCO[C@H]1c1ccc(Cl)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3594503
Phase Preclinical
Structure Type MOL
InChI Key RMDGDCHEMHTCTH-SKDRFNHKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

303.2
MW (Da)
2.02
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.88
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 C13H16Cl2N2O2
MW 303.19
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.35

Data from ChEMBL 36 via Core Engine