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Compound Detail

CHEMBL1269036

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CN1CCN(C2=CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1269036
Phase Preclinical
Structure Type MOL
InChI Key OFBOOQQXKXQESS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

305.8
MW (Da)
1.34
ALogP
4
HBA
0
HBD
43.9
PSA (Ų)
0.77
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 C15H16ClN3O2
MW 305.77
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -1.00

Literature References

PubMed DOI Target Context # Activities
20933419 10.1016/j.bmcl.2010.09.046 Bcl-2-related protein A1 2

Data from ChEMBL 36 via Core Engine