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Compound Detail

CHEMBL1193260

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C#CCNC1CCc2cccc(OC(=O)N(C)CC)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193260
Phase Preclinical
Structure Type MOL
InChI Key CPURZAVPYKEGDF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

272.4
MW (Da)
2.35
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H20N2O2
MW 272.35
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.47

Data from ChEMBL 36 via Core Engine