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Compound Detail

CHEMBL97336

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C#CC(C)(C)N1CCN(C(=O)CCC(=O)c2ccc(Cl)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL97336
Phase Preclinical
Structure Type MOL
InChI Key SRUMBDHABCBAMI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

346.9
MW (Da)
2.86
ALogP
3
HBA
0
HBD
40.6
PSA (Ų)
0.61
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23ClN2O2
MW 346.86
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine