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Compound Detail

CHEMBL4650906

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CN1[C@H](COc2ccc(Cl)nc2)C[C@H]2C[C@H]21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4650906
Phase Preclinical
Structure Type MOL
InChI Key OURWEQSYKPJJJA-ATZCPNFKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

238.7
MW (Da)
2.21
ALogP
3
HBA
0
HBD
25.4
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H15ClN2O
MW 238.72
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.67

Data from ChEMBL 36 via Core Engine