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Compound Detail

CHEMBL4650901

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Clc1cncc(OC[C@@H]2CC[C@H]3C[C@H]3N2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4650901
Phase Preclinical
Structure Type MOL
InChI Key BIERIKWXCCJADR-PTOFAABTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

238.7
MW (Da)
2.25
ALogP
3
HBA
1
HBD
34.1
PSA (Ų)
0.88
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 0.35

Data from ChEMBL 36 via Core Engine