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Compound Detail

CHEMBL1182547

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C[N+]1(C)CC2CC1CN2c1ccc(Cl)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182547
Phase Preclinical
Structure Type MOL
InChI Key HBGYGDPEMJQNII-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

238.7
MW (Da)
1.77
ALogP
2
HBA
0
HBD
16.1
PSA (Ų)
0.55
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H17ClN3+
MW 238.74
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.47

Data from ChEMBL 36 via Core Engine