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Compound Detail

CHEMBL3891385

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CC(N)c1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3891385
Phase Preclinical
Structure Type MOL
InChI Key KHSYYLCXQKCYQX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

171.2
MW (Da)
2.86
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.70
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 C12H13N
MW 171.24
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -0.38

Data from ChEMBL 36 via Core Engine