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Compound Detail

CHEMBL1194129

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CC1=C(CC2=NCCN2)Cc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194129
Phase Preclinical
Structure Type MOL
InChI Key IAAPCMDPYJWYNE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

212.3
MW (Da)
2.41
ALogP
2
HBA
1
HBD
24.4
PSA (Ų)
0.80
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H16N2
MW 212.30
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.17

Data from ChEMBL 36 via Core Engine