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Compound Detail

CHEMBL3546082

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CN(C)C1=Nc2cccc3cccc(c23)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3546082
Phase Preclinical
Structure Type MOL
InChI Key UGSSZKYLHJGRIO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

211.3
MW (Da)
2.81
ALogP
3
HBA
1
HBD
27.6
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H13N3
MW 211.27
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.40

Data from ChEMBL 36 via Core Engine