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Compound Detail

CHEMBL1498522

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COc1ccc(Nc2cc(C)nc3ccccc23)cc1.Cl

Basic Information

ChEMBL ID CHEMBL1498522
Phase Preclinical
Structure Type MOL
InChI Key SUTVURVOSLJDGJ-UHFFFAOYSA-N
Parent Compound CHEMBL1622619
Active Moiety CHEMBL1622619
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

264.3
MW (Da)
4.30
ALogP
3
HBA
1
HBD
34.1
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17ClN2O
MW 300.79
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.08

Data from ChEMBL 36 via Core Engine