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Compound Detail

CHEMBL1190891

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COc1cccc(-c2nc(CN(C)Cc3ccccc3)c[nH]2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190891
Phase Preclinical
Structure Type MOL
InChI Key SPRWFPWRLMRUIZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

337.4
MW (Da)
3.73
ALogP
4
HBA
1
HBD
50.4
PSA (Ų)
0.71
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23N3O2
MW 337.42
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine