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Compound Detail

CHEMBL1889188

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COc1cc2c(cc1OC)-c1cc(NC(C)c3ccccc3)nc(=O)n1CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1889188
Phase Preclinical
Structure Type MOL
InChI Key HQEBDFUASOJPSD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
3.66
ALogP
6
HBA
1
HBD
65.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C22H23N3O3
MW 377.44
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.49

Data from ChEMBL 36 via Core Engine