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Compound Detail

CHEMBL1189132

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COc1ccc2[nH]c(C(=N)NCc3ccccc3OC)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189132
Phase Preclinical
Structure Type MOL
InChI Key YFSMIWZJEOUDHA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

309.4
MW (Da)
3.30
ALogP
3
HBA
3
HBD
70.1
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H19N3O2
MW 309.37
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine