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Compound Detail

CHEMBL3197130

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COc1cc(/C=N/Nc2nncc3ccccc23)cc(OC)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3197130
Phase Preclinical
Structure Type MOL
InChI Key ILDMLMZWSAVSES-VXLYETTFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
3.10
ALogP
7
HBA
1
HBD
77.9
PSA (Ų)
0.55
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H18N4O3
MW 338.37
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.06

Data from ChEMBL 36 via Core Engine