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Compound Detail

CHEMBL4803329

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CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnc(OC)cn2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803329
Phase Preclinical
Structure Type MOL
InChI Key GKHGVNLHTJTHHE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

448.5
MW (Da)
3.01
ALogP
8
HBA
3
HBD
127.4
PSA (Ų)
0.48
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H24N6O4
MW 448.48
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.21

Data from ChEMBL 36 via Core Engine