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Compound Detail

CHEMBL4803607

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CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(C)cn2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803607
Phase Preclinical
Structure Type MOL
InChI Key FRYJARBJFRUEJK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

433.5
MW (Da)
2.70
ALogP
8
HBA
3
HBD
131.0
PSA (Ų)
0.52
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23N7O3
MW 433.47
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine