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Compound Detail

CHEMBL5221289

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CC(C)Oc1ccc(-n2cc(-c3ccc(CN4CC(C(=O)O)C4)cc3)nn2)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221289
Phase Preclinical
Structure Type MOL
InChI Key YVBIGKXRPBJGNR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

426.9
MW (Da)
3.89
ALogP
6
HBA
1
HBD
80.5
PSA (Ų)
0.62
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23ClN4O3
MW 426.90
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.77

Data from ChEMBL 36 via Core Engine