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Compound Detail

CHEMBL6041413

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CCOc1c(C(C)n2nc(C)c3c(N)ncnc32)cc(Cl)c(C#N)c1C1CN(C(=O)C(C)(C)O)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6041413
Phase Preclinical
Structure Type MOL
InChI Key YWZBSHAJAYTKLC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

498.0
MW (Da)
2.95
ALogP
9
HBA
2
HBD
143.2
PSA (Ų)
0.53
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28ClN7O3
MW 497.99
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.84

Data from ChEMBL 36 via Core Engine