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Compound Detail

CHEMBL5984528

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COc1c(C(C)n2nc(C)c3c(N)ncnc32)cc(Cl)c(C#N)c1C1CN(C(=O)NC(C)(C)C)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5984528
Phase Preclinical
Structure Type MOL
InChI Key NGSFHDXBDLNNPM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

497.0
MW (Da)
3.77
ALogP
8
HBA
2
HBD
135.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H29ClN8O2
MW 497.00
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -1.10

Data from ChEMBL 36 via Core Engine