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Compound Detail

CHEMBL2219988

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Cn1c(=O)c2c(nc(N3CCC[C@@H](N)C3)n2Cc2ccccc2Cl)c2ccc(CC(=O)O)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2219988
Phase Preclinical
Structure Type MOL
InChI Key YKNZGOSWPPSVJA-QGZVFWFLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.0
MW (Da)
3.14
ALogP
7
HBA
2
HBD
106.4
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H26ClN5O3
MW 479.97
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -1.05

Data from ChEMBL 36 via Core Engine