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Compound Detail

CHEMBL2220220

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COC(=O)c1ccc2c(c1)c1nc(N3CCC[C@@H](N)C3)n(Cc3ccccc3Cl)c1c(=O)n2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2220220
Phase Preclinical
Structure Type MOL
InChI Key FPOLFSCTFRBBHI-QGZVFWFLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.0
MW (Da)
3.30
ALogP
8
HBA
1
HBD
95.4
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
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 -1.24

Data from ChEMBL 36 via Core Engine