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Compound Detail

CHEMBL1186564

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COc1ccc(-c2cc([C@@H]3C4CCC(C[C@@H]3c3ccc(Cl)cc3)N4C)on2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186564
Phase Preclinical
Structure Type MOL
InChI Key MZBDCJWEXVZTQQ-XFLMMPOFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

408.9
MW (Da)
5.74
ALogP
4
HBA
0
HBD
38.5
PSA (Ų)
0.55
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H25ClN2O2
MW 408.93
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.46

Data from ChEMBL 36 via Core Engine