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Compound Detail

CHEMBL1186449

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CN(C)CCOc1ccc(C(=O)N2C/C(=C\c3ccc(Cl)cc3)C(=O)/C(=C/c3ccc(Cl)cc3)C2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186449
Phase Preclinical
Structure Type MOL
InChI Key ZHWGNOZUBOOZNG-WZGDJCGDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

535.5
MW (Da)
6.13
ALogP
4
HBA
0
HBD
49.9
PSA (Ų)
0.34
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H28Cl2N2O3
MW 535.47
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine