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Compound Detail

CHEMBL1604097

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O=C(COc1ccc(Cl)cc1Cl)c1ccc[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1604097
Phase Preclinical
Structure Type MOL
InChI Key SXDMTLDFXRWOAI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

270.1
MW (Da)
3.58
ALogP
2
HBA
1
HBD
42.1
PSA (Ų)
0.86
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 C12H9Cl2NO2
MW 270.12
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.53

Data from ChEMBL 36 via Core Engine