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Compound Detail

CHEMBL2110053

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O=C(O)[C@H]1CCCN(CCOC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2110053
Phase Preclinical
Structure Type MOL
InChI Key UFHSGXOXBRCZTN-KRWDZBQOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

408.3
MW (Da)
4.90
ALogP
3
HBA
1
HBD
49.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H23Cl2NO3
MW 408.33
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.80

Data from ChEMBL 36 via Core Engine