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Compound Detail

CHEMBL1194169

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O=C(O)[C@@H]1CCCN(CCOCCN2c3cc(Cl)ccc3CCc3ccc(Cl)cc32)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194169
Phase Preclinical
Structure Type MOL
InChI Key SFXNBCLCFHXQSF-LJQANCHMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

463.4
MW (Da)
5.04
ALogP
4
HBA
1
HBD
53.0
PSA (Ų)
0.58
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28Cl2N2O3
MW 463.41
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.92

Data from ChEMBL 36 via Core Engine