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Compound Detail

CHEMBL1196571

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CN(C(=O)COc1cc(Cl)c(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N1CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196571
Phase Preclinical
Structure Type MOL
InChI Key GQBRYJANYDGUOI-IAGOWNOFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

419.8
MW (Da)
4.89
ALogP
3
HBA
0
HBD
32.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H25Cl3N2O2
MW 419.78
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine