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Compound Detail

CHEMBL3558229

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CC(C)(CN1C(=O)c2ccccc2C1=O)C[N+](C)(C)CCCCCC[N+]1(C)[C@@H]2CC[C@@H]1CC(OC(=O)C(CO)c1ccccc1)C2

Basic Information

ChEMBL ID CHEMBL3558229
Phase Preclinical
Structure Type MOL
InChI Key FFWZAKHCGSHEHR-BPWFWNOOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

633.9
MW (Da)
5.40
ALogP
5
HBA
1
HBD
83.9
PSA (Ų)
0.12
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H55N3O5+2
MW 633.87
Aromatic Rings 2
Heavy Atoms 46
NP-Likeness 0.39

Data from ChEMBL 36 via Core Engine