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Compound Detail

CHEMBL1536198

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COc1ccc(CCN(C)CCCN2CC(c3ccccc3)CC2=O)cc1OC.O=C(O)C(=O)O

Basic Information

ChEMBL ID CHEMBL1536198
Phase Preclinical
Structure Type MOL
InChI Key GOJSLQKBJLJWJC-UHFFFAOYSA-N
Parent Compound CHEMBL1623284
Active Moiety CHEMBL1623284
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

396.5
MW (Da)
3.58
ALogP
4
HBA
0
HBD
42.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H34N2O7
MW 486.57
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine