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Compound Detail

CHEMBL1740174

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CCN(C[C@H]1N[C@@](Cc2ccccc2)(C(=O)OC)[C@H]2C(=O)N(C)C(=O)[C@@H]12)S(=O)(=O)c1ccc(OC)cc1

Basic Information

ChEMBL ID CHEMBL1740174
Phase Preclinical
Structure Type MOL
InChI Key VVVAUNBJVWFLEY-UXGLMHHASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

529.6
MW (Da)
1.06
ALogP
8
HBA
1
HBD
122.3
PSA (Ų)
0.38
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H31N3O7S
MW 529.62
Aromatic Rings 2
Heavy Atoms 37
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine