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Compound Detail

CHEMBL5768185

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CCO[C@@H](Cc1ccc(OC[C@H](O)c2cccc(CO)c2)cc1)C(=O)N(C)OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5768185
Phase Preclinical
Structure Type MOL
InChI Key FJXWUXJKXXSRCI-SFTDATJTSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

403.5
MW (Da)
2.26
ALogP
6
HBA
2
HBD
88.5
PSA (Ų)
0.56
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H29NO6
MW 403.48
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.13

Activity Summary

IC50 1 meas.

Data from ChEMBL 36 via Core Engine