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Compound Detail

CHEMBL4650636

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CCCCCCCCCCCCOC(=O)Oc1ccc(COP(=O)(OCc2ccc(OC(=O)OCCCC)cc2)OP(=O)(O)OP(=O)(O)OC[C@@H]2C=C[C@H](n3cc(C)c(=O)[nH]c3=O)O2)cc1

Basic Information

ChEMBL ID CHEMBL4650636
Phase Preclinical
Structure Type MOL
InChI Key GQSMLXLFQOMLLU-PTKNZDETSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

988.9
MW (Da)
9.84
ALogP
18
HBA
3
HBD
273.0
PSA (Ų)
0.02
QED
3
Ro5 Violations
30
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C42H59N2O19P3
MW 988.85
Aromatic Rings 3
Heavy Atoms 66
NP-Likeness 0.37

Data from ChEMBL 36 via Core Engine