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Compound Detail

CHEMBL5189128

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CCCCCCCCCCCOc1cccc(CCC(=O)NC[C@@H](O)COP(=O)(O)OCCNC(C)=O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5189128
Phase Preclinical
Structure Type MOL
InChI Key SBIPNZHRIGJIEI-RUZDIDTESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

558.6
MW (Da)
4.28
ALogP
7
HBA
4
HBD
143.4
PSA (Ų)
0.12
QED
1
Ro5 Violations
23
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H47N2O8P
MW 558.65
Aromatic Rings 1
Heavy Atoms 38
NP-Likeness -0.12

Literature References

PubMed DOI Target Context # Activities
34233115 10.1021/acs.jmedchem.1c00347 Probable G-protein coupled receptor 174 4

Data from ChEMBL 36 via Core Engine