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Compound Detail

CHEMBL5571211

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Cc1ccccc1CO[P@](=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)N[C@@H](C)C(=O)OC(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5571211
Phase Preclinical
Structure Type MOL
InChI Key LKIYKBVQRQNBOW-CJNPLZAGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

504.5
MW (Da)
3.42
ALogP
10
HBA
2
HBD
143.5
PSA (Ų)
0.28
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H33N6O5P
MW 504.53
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.45

Literature References

PubMed DOI Target Context # Activities
38246114 10.1016/j.bmc.2024.117607 Hepatitis B virus 1
38246114 10.1016/j.bmc.2024.117607 HepG2 2.2.15 1

Data from ChEMBL 36 via Core Engine