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Compound Detail

CHEMBL4438314

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O=C(O)C(Cn1cnc2ccccc21)P(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4438314
Phase Preclinical
Structure Type MOL
InChI Key LQZXULNZTSCOBJ-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

270.2
MW (Da)
0.67
ALogP
4
HBA
3
HBD
112.7
PSA (Ų)
0.70
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H11N2O5P
MW 270.18
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.75

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
31699606 10.1016/j.bmcl.2019.126757 Geranylgeranyl transferase type-2 7
31699606 10.1016/j.bmcl.2019.126757 Farnesyl pyrophosphate synthase 3
31699606 10.1016/j.bmcl.2019.126757 Protein farnesyltransferase 2
31699606 10.1016/j.bmcl.2019.126757 Geranylgeranyl transferase type I 1
31699606 10.1016/j.bmcl.2019.126757 Geranylgeranyl pyrophosphate synthase 1
31699606 10.1016/j.bmcl.2019.126757 geranylgeranyltransferase type-I 1

Data from ChEMBL 36 via Core Engine