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Compound Detail

CHEMBL1201369

GTP
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Nc1nc(=O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@H]3O)c2[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1201369
Name GTP
Phase Preclinical
Structure Type MOL
InChI Key XKMLYUALXHKNFT-FJFJXFQQSA-N

Known Names

9beta-d-arabinofuranosylguanosine 5'-triphosphate Gtp
0
Targets
2
Activities
2
Assay Types
1
PK Parameters
7
Publications
2
Known Names

Molecular Properties

523.2
MW (Da)
-2.34
ALogP
14
HBA
8
HBD
299.1
PSA (Ų)
0.17
QED
3
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Single Enantiomer

Flags

Natural Product

Extended Properties

Molecular Formula C10H16N5O14P3
MW 523.18
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness 1.23

Activity Summary

IC50 1 meas.
Ki 1 meas.

Pharmacokinetic Data

Parameter Value Units Species
KA 57.0 uM Trypanosoma brucei

Literature References

PubMed DOI Target Context # Activities
20145089 10.1128/aac.01444-09 Unchecked 9
21840216 10.1016/j.bmcl.2011.07.054 Unchecked 9
23050700 10.1021/jm3012728 Cell division protein FtsZ 2
458818 10.1021/jm00192a005 Thymidine kinase, cytosolic 2
23050700 10.1021/jm3012728 Unchecked 1
458818 10.1021/jm00192a005 Thymidine kinase 2, mitochondrial 1
24900835 10.1021/ml400399f Uracil nucleotide/cysteinyl leukotriene receptor 1

Data from ChEMBL 36 via Core Engine