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Compound Detail

CHEMBL3327154

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O=P(O)(O)C(CNc1ncnc2ncccc12)P(=O)(O)O

Basic Information

ChEMBL ID CHEMBL3327154
Phase Preclinical
Structure Type MOL
InChI Key XFSUYQGTOPMESG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

334.2
MW (Da)
0.12
ALogP
6
HBA
5
HBD
165.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H12N4O6P2
MW 334.17
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.60

Literature References

PubMed DOI Target Context # Activities
25144111 10.1021/jm501010f Human immunodeficiency virus type 1 reverse transcriptase 1

Data from ChEMBL 36 via Core Engine