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Compound Detail

CHEMBL2111602

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Cc1cn([C@H]2CC[C@H](COP(=O)(O)O)O2)c(=O)[nH]c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2111602
Phase Preclinical
Structure Type MOL
InChI Key WVNRRNJFRREKAR-HTQZYQBOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

306.2
MW (Da)
-0.37
ALogP
6
HBA
3
HBD
130.8
PSA (Ų)
0.65
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H15N2O7P
MW 306.21
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.96

Literature References

PubMed DOI Target Context # Activities
8709123 10.1021/jm960175c NON-PROTEIN TARGET 1
8709123 10.1021/jm960175c Unchecked 1

Data from ChEMBL 36 via Core Engine