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Compound Detail

CHEMBL1618286

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CCCCCCCCCCCCCCCCCCOCCOP(=O)(O)CO[C@H](CO)Cn1cnc2c(N)nc(N)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1618286
Phase Preclinical
Structure Type MOL
InChI Key VBUVCWMJUNJDEO-VWLOTQADSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

614.8
MW (Da)
5.81
ALogP
11
HBA
4
HBD
180.9
PSA (Ų)
0.07
QED
3
Ro5 Violations
27
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H55N6O6P
MW 614.77
Aromatic Rings 2
Heavy Atoms 42
NP-Likeness 0.03

Literature References

PubMed DOI Target Context # Activities
19704122 10.1128/aac.00840-09 Schistosoma mansoni 7

Data from ChEMBL 36 via Core Engine