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Compound Detail

CHEMBL287512

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Nc1nc(O)c2ncn([C@H]3CCC[C@H]3CO)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL287512
Phase Preclinical
Structure Type MOL
InChI Key MEZRKQQCOBQFMS-BQBZGAKWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

249.3
MW (Da)
0.45
ALogP
7
HBA
3
HBD
110.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H15N5O2
MW 249.27
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness 0.27

Literature References

PubMed DOI Target Context # Activities
9871764 10.1016/s0960-894x(98)00216-9 L1210 1
9871764 10.1016/s0960-894x(98)00216-9 MOLT-4 1
9871764 10.1016/s0960-894x(98)00216-9 CCRF-CEM 1

Data from ChEMBL 36 via Core Engine