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Compound Detail

CHEMBL31383

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CN(C)c1cc(Cl)c2c(c1)NC1=NC(=O)CN1C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL31383
Phase Preclinical
Structure Type MOL
InChI Key VRAXWPBKUZAFIC-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

264.7
MW (Da)
1.53
ALogP
4
HBA
1
HBD
47.9
PSA (Ų)
0.84
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H13ClN4O
MW 264.72
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.93

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
4045917 10.1021/jm00148a003 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine