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Compound Detail

CHEMBL256700

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O=C1NC(=S)NC(=O)C1=Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL256700
Phase Preclinical
Structure Type MOL
InChI Key TXGVDOCEVWJSPR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

232.3
MW (Da)
0.60
ALogP
3
HBA
2
HBD
58.2
PSA (Ų)
0.42
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 C11H8N2O2S
MW 232.26
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.90

Literature References

PubMed DOI Target Context # Activities
18343108 10.1016/j.bmcl.2008.02.066 Unchecked 1
18343108 10.1016/j.bmcl.2008.02.066 Methionine aminopeptidase 1 1
19904929 10.1021/jm901183d RAW264.7 1

Data from ChEMBL 36 via Core Engine