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Compound Detail

CHEMBL323423

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CC1(C)C(=O)NC(=S)N/C1=C/c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL323423
Phase Preclinical
Structure Type MOL
InChI Key LWCDBZQFGQBNKL-CSKARUKUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

246.3
MW (Da)
2.06
ALogP
2
HBA
2
HBD
41.1
PSA (Ų)
0.75
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 C13H14N2OS
MW 246.34
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.32

Literature References

PubMed DOI Target Context # Activities
7650679 10.1021/jm00017a010 MT4 2

Data from ChEMBL 36 via Core Engine