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Compound Detail

CHEMBL1419748

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CN1C(=S)SC(N(O)C(=O)Nc2ccccc2)C1(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1419748
Phase Preclinical
Structure Type MOL
InChI Key ZAVWCZXKLDFJTP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

311.4
MW (Da)
2.98
ALogP
4
HBA
2
HBD
55.8
PSA (Ų)
0.50
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 C13H17N3O2S2
MW 311.43
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine