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Compound Detail

CHEMBL1198347

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Cc1ccc(C)c(-c2csc(Nc3ccc(C)c(C)c3)n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1198347
Phase Preclinical
Structure Type MOL
InChI Key APCPGRSHWZYJEA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

308.4
MW (Da)
5.79
ALogP
3
HBA
1
HBD
24.9
PSA (Ų)
0.66
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H20N2S
MW 308.45
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.93

Data from ChEMBL 36 via Core Engine