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Compound Detail

CHEMBL1187653

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CC(C)(CC(=O)N1CCc2ccsc2C1)[C@H](N)C(=O)N1CCC[C@H]1C#N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187653
Phase Preclinical
Structure Type MOL
InChI Key JAJZIENLNRTEFR-WMLDXEAASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

374.5
MW (Da)
1.89
ALogP
5
HBA
1
HBD
90.4
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H26N4O2S
MW 374.51
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -1.01

Data from ChEMBL 36 via Core Engine