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Compound Detail

CHEMBL1188699

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CN(CC1CC1)[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1cccc2sccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1188699
Phase Preclinical
Structure Type MOL
InChI Key BLQSPWHFSRSTAS-WOJBJXKFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

370.6
MW (Da)
4.56
ALogP
3
HBA
0
HBD
23.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H30N2OS
MW 370.56
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -1.35

Data from ChEMBL 36 via Core Engine