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Compound Detail

CHEMBL1186795

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N#C[C@]1(NC(=O)[C@H](N)Cc2cccs2)C[C@H]1c1ccccc1

Basic Information

ChEMBL ID CHEMBL1186795
Phase Preclinical
Structure Type MOL
InChI Key FUYOZZGSCQXNCB-ZMSDIMECSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

311.4
MW (Da)
2.18
ALogP
4
HBA
2
HBD
78.9
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17N3OS
MW 311.41
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.62

Data from ChEMBL 36 via Core Engine