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Compound Detail

CHEMBL1197311

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O=C(CS[n+]1cc(-c2ccc(F)cc2)cs1)NC(=O)NCc1ccco1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197311
Phase Preclinical
Structure Type MOL
InChI Key MVYXWWVBQDKSTC-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.5
MW (Da)
2.96
ALogP
5
HBA
2
HBD
75.2
PSA (Ų)
0.63
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 C17H15FN3O3S2+
MW 392.46
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.72

Data from ChEMBL 36 via Core Engine