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Compound Detail

CHEMBL1207256

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O=C(O)C1=CS[C@@H]2/C(=C\c3cc4n(n3)CCS(=O)(=O)C4)C(=O)N12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207256
Phase Preclinical
Structure Type MOL
InChI Key IBSSBUWAVGFIIX-TWLAMCEISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

353.4
MW (Da)
0.04
ALogP
7
HBA
1
HBD
109.6
PSA (Ų)
0.59
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H11N3O5S2
MW 353.38
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.92

Data from ChEMBL 36 via Core Engine