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Compound Detail

CHEMBL1205656

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O=C(Nc1ccccc1)N1CC[C@@H]2[C@H]1C(=O)N2S(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205656
Phase Preclinical
Structure Type MOL
InChI Key IOBPNPLVGSCZSV-ZJUUUORDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

311.3
MW (Da)
0.31
ALogP
4
HBA
2
HBD
107.0
PSA (Ų)
0.60
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 C12H13N3O5S
MW 311.32
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine