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Compound Detail

CHEMBL5092304

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C[C@H]1CNS(=O)(=O)c2cnn3ccc(nc23)N[C@H](C)c2cc(F)ccc2O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5092304
Phase Preclinical
Structure Type MOL
InChI Key CTZJSQBAJLJDCB-WDEREUQCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

391.4
MW (Da)
2.10
ALogP
7
HBA
2
HBD
97.6
PSA (Ų)
0.61
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18FN5O3S
MW 391.43
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.79

Literature References

PubMed DOI Target Context # Activities
34253025 10.1021/acs.jmedchem.1c00712 High affinity nerve growth factor receptor 1

Data from ChEMBL 36 via Core Engine