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Compound Detail

CHEMBL1741055

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Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1C(=O)N2[C@@H](C(=O)O)C(C)(C)S(=O)(=O)[C@H]12

Basic Information

ChEMBL ID CHEMBL1741055
Phase Preclinical
Structure Type MOL
InChI Key UGWDODBNIXDVIT-JKIFEVAISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

433.4
MW (Da)
0.58
ALogP
7
HBA
2
HBD
146.9
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H19N3O7S
MW 433.44
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.48

Data from ChEMBL 36 via Core Engine