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Compound Detail

CHEMBL1192214

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CC(C)[C@@H]1C(=O)N(S(C)(=O)=O)[C@@H]2CCN(C(=O)c3cnc(CNC4CC4)cn3)[C@H]21

Basic Information

ChEMBL ID CHEMBL1192214
Phase Preclinical
Structure Type MOL
InChI Key TZSPKNFWFIBCTO-IXDOHACOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

421.5
MW (Da)
0.39
ALogP
7
HBA
1
HBD
112.6
PSA (Ų)
0.71
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 C19H27N5O4S
MW 421.52
Aromatic Rings 1
Heavy Atoms 29
NP-Likeness -0.77

Data from ChEMBL 36 via Core Engine