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Compound Detail

CHEMBL1199882

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CC(C)Oc1ccccc1N1CCN(Cc2ccc(CN(C)S(=O)(=O)C(C)C)n2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1199882
Phase Preclinical
Structure Type MOL
InChI Key PDFYNWDLYVXERX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

462.7
MW (Da)
3.30
ALogP
6
HBA
0
HBD
58.0
PSA (Ų)
0.57
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H38N4O3S
MW 462.66
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -1.24

Data from ChEMBL 36 via Core Engine