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Compound Detail

CHEMBL1455762

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O=C(c1ccc(CNS(=O)(=O)c2ccccc2)cc1)N1CCN(Cc2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1455762
Phase Preclinical
Structure Type MOL
InChI Key UFMJAGNPIYFMFZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

449.6
MW (Da)
3.12
ALogP
4
HBA
1
HBD
69.7
PSA (Ų)
0.60
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27N3O3S
MW 449.58
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.62

Data from ChEMBL 36 via Core Engine