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Compound Detail

CHEMBL1617556

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O=C(CNC1CCN(Cc2ccccc2)CC1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1617556
Phase Preclinical
Structure Type MOL
InChI Key KXVFMIUCXNRCSM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

470.6
MW (Da)
3.05
ALogP
5
HBA
2
HBD
81.8
PSA (Ų)
0.62
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H34N4O3S
MW 470.64
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness -1.84

Data from ChEMBL 36 via Core Engine