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Compound Detail

CHEMBL1736022

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CN(C)S(=O)(=O)c1cc(C(=O)NC2CCSc3ccccc32)ccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1736022
Phase Preclinical
Structure Type MOL
InChI Key ZVPKUKUIBHBLEC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

410.9
MW (Da)
3.56
ALogP
4
HBA
1
HBD
66.5
PSA (Ų)
0.84
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 C18H19ClN2O3S2
MW 410.95
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -2.04

Data from ChEMBL 36 via Core Engine