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Compound Detail

CHEMBL3040646

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N=C(NCc1ccc(Cl)cc1)SCCCN1CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040646
Phase Preclinical
Structure Type MOL
InChI Key HQQJSFKQAPDYJB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

311.9
MW (Da)
3.58
ALogP
3
HBA
2
HBD
39.1
PSA (Ų)
0.48
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 C15H22ClN3S
MW 311.88
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -1.34

Data from ChEMBL 36 via Core Engine