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Compound Detail

CHEMBL317518

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CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL317518
Phase Preclinical
Structure Type MOL
InChI Key RHYXXDZTKNFKQG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

279.4
MW (Da)
1.79
ALogP
4
HBA
1
HBD
49.6
PSA (Ų)
0.84
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H21N3OS
MW 279.41
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -1.04

Data from ChEMBL 36 via Core Engine