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Compound Detail

CHEMBL98989

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CN(C)CCCN1C(=O)CSC1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL98989
Phase Preclinical
Structure Type MOL
InChI Key WPBPEYZCMLLZET-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

264.4
MW (Da)
2.21
ALogP
3
HBA
0
HBD
23.6
PSA (Ų)
0.81
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 C14H20N2OS
MW 264.39
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.18

Data from ChEMBL 36 via Core Engine