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Compound Detail

CHEMBL1390245

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CCCCC1(C)NC(=O)c2c(C)sc(C(=O)OCC)c2N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1390245
Phase Preclinical
Structure Type MOL
InChI Key ZWQSKLZHURAMLP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

310.4
MW (Da)
3.29
ALogP
5
HBA
2
HBD
67.4
PSA (Ų)
0.82
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 C15H22N2O3S
MW 310.42
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine