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Compound Detail

CHEMBL1489665

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CCn1c(SCC(=O)O)nc2sc3c(c2c1=O)CCCC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1489665
Phase Preclinical
Structure Type MOL
InChI Key RZCGXZIBYWXSJZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
2.53
ALogP
6
HBA
1
HBD
72.2
PSA (Ų)
0.69
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 C14H16N2O3S2
MW 324.43
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -2.56

Data from ChEMBL 36 via Core Engine