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Compound Detail

CHEMBL298128

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CCCCN(CCCC)CCCOc1ccc(-c2csc(-c3cc(OC)cc(OC)c3)n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL298128
Phase Preclinical
Structure Type MOL
InChI Key GTSSXNAKJNCRPF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

482.7
MW (Da)
7.17
ALogP
6
HBA
0
HBD
43.8
PSA (Ų)
0.21
QED
1
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H38N2O3S
MW 482.69
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.12

Data from ChEMBL 36 via Core Engine