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Compound Detail

CHEMBL3198103

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CCCCCOc1ccc(/C=c2\sc3nc(=O)c(-c4ccccc4)nn3c2=O)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3198103
Phase Preclinical
Structure Type MOL
InChI Key UOVILEBZFVLBKD-HKWRFOASSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

449.5
MW (Da)
3.30
ALogP
8
HBA
0
HBD
82.8
PSA (Ų)
0.38
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H23N3O4S
MW 449.53
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.26

Data from ChEMBL 36 via Core Engine