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Compound Detail

CHEMBL6070199

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C[n+]1c(/C=C/c2c[nH]c3ccccc23)cc(/C=C2\Sc3ccccc3N2CCCN2CCCCC2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6070199
Phase Preclinical
Structure Type MOL
InChI Key MFMYVUOEORVCCU-LAKKEJQSSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

557.8
MW (Da)
8.10
ALogP
3
HBA
1
HBD
26.1
PSA (Ų)
0.20
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H37N4S+
MW 557.79
Aromatic Rings 5
Heavy Atoms 41
NP-Likeness -0.57

Data from ChEMBL 36 via Core Engine