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Compound Detail

CHEMBL1739630

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CC(C)(C)c1cc[n+](CCCCCCCC[n+]2ccc(C(C)(C)C)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1739630
Phase Preclinical
Structure Type MOL
InChI Key BGWSJOXUYWABSA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

382.6
MW (Da)
5.90
ALogP
0
HBA
0
HBD
7.8
PSA (Ų)
0.38
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H42N2+2
MW 382.64
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine