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Compound Detail

CHEMBL1184110

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CCCCCCCCCCCCCCCNC(=O)OCC1OCC(COC(=O)N(Cc2cccc[n+]2CC)C(C)=O)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184110
Phase Preclinical
Structure Type MOL
InChI Key ZPSLXVZLSDKJSD-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

592.8
MW (Da)
6.04
ALogP
7
HBA
1
HBD
107.3
PSA (Ų)
0.14
QED
2
Ro5 Violations
21
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H54N3O7+
MW 592.80
Aromatic Rings 1
Heavy Atoms 42
NP-Likeness -0.11

Data from ChEMBL 36 via Core Engine