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Compound Detail

CHEMBL1181154

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CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(Cc1cccc[n+]1C)C(C)=O)OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1181154
Phase Preclinical
Structure Type MOL
InChI Key UFVWIWGBFRAXDP-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

592.8
MW (Da)
7.00
ALogP
6
HBA
1
HBD
98.0
PSA (Ų)
0.10
QED
2
Ro5 Violations
24
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H58N3O6+
MW 592.84
Aromatic Rings 1
Heavy Atoms 42
NP-Likeness 0.07

Data from ChEMBL 36 via Core Engine