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Compound Detail

CHEMBL1180784

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C[N+]1(CCC(=O)Nc2cccc3c2C(=O)c2cccc(NC(=O)CC[N+]4(C)CCOCC4)c2C3=O)CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1180784
Phase Preclinical
Structure Type MOL
InChI Key UVXZYPRCYXKDII-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

550.7
MW (Da)
2.07
ALogP
6
HBA
2
HBD
110.8
PSA (Ų)
0.42
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H38N4O6+2
MW 550.66
Aromatic Rings 2
Heavy Atoms 40
NP-Likeness -0.27

Data from ChEMBL 36 via Core Engine