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Compound Detail

CHEMBL2365857

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COC1=C(OC)C(=O)C(CCCCCCCCCC[N+](C)(Cc2ccccc2)Cc2ccccc2)=C(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2365857
Phase Preclinical
Structure Type MOL
InChI Key WHPDJKGHDXPCBN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

532.8
MW (Da)
7.32
ALogP
4
HBA
0
HBD
52.6
PSA (Ų)
0.12
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H46NO4+
MW 532.75
Aromatic Rings 2
Heavy Atoms 39
NP-Likeness 0.80

Data from ChEMBL 36 via Core Engine