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Compound Detail

CHEMBL5499124

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COC(=O)c1cc(C(=O)c2ccc(OC)cc2)n2ccc(CCCc3cc[n+](C)cc3)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499124
Phase Preclinical
Structure Type MOL
InChI Key IILWHJNAPFMQIG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

443.5
MW (Da)
3.97
ALogP
5
HBA
0
HBD
60.9
PSA (Ų)
0.23
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H27N2O4+
MW 443.52
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -0.43

Data from ChEMBL 36 via Core Engine