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Compound Detail

CHEMBL1182154

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COc1ccc(C[C@H]2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182154
Phase Preclinical
Structure Type MOL
InChI Key RVBHVIRGZXRPRX-SFHVURJKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

372.5
MW (Da)
3.64
ALogP
4
HBA
0
HBD
36.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H30NO4+
MW 372.49
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness 1.04

Data from ChEMBL 36 via Core Engine