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Compound Detail

CHEMBL3140141

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C[N+]1(C)[C@@H]2CC[C@H]1C[C@@H](CC(CO)(c1ccccc1)c1ccccc1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3140141
Phase Preclinical
Structure Type MOL
InChI Key FOJQLTRBJHZZKU-QYEXWFEISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.5
MW (Da)
4.37
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H32NO+
MW 350.53
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness 0.35

Data from ChEMBL 36 via Core Engine