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Compound Detail

CHEMBL3140218

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Cc1ccccc1C(O)(C[C@H]1C[C@H]2CC[C@@H](C1)[N+]2(C)C)c1ccccc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3140218
Phase Preclinical
Structure Type MOL
InChI Key NSBBSEOLGKYCEK-KOUNCHBCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

364.6
MW (Da)
4.95
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H34NO+
MW 364.55
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness 0.13

Data from ChEMBL 36 via Core Engine