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Compound Detail

CHEMBL1184043

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c1ccc2c(c1)C1CC(c3cc[nH]c3)(c3cc[nH]c3)C2c2cccc[n+]21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184043
Phase Preclinical
Structure Type MOL
InChI Key FTHMSNDPXJXXQI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
4.06
ALogP
0
HBA
2
HBD
35.5
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H20N3+
MW 338.43
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness 0.19

Data from ChEMBL 36 via Core Engine