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Compound Detail

CHEMBL3040320

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Cc1ccc2c(c1)c1cc[n+]2Cc2cccc(c2)C[n+]2ccc(c3cc(C)ccc32)NCc2ccc(cc2)CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040320
Phase Preclinical
Structure Type MOL
InChI Key RIUOOVHLSOPKQH-YEQLPCBTSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

522.7
MW (Da)
6.82
ALogP
2
HBA
2
HBD
31.8
PSA (Ų)
0.21
QED
2
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H34N4+2
MW 522.70
Aromatic Rings 6
Heavy Atoms 40
NP-Likeness 0.35

Data from ChEMBL 36 via Core Engine