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Compound Detail

CHEMBL3040349

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c1cc2cc(c1)C[n+]1ccc(c3ccccc31)NCC1CCC(CC1)CNc1cc[n+](c3ccccc13)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040349
Phase Preclinical
Structure Type MOL
InChI Key SCDNCZYJEDKBIF-QUTRQNJUSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

500.7
MW (Da)
6.31
ALogP
2
HBA
2
HBD
31.8
PSA (Ų)
0.24
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 C34H36N4+2
MW 500.69
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness 0.33

Data from ChEMBL 36 via Core Engine