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Compound Detail

CHEMBL3040369

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Nc1ccc2c(c1)c1cc[n+]2Cc2cccc(c2)C[n+]2ccc(c3cc(N)ccc32)NCc2ccc(cc2)CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040369
Phase Preclinical
Structure Type MOL
InChI Key NMRKUXYHNBZEIV-CBSZVXRSSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

524.7
MW (Da)
5.37
ALogP
4
HBA
4
HBD
83.9
PSA (Ų)
0.16
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 C34H32N6+2
MW 524.67
Aromatic Rings 6
Heavy Atoms 40
NP-Likeness 0.43

Data from ChEMBL 36 via Core Engine