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Compound Detail

CHEMBL3039641

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O=[N+]([O-])c1ccc2c(c1)c1cc[n+]2Cc2cccc(c2)C[n+]2ccc(c3cc([N+](=O)[O-])ccc32)NCc2ccc(cc2)CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3039641
Phase Preclinical
Structure Type MOL
InChI Key ZFLVLBGXPLRZKY-QUTRQNJUSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

584.6
MW (Da)
6.02
ALogP
6
HBA
2
HBD
118.1
PSA (Ų)
0.15
QED
2
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H28N6O4+2
MW 584.64
Aromatic Rings 6
Heavy Atoms 44
NP-Likeness 0.11

Data from ChEMBL 36 via Core Engine