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Compound Detail

CHEMBL4597480

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O=C(N/N=C/c1cc[n+](Cc2ccccc2)c2ccccc12)c1ccc2ccc3ccc(C(=O)N/N=C/c4cc[n+](Cc5ccccc5)c5ccccc45)nc3c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597480
Phase Preclinical
Structure Type MOL
InChI Key IWOPHNSCXZWKGY-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

756.9
MW (Da)
7.29
ALogP
6
HBA
2
HBD
116.5
PSA (Ų)
0.07
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C48H36N8O2+2
MW 756.87
Aromatic Rings 9
Heavy Atoms 58
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine