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Compound Detail

CHEMBL1199149

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CC(C)(CN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O)C[N+](C)(C)CCCCCC[N+](C)(C)CC(C)(C)CN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O

Basic Information

ChEMBL ID CHEMBL1199149
Phase Preclinical
Structure Type MOL
InChI Key QRPAYOCOCFWLKU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

795.0
MW (Da)
7.47
ALogP
8
HBA
0
HBD
161.0
PSA (Ų)
0.03
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C44H54N6O8+2
MW 794.95
Aromatic Rings 4
Heavy Atoms 58
NP-Likeness -0.23

Data from ChEMBL 36 via Core Engine