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Compound Detail

CHEMBL1188429

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Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc(NC(=O)c5ccc(N(CCCl)CCCl)cc5)nn4C)cn3C)cn2C)cc1C(=O)NCCC(=N)N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1188429
Phase Preclinical
Structure Type MOL
InChI Key IKIBPLPDZZCXJK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

820.7
MW (Da)
3.78
ALogP
12
HBA
7
HBD
231.2
PSA (Ų)
0.04
QED
3
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C37H43Cl2N13O5
MW 820.74
Aromatic Rings 5
Heavy Atoms 57
NP-Likeness -0.76

Data from ChEMBL 36 via Core Engine