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Compound Detail

CHEMBL1193586

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C=C(Br)C(=O)Nc1cc(C(=O)Nc2cc(C(=O)Nc3cc(C(=O)Nc4cc(C(=O)NCCN/C(=N\C)NC)n(C)c4)n(C)c3)n(C)c2)n(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193586
Phase Preclinical
Structure Type MOL
InChI Key SKNFKLQWJVNWPA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

751.6
MW (Da)
2.17
ALogP
10
HBA
7
HBD
201.6
PSA (Ų)
0.05
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H39BrN12O5
MW 751.65
Aromatic Rings 4
Heavy Atoms 50
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine