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Compound Detail

CHEMBL1196167

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

Basic Information

ChEMBL ID CHEMBL1196167
Phase Preclinical
Structure Type MOL
InChI Key OJRRBEWDZUVRAD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

708.6
MW (Da)
2.70
ALogP
10
HBA
7
HBD
215.1
PSA (Ų)
0.07
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 C30H34BrN11O5
MW 708.58
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -0.40

Data from ChEMBL 36 via Core Engine