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Compound Detail

CHEMBL1195512

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

Basic Information

ChEMBL ID CHEMBL1195512
Phase Preclinical
Structure Type MOL
InChI Key SQDMDCRADRDVPC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

722.6
MW (Da)
2.96
ALogP
10
HBA
7
HBD
201.1
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 C31H36BrN11O5
MW 722.60
Aromatic Rings 4
Heavy Atoms 48
NP-Likeness -0.45

Data from ChEMBL 36 via Core Engine