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Compound Detail

CHEMBL1193332

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CNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(C)c(COc3cccc4c(-c5ccccc5)cc(C)nc34)c2C)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193332
Phase Preclinical
Structure Type MOL
InChI Key VWTSQBOHEAOVQL-HEHNFIMWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

626.8
MW (Da)
6.56
ALogP
5
HBA
2
HBD
100.6
PSA (Ų)
0.17
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C39H38N4O4
MW 626.76
Aromatic Rings 5
Heavy Atoms 47
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine