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Compound Detail

CHEMBL1193123

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CNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccc4c(N(C)C)cc(C)nc34)c2Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193123
Phase Preclinical
Structure Type MOL
InChI Key XRDVAWCYQCZLQY-LFIBNONCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

634.6
MW (Da)
5.65
ALogP
6
HBA
2
HBD
103.9
PSA (Ų)
0.22
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 C33H33Cl2N5O4
MW 634.56
Aromatic Rings 4
Heavy Atoms 44
NP-Likeness -1.08

Data from ChEMBL 36 via Core Engine