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Compound Detail

CHEMBL1194911

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CNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccc4c(OC5CCCC5)cc(C)nc34)c2Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194911
Phase Preclinical
Structure Type MOL
InChI Key FYIAVPWBQUDKAW-QGOAFFKASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

675.6
MW (Da)
6.90
ALogP
6
HBA
2
HBD
109.9
PSA (Ų)
0.17
QED
2
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H36Cl2N4O5
MW 675.61
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -0.84

Data from ChEMBL 36 via Core Engine