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Compound Detail

CHEMBL1193789

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

Basic Information

ChEMBL ID CHEMBL1193789
Phase Preclinical
Structure Type MOL
InChI Key URFSBSHWYKXGHP-LFIBNONCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

649.6
MW (Da)
6.37
ALogP
6
HBA
2
HBD
109.9
PSA (Ų)
0.18
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 C34H34Cl2N4O5
MW 649.58
Aromatic Rings 4
Heavy Atoms 45
NP-Likeness -1.13

Data from ChEMBL 36 via Core Engine