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Compound Detail

CHEMBL1190165

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CCOC(=O)COc1cc(C)nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)/C=C/c4ccc(C(=O)NC)cc4)c3Cl)cccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190165
Phase Preclinical
Structure Type MOL
InChI Key GTXMALXTVPPBMA-LFIBNONCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

693.6
MW (Da)
5.52
ALogP
8
HBA
2
HBD
136.2
PSA (Ų)
0.14
QED
2
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H34Cl2N4O7
MW 693.58
Aromatic Rings 4
Heavy Atoms 48
NP-Likeness -1.11

Data from ChEMBL 36 via Core Engine