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Compound Detail

CHEMBL1191606

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CN(C)CCCOc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191606
Phase Preclinical
Structure Type MOL
InChI Key JEUMWNWUQZXLQK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

383.8
MW (Da)
4.19
ALogP
5
HBA
0
HBD
59.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H18ClNO4
MW 383.83
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.10

Data from ChEMBL 36 via Core Engine