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Compound Detail

CHEMBL1190379

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O=C(OC1CC2CCC(C1)N2Cc1ccccc1)n1c(=O)[nH]c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190379
Phase Preclinical
Structure Type MOL
InChI Key PRLVXOBFRCSGHP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
3.51
ALogP
5
HBA
1
HBD
67.3
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23N3O3
MW 377.44
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.31

Data from ChEMBL 36 via Core Engine