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Compound Detail

CHEMBL1190928

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Oc1ccc2c(c1O)-c1cccc3c1[C@@H](C2)N(CC1CC1)CC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190928
Phase Preclinical
Structure Type MOL
InChI Key OXQZCFBTWSWVNN-MRXNPFEDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

307.4
MW (Da)
3.63
ALogP
3
HBA
2
HBD
43.7
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H21NO2
MW 307.39
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness 0.89

Data from ChEMBL 36 via Core Engine