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Compound Detail

CHEMBL6068987

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COc1ccc2c3ccnc(C)c3n(CCN(C)C)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6068987
Phase Preclinical
Structure Type MOL
InChI Key MOPUAJCKFRRYRF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

283.4
MW (Da)
3.07
ALogP
4
HBA
0
HBD
30.3
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H21N3O
MW 283.37
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.44

Data from ChEMBL 36 via Core Engine