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Compound Detail

CHEMBL248616

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O=C(N[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C(O)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL248616
Phase Preclinical
Structure Type MOL
InChI Key UGNOTWMFRTUFBZ-ULNPTZJRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

322.4
MW (Da)
1.97
ALogP
3
HBA
2
HBD
52.6
PSA (Ų)
0.88
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 C20H22N2O2
MW 322.41
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.41

Literature References

PubMed DOI Target Context # Activities
17629699 10.1016/j.bmcl.2007.06.081 Muscarinic acetylcholine receptor M2 1
17629699 10.1016/j.bmcl.2007.06.081 Muscarinic receptor M2 and M3 1
17629699 10.1016/j.bmcl.2007.06.081 Muscarinic acetylcholine receptor M3 1

Data from ChEMBL 36 via Core Engine