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Compound Detail

CHEMBL1709464

PHENAZEPAM
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O=C1CN=C(c2ccccc2Cl)c2cc(Br)ccc2N1

Basic Information

ChEMBL ID CHEMBL1709464
Name PHENAZEPAM
Phase Preclinical
Structure Type MOL
InChI Key CGMJQQJSWIRRRL-UHFFFAOYSA-N
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

349.6
MW (Da)
3.89
ALogP
2
HBA
1
HBD
41.5
PSA (Ų)
0.83
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H10BrClN2O
MW 349.62
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.53

Activity Summary

Ki 4 meas. best 10.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
GABA-A receptor; alpha-1/beta-2/gamma-2
CHEMBL2095172
Ki 10.3 10.3 0.1 1
GABA A receptor alpha-2/beta-2/gamma-2
CHEMBL2111413
Ki 10.22 10.22 0.1 1
GABA A receptor alpha-3/beta-2/gamma-2
CHEMBL2111339
Ki 9.92 9.92 0.1 1
Gamma-aminobutyric acid receptor subunit alpha-5/beta-2/gamma-2
CHEMBL4523641
Ki 9.17 9.17 0.7 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1007/s00044-012-9977-1 Whole blood 1
35218882 10.1016/j.bmcl.2022.128637 GABA-A receptor; alpha-1/beta-2/gamma-2 1
35218882 10.1016/j.bmcl.2022.128637 GABA A receptor alpha-2/beta-2/gamma-2 1
35218882 10.1016/j.bmcl.2022.128637 GABA A receptor alpha-3/beta-2/gamma-2 1
35218882 10.1016/j.bmcl.2022.128637 Gamma-aminobutyric acid receptor subunit alpha-5/beta-2/gamma-2 1

Data from ChEMBL 36 via Core Engine