Compound Detail
CHEMBL5763676
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CCc1c2c(nn1C)C(CCC1CCOCC1)N(C)S(=O)(=O)CCCn1c(C(=O)O)c(CCCOc3cccc4cc(F)ccc34)c3ccc(Cl)c-2c31
Basic Information
| ChEMBL ID | CHEMBL5763676 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LAWVJPDUZILMPR-UHFFFAOYSA-N |
3
Targets
13
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
765.4
MW (Da)
8.17
ALogP
8
HBA
1
HBD
115.9
PSA (Ų)
0.14
QED
2
Ro5 Violations
10
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 13 meas. best 9.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1/Phorbol-12-myristate-13-acetate-induced protein 1 CHEMBL6066576 | IC50 | 9.03 | 8.3283 | 0.9 | 6 |
| BCL2/BAD CHEMBL5169266 | IC50 | 4.85 | 4.785 | 14000.0 | 4 |
| BCL2L1/BAD CHEMBL5169267 | IC50 | 4.8 | 4.7567 | 16000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine