SEL-120

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: SDM3M518PJ

Structure
InChI Key FSBMCTDYWXIBLM-UHFFFAOYSA-N
Smile Cc1c(Br)c(Br)c2c3c1nc(N1CCNCC1)n3CCC2
InChI
InChI=1S/C15H18Br2N4/c1-9-11(16)12(17)10-3-2-6-21-14(10)13(9)19-15(21)20-7-4-18-5-8-20/h18H,2-8H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H18Br2N4
Molecular Weight 414.14
AlogP 3.23
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 33.09
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase CDK family CMGC protein kinase CDK8 subfamily
- 10 - - -
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase CDK family CMGC protein kinase CDK9 subfamily
- 1070 - - -
Other cytosolic protein
- 10 - - -

Cross References

Resources Reference
ChEMBL CHEMBL4578881
FDA SRS SDM3M518PJ
PubChem 73776232
SureChEMBL SCHEMBL17106021
ChEMBL CHEMBL4225966
FDA SRS 6LGR0RYY5Q
PubChem 73776232
SureChEMBL SCHEMBL17106044
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