ZB-716

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Synonyms
Status
Molecule Category Free-form
UNII E35ZN95LMT

Structure

InChI Key FIAYIYKWRBIBQG-GDWZZRAASA-N
Smiles C[C@]12CC[C@@H]3c4ccc(B(O)O)cc4C[C@@H](CCCCCCCCC[S+]([O-])CCCC(F)(F)C(F)(F)F)[C@H]3[C@@H]1CC[C@@H]2O
InChI
InChI=1S/C32H48BF5O4S/c1-30-17-15-26-25-12-11-24(33(40)41)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-43(42)19-9-16-31(34,35)32(36,37)38/h11-12,21-22,26-29,39-41H,2-10,13-20H2,1H3/t22-,26-,27+,28+,29-,30+,43?/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C32H48BF5O4S
Molecular Weight 634.6

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group A Nuclear hormone receptor subfamily 3 group A member 1
- 4.1-12.7 - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 3.2-69 - - -

Cross References

Resources Reference
ChEMBL CHEMBL4526356
FDA SRS E35ZN95LMT
SureChEMBL SCHEMBL19578939
CONTENTS