EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:747378 - SAFit2

Default Structure
ChEBI IDCHEBI:747378
ChEBI NameSAFit2
Stars
DefinitionSAFit2, a chemical probe, is a highly potent, highly selective FK506-binding protein 51 (FKBP51) inhibitor with a Ki of 6 nM and also enhances AKT2-AS160 binding.
Last Modified19 February 2026
Submittercyan
DownloadsMolfile
FormulaC46H62N2O10
Net Charge0
Average Mass803.006
Monoisotopic Mass802.44045
SMILESCOc1ccc(CC[C@@H](OC(=O)[C@@H]2CCCCN2C(=O)[C@H](c2cc(OC)c(OC)c(OC)c2)C2CCCCC2)c2cccc(OCCN3CCOCC3)c2)cc1OC
InChIInChI=1S/C46H62N2O10/c1-51-39-20-18-32(28-40(39)52-2)17-19-38(34-14-11-15-36(29-34)57-27-24-47-22-25-56-26-23-47)58-46(50)37-16-9-10-21-48(37)45(49)43(33-12-7-6-8-13-33)35-30-41(53-3)44(55-5)42(31-35)54-4/h11,14-15,18,20,28-31,33,37-38,43H,6-10,12-13,16-17,19,21-27H2,1-5H3/t37-,38+,43-/m0/s1
InChIKeyZDBWLRLGUBSLPG-FDHYQTMZSA-N
ChEBI Ontology
Outgoing Relation(s)
SAFit2 (CHEBI:747378) is a organic molecular entity (CHEBI:50860)
Registry NumbersSources
CAS:1643125-33-0CAS