RIDAFOROLIMUS

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: L01EG03
UNII: 48Z35KB15K

Structure
InChI Key BUROJSBIWGDYCN-GAUTUEMISA-N
Smile CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](OP(C)(C)=O)[C@H](OC)C2)CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C/1C
InChI
InChI=1S/C53H84NO14P/c1-32-18-14-13-15-19-33(2)44(63-8)30-40-23-21-38(7)53(61,67-40)50(58)51(59)54-25-17-16-20-41(54)52(60)66-45(35(4)28-39-22-24-43(46(29-39)64-9)68-69(11,12)62)31-42(55)34(3)27-37(6)48(57)49(65-10)47(56)36(5)26-32/h13-15,18-19,27,32,34-36,38-41,43-46,48-49,57,61H,16-17,20-26,28-31H2,1-12H3/b15-13+,18-14+,33-19+,37-27+/t32-,34-,35-,36-,38-,39+,40+,41+,43-,44+,45+,46-,48-,49+,53-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C53H84NO14P
Molecular Weight 990.22
AlogP 7.74
Hydrogen Bond Acceptor 14.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 201.5
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 69.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Serine/threonine-protein kinase mTOR inhibitor PubMed
Primary Target
mechanistic target of rapamycin kinase

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Neoplasms 3 D009369 ClinicalTrials
Sarcoma 3 D012509 ClinicalTrials
Osteosarcoma 3 D012516 ClinicalTrials
Sarcoma 3 D012509 ClinicalTrials
Osteosarcoma 3 D012516 ClinicalTrials
Leiomyosarcoma 2 D007890 ClinicalTrials
Leukemia 2 D007938 ClinicalTrials
Liposarcoma 2 D008080 ClinicalTrials
Lymphoma 2 D008223 ClinicalTrials
Primary Myelofibrosis 2 D055728 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials
Myelodysplastic Syndromes 2 D009190 ClinicalTrials
Endometrial Neoplasms 2 D016889 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Carcinoma, Non-Small-Cell Lung 2 D002289 ClinicalTrials
Gliosarcoma 1 D018316 ClinicalTrials
Multiple Myeloma 1 D009101 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 572924-54-0
ChEBI 79700
ChEMBL CHEMBL2103839
DrugBank DB06233
DrugCentral 4778
FDA SRS 48Z35KB15K
Guide to Pharmacology 7884
KEGG C15183
PubChem 11520894
SureChEMBL SCHEMBL7719298
ZINC ZINC000169677038
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