RAD001 (Everolimus)
1,18-dihydroxy-12-[1-[4-(2-hydroxyethoxy)-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone
Molecular Identity
RAD001 (Everolimus)
1,18-dihydroxy-12-[1-[4-(2-hydroxyethoxy)-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone
PubChem CID: 53398658
2D Structure
Properties
C53H83NO14
Molecular Formula
958.20
Molecular Weight
g/mol
957.5814
Exact Mass
Da
5.9
XLogP
Above Lipinski threshold
205
TPSA
May have limited oral absorption
3
H-Bond Donors
14
H-Bond Acceptors
1810
Complexity
SMILES
Canonical SMILES
SMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)OCCO)C)C)O)OC)C)C)C)OCIsomeric SMILES
SMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)OCCO)C)C)O)OC)C)C)C)OCSynonyms(5)
S1120RAD001 (Everolimus)HMS3672G03LSM-4258Q27165445
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to RAD001 (Everolimus)
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