General
Preferred name
UMIROLIMUS
Synonyms
TRM-986 ()
Biolimus ()
biolimus A9 ()
TRM 986 ()
40-o-(2-ethoxyethyl)rapamycin ()
42-o-(2-ethoxyethyl) rapamycin ()
Rapamycin, 42-o-(2-ethoxyethyl)- ()
P&D ID
PD064847
CAS
851536-75-9
Tags
drug candidate
natural product
available
Drug Status
experimental
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
Cayman Chemical Bioactives
ChEMBL Drugs
DrugBank
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
985.61
Hydrogen Bond Acceptors
14
Hydrogen Bond Donors
2
Rotatable Bonds
11
Ring Count
4
Aromatic Ring Count
0
cLogP
7.24
TPSA
193.66
Fraction CSP3
0.76
Chiral centers
15.0
Largest ring
29.0
QED
0.09
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Bacterial
Source data
