Showing RIpred-Card for Avapritinib,1TBDMS,isomer#1 (RI01721995)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01721995
Compound Identification
Common NameAvapritinib,1TBDMS,isomer#1
Structure
Average Molecular Weight612.3269
SMILESCN1C=C(C2=CN3N=CN=C(N4CCN(C5=NC=C([C@@](C)(N[Si](C)(C)C(C)(C)C)C6=CC=C(F)C=C6)C=N5)CC4)C3=C2)C=N1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4688.116
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices