Showing RIpred-Card for Zanubrutinib,2TMS,isomer#2 (RI01722335)

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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 IDRI01722335
Compound Identification
Common NameZanubrutinib,2TMS,isomer#2
Structure
Average Molecular Weight615.3061
SMILESC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3547.9805
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices