Showing RIpred-Card for Pralsetinib,1TBDMS,isomer#3 (RI01722048)

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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 IDRI01722048
Compound Identification
Common NamePralsetinib,1TBDMS,isomer#3
Structure
Average Molecular Weight647.3528
SMILESCO[C@]1(C(=O)N([C@@H](C)C2=CC=C(N3C=C(F)C=N3)N=C2)[Si](C)(C)C(C)(C)C)CC[C@@H](C2=NC(C)=CC(NC3=N[NH]C(C)=C3)=N2)CC1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6608.694
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices