Showing RIpred-Card for Pralsetinib,3TBDMS,isomer#1 (RI01722038)

Jump To Section:
IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722038
Compound Identification
Common NamePralsetinib,3TBDMS,isomer#1
Structure
Average Molecular Weight875.5257
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(N(C3=NN([Si](C)(C)C(C)(C)C)C(C)=C3)[Si](C)(C)C(C)(C)C)=N2)CC1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4931.121
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices