CHEBI:125006 - (1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3-(5-pyrimidinylmethyl)-3,6-diazabicyclo[3.1.1]heptane

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ChEBI Name (1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3-(5-pyrimidinylmethyl)-3,6-diazabicyclo[3.1.1]heptane
ChEBI ID CHEBI:125006
Stars This entity has been manually annotated by a third party.
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Formula C22H21FN4
Net Charge 0
Average Mass 360.428
Monoisotopic Mass 360.17502
InChI InChI=1S/C22H21FN4/c23-19-3-1-2-18(8-19)16-4-6-17(7-5-16)22-20-12-27(13-21(22)26-20)11-15-9-24-14-25-10-15/h1-10,14,20-22,26H,11-13H2/t20-,21+,22?
InChIKey ZYWXWNJTNSSVNL-CBQGHPETSA-N
SMILES C1[C@@H]2C([C@@H](N2)CN1CC3=CN=CN=C3)C4=CC=C(C=C4)C5=CC(=CC=C5)F
ChEBI Ontology
Outgoing (1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3-(5-pyrimidinylmethyl)-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125006) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36468 LINCS
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