IBD Research Resource Center

BioID	bio200549
Name	BIMIRALISIB
ChEMBL ID	CHEMBL4084907
Molecular Formula	C17H20F3N7O2
Molecular Weight	411.39
Molecular Weight (Monoisotopic)	411.1631
Type	Small molecule
Max Phase	Phase 2
Target ID	Tar81
Target Name	None
Synonyms	BIMIRALISIB\|NC-B5\|NCB5\|PI3K-IN-2\|PQR-309\|PQR309
Smiles	Nc1cc(C(F)(F)F)c(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cn1
Inchi	InChI=1S/C17H20F3N7O2/c18-17(19,20)12-9-13(21)22-10-11(12)14-23-15(26-1-5-28-6-2-26)25-16(24-14)27-3-7-29-8-4-27/h9-10H,1-8H2,(H2,21,22)
Inchi Key	ADGGYDAFIHSYFI-UHFFFAOYSA-N
Molecular Species	NEUTRAL
Targets	34.0
Bioactivities	141.0
Np Likeness Score	-0.87
Records Key	['BIMIRALISIB', 'BIMIRALISIB', 'BIMIRALISIB', 'PQR309; 1', '5; PQR309', 'COVC-1223403929', 'Bimiralisib', '1; PQR309', 'Bimiralisib', '1; PQR309', 'PQR309; 9', '7; PQR309', 'Bimiralisib', '1; PQR309', 'PQR309']
Records Name	['BIMIRALISIB', 'BIMIRALISIB', 'BIMIRALISIB', '5-[4,6-Bis(morpholin-4-yl)-1,3,5-triazin-2-yl]-4-(trifluoromethyl)-pyridin-2-amine', 'Bimiralisib', 'BIMIRALISIB', 'Bimiralisib', '5-(4,6-dimorpholino-1,3,5-triazin-2-yl)-4-(trifluoromethyl)pyridin-2-amine', 'Bimiralisib', 'Bimiralisib; 5-(4,6-Dimorpholino-1,3,5-triazin-2-yl)-4-(trifluoromethyl)-pyridin-2-amine', 'Bimiralisib', 'Bimiralisib', 'Bimiralisib', 'Bimiralisib', 'Bimiralisib']
Withdrawn Flag	False
Orphan	0