Standard InChI: InChI=1S/C26H23N7O2/c1-2-6-21(34)32-15-5-7-19(32)25-31-22(23-24(27)29-14-16-33(23)25)17-9-11-18(12-10-17)26(35)30-20-8-3-4-13-28-20/h3-4,8-14,16,19H,5,7,15H2,1H3,(H2,27,29)(H,28,30,35)/t19-/m0/s1 (Source: PubChem)

IUPAC Name: 4-[8-amino-3-[(2S)-1-but-2-ynoylpyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-pyridin-2-ylbenzamide (Source: PubChem)

PubChem CID: 71226662 (Source: PubChem)

SMILES String: CC#CC(=O)N1CCC[C@H]1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=N5 (Source: PubChem)

Connectivity SMILES string: CC#CC(=O)N1CCCC1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=N5 (Source: PubChem)

Standard InChIKey: WDENQIQQYWYTPO-IBGZPJMESA-N (Source: PubChem)

CAS Registry Number: 1420477-60-6 (Source: PubChem)

ChEBI ID: CHEBI:167707 (Source: PubChem)

ChEMBL ID: CHEMBL3707348 (Source: PubChem)

CompTox Dashboard Substance ID: DTXSID401026209 (Source: PubChem)

European Community Number: 814-272-0 (Source: PubChem)

Wikidata ID: Q23668732 (Source: PubChem)

CompTox Dashboard Compound ID: DTXCID401510462 (Source: PubChem)

WHO ATC Classification Drug Code: L01EL02 (Source: ChEMBL)

Connectivity SMILES string: CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)cc2)c2c(N)nccn12 (Source: ChEMBL)

International Nonproprietary Name: Acalabrutinib (Source: ChEMBL)

Japanese Adopted Name: Acalabrutinib (Source: ChEMBL)

Merck Index Name: Acalabrutinib (Source: ChEMBL)

Preferred Name: ACALABRUTINIB (Source: ChEMBL)

Standard InChI: InChI=1S/C26H23N7O2/c1-2-6-21(34)32-15-5-7-19(32)25-31-22(23-24(27)29-14-16-33(23)25)17-9-11-18(12-10-17)26(35)30-20-8-3-4-13-28-20/h3-4,8-14,16,19H,5,7,15H2,1H3,(H2,27,29)(H,28,30,35)/t19-/m0/s1 (Source: ChEMBL)

Standard InChIKey: WDENQIQQYWYTPO-IBGZPJMESA-N (Source: ChEMBL)

US Adopted Name: Acalabrutinib (Source: ChEMBL)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Thermodynamic parameters: 3 (Source: PubChem)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Mass parameters: 465.19132300 Da (Source: PubChem)

Molecule statistics: 35 (Source: PubChem)

Molecule statistics: 6 (Source: PubChem)

Molecule statistics: 2 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Surface parameters: 0 (Source: PubChem)

Stuctural analysis: 845 (Source: PubChem)

Stuctural analysis: 359.4 (Source: PubChem)

Mass parameters: 465.5 g/mol (Source: PubChem)

Mass parameters: 465.19132300 Da (Source: PubChem)

Molecule statistics: 4 (Source: PubChem)

Surface parameters: 119 Ų (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Thermodynamic parameters: 4 (Source: ChEMBL)

Thermodynamic parameters: 3.31 (Source: ChEMBL)

Molecule statistics: 35 (Source: ChEMBL)

Molecule statistics: 7 (Source: ChEMBL)

Molecule statistics: 2 (Source: ChEMBL)

Mass parameters: 465.52 g/mol (Source: ChEMBL)

Mass parameters: 465.52 g/mol (Source: ChEMBL)

Molecule statistics: -0.95 (Source: ChEMBL)

Molecule statistics: 118.51 (Source: ChEMBL)

Molecule statistics: 0.45 (Source: ChEMBL)

Molecule statistics: 4 (Source: ChEMBL)

Chemical formula: C26H23N7O2 (Source: PubChem)

Chirality: 1 (Source: ChEMBL)

Chemical formula: C26H23N7O2 (Source: ChEMBL)

Molecule type: Small molecule (Source: ChEMBL)

Natural product: 1 (Source: ChEMBL)

Passes the rule of three : N (Source: ChEMBL)

USAN STEM Defintion: tyrosine kinase inhibitors: tyrosine kinase inhibitors Bruton's (Btk) inhibitors (Source: ChEMBL)

USAN STEM: -tinib (Source: ChEMBL)